WorldWideScience

Sample records for carlo study shows

  1. Monte Carlo studies of ZEPLIN III

    CERN Document Server

    Dawson, J; Davidge, D C R; Gillespie, J R; Howard, A S; Jones, W G; Joshi, M; Lebedenko, V N; Sumner, T J; Quenby, J J

    2002-01-01

    A Monte Carlo simulation of a two-phase xenon dark matter detector, ZEPLIN III, has been achieved. Results from the analysis of a simulated data set are presented, showing primary and secondary signal distributions from low energy gamma ray events.

  2. FACTORES INDIVIDUALES, FAMILIARES Y SOCIALES ASOCIADOS AL EMBARAZO EN ADOLESCENTES EN EL CENTRO DE SALUD CARLOS SHOWING FERRARI 2014 - 2015

    OpenAIRE

    Luyo Marcellini, Delci Fiorella

    2017-01-01

    OBJETIVO: Determinar los factores individuales, familiares y sociales asociados al embarazo en adolescentes en el Centro de Salud Carlos Showing Ferrari del periodo de enero del 2014 a diciembre del 2015. METODOS Y TECNICA: El estudio fue observacional, longitudinal, retrospectivo. Con un diseño caso y control. La técnica utilizada fue el fichaje en base a la recolección de datos de fuentes secundarias. RESULTADOS: Dentro de los Factores individuales de riesgo asociados al embarazo en ...

  3. Study of TXRF experimental system by Monte Carlo simulation

    International Nuclear Information System (INIS)

    Costa, Ana Cristina M.; Leitao, Roberta G.; Lopes, Ricardo T.; Anjos, Marcelino J.; Conti, Claudio C.

    2011-01-01

    The Total-Reflection X-ray Fluorescence (TXRF) technique offers unique possibilities to study the concentrations of a wide range of trace elements in various types of samples. Besides that, the TXRF technique is widely used to study the trace elements in biological, medical and environmental samples due to its multielemental character as well as simplicity of sample preparation and quantification methods used. In general the TXRF experimental setup is not simple and might require substantial experimental efforts. On the other hand, in recent years, experimental TXRF portable systems have been developed. It has motivated us to develop our own TXRF portable system. In this work we presented a first step in order to optimize a TXRF experimental setup using Monte Carlo simulation by MCNP code. The results found show that the Monte Carlo simulation method can be used to investigate the development of a TXRF experimental system before its assembly. (author)

  4. Temperature variance study in Monte-Carlo photon transport theory

    International Nuclear Information System (INIS)

    Giorla, J.

    1985-10-01

    We study different Monte-Carlo methods for solving radiative transfer problems, and particularly Fleck's Monte-Carlo method. We first give the different time-discretization schemes and the corresponding stability criteria. Then we write the temperature variance as a function of the variances of temperature and absorbed energy at the previous time step. Finally we obtain some stability criteria for the Monte-Carlo method in the stationary case [fr

  5. Monte Carlo Transverse Emittance Study on Cs2Te

    CERN Document Server

    Banfi, F; Galimberti, P G; Giannetti, C; Pagliara, S; Parmigiani, F; Pedersoli, E

    2005-01-01

    A Monte Carlo study of electron transport in Cs2Te films is performed to investigate the transverse emittance epsilon at the cathode surface. We find the photoemitted electron angular distribution and explain the physical mechanism involved in the process, a mechanism hindered by the statistical nature of the Monte Carlo method. The effects of electron-phonon scattering are discussed. The transverse emittance is calculated for different radiation wavelengths and a laser spot size of 1.5*10(-3) m. For a laser radiation at 265 nm we find epsilon = 0.56 mm-mrad. The dependence of epsilon and the quantum yield on the electron affinity Ea is also investigated. The data shows the importance of aging/contamination on the material.

  6. Monte Carlo studies of uranium calorimetry

    International Nuclear Information System (INIS)

    Brau, J.; Hargis, H.J.; Gabriel, T.A.; Bishop, B.L.

    1985-01-01

    Detailed Monte Carlo calculations of uranium calorimetry are presented which reveal a significant difference in the responses of liquid argon and plastic scintillator in uranium calorimeters. Due to saturation effects, neutrons from the uranium are found to contribute only weakly to the liquid argon signal. Electromagnetic sampling inefficiencies are significant and contribute substantially to compensation in both systems. 17 references

  7. Monte Carlo study of the multiquark systems

    International Nuclear Information System (INIS)

    Kerbikov, B.O.; Polikarpov, M.I.; Zamolodchikov, A.B.

    1986-01-01

    Random walks have been used to calculate the energies of the ground states in systems of N=3, 6, 9, 12 quarks. Multiquark states with N>3 are unstable with respect to the spontaneous dissociation into color singlet hadrons. The modified Green's function Monte Carlo algorithm which proved to be more simple and much accurate than the conventional few body methods have been employed. In contrast to other techniques, the same equations are used for any number of particles, while the computer time increases only linearly V, S the number of particles

  8. Studies of Monte Carlo Modelling of Jets at ATLAS

    CERN Document Server

    Kar, Deepak; The ATLAS collaboration

    2017-01-01

    The predictions of different Monte Carlo generators for QCD jet production, both in multijets and for jets produced in association with other objects, are presented. Recent improvements in showering Monte Carlos provide new tools for assessing systematic uncertainties associated with these jets.  Studies of the dependence of physical observables on the choice of shower tune parameters and new prescriptions for assessing systematic uncertainties associated with the choice of shower model and tune are presented.

  9. Study of the Transition Flow Regime using Monte Carlo Methods

    Science.gov (United States)

    Hassan, H. A.

    1999-01-01

    This NASA Cooperative Agreement presents a study of the Transition Flow Regime Using Monte Carlo Methods. The topics included in this final report are: 1) New Direct Simulation Monte Carlo (DSMC) procedures; 2) The DS3W and DS2A Programs; 3) Papers presented; 4) Miscellaneous Applications and Program Modifications; 5) Solution of Transitional Wake Flows at Mach 10; and 6) Turbulence Modeling of Shock-Dominated Fows with a k-Enstrophy Formulation.

  10. Variational Monte Carlo study of pentaquark states

    Energy Technology Data Exchange (ETDEWEB)

    Mark W. Paris

    2005-07-01

    Accurate numerical solution of the five-body Schrodinger equation is effected via variational Monte Carlo. The spectrum is assumed to exhibit a narrow resonance with strangeness S=+1. A fully antisymmetrized and pair-correlated five-quark wave function is obtained for the assumed non-relativistic Hamiltonian which has spin, isospin, and color dependent pair interactions and many-body confining terms which are fixed by the non-exotic spectra. Gauge field dynamics are modeled via flux tube exchange factors. The energy determined for the ground states with J=1/2 and negative (positive) parity is 2.22 GeV (2.50 GeV). A lower energy negative parity state is consistent with recent lattice results. The short-range structure of the state is analyzed via its diquark content.

  11. A study of Monte Carlo radiative transfer through fractal clouds

    Energy Technology Data Exchange (ETDEWEB)

    Gautier, C.; Lavallec, D.; O`Hirok, W.; Ricchiazzi, P. [Univ. of California, Santa Barbara, CA (United States)] [and others

    1996-04-01

    An understanding of radiation transport (RT) through clouds is fundamental to studies of the earth`s radiation budget and climate dynamics. The transmission through horizontally homogeneous clouds has been studied thoroughly using accurate, discreet ordinates radiative transfer models. However, the applicability of these results to general problems of global radiation budget is limited by the plane parallel assumption and the fact that real clouds fields show variability, both vertically and horizontally, on all size scales. To understand how radiation interacts with realistic clouds, we have used a Monte Carlo radiative transfer model to compute the details of the photon-cloud interaction on synthetic cloud fields. Synthetic cloud fields, generated by a cascade model, reproduce the scaling behavior, as well as the cloud variability observed and estimated from cloud satellite data.

  12. Higgs boson events and background lep. A Monte Carlo study

    International Nuclear Information System (INIS)

    Ekspong, G.; Hultqvist, K.

    1982-06-01

    Higgs boson production at LEP using e+ e- to Z 0 to H 0 + e+ e- has been studied by Monte Carlo generation of events with realistic errors of measurement added. The results show the recoil mass (Higgs boson mass) resolution to be reasonably good for boson masses bigger than 5 Ge V. The events are found to populate a phase space region free of physical background for all boson masses below about 35 GeV. For masses above 40 GeV the Higgs boson signal merges with the physical background produced by semileptonic decays of heavy flavour quarks while diminishing in strength to low levels. The geometrical acceptance of a detector like DELPHI is about 80 per cent for Higgs boson events. (Author)

  13. Magnetic properties of checkerboard lattice: a Monte Carlo study

    Science.gov (United States)

    Jabar, A.; Masrour, R.; Hamedoun, M.; Benyoussef, A.

    2017-12-01

    The magnetic properties of ferrimagnetic mixed-spin Ising model in the checkerboard lattice are studied using Monte Carlo simulations. The variation of total magnetization and magnetic susceptibility with the crystal field has been established. We have obtained a transition from an order to a disordered phase in some critical value of the physical variables. The reduced transition temperature is obtained for different exchange interactions. The magnetic hysteresis cycles have been established. The multiples hysteresis cycle in checkerboard lattice are obtained. The multiples hysteresis cycle have been established. The ferrimagnetic mixed-spin Ising model in checkerboard lattice is very interesting from the experimental point of view. The mixed spins system have many technological applications such as in domain opto-electronics, memory, nanomedicine and nano-biological systems. The obtained results show that that crystal field induce long-range spin-spin correlations even bellow the reduced transition temperature.

  14. Monte Carlo studies of high-transverse-energy hadronic interactions

    International Nuclear Information System (INIS)

    Corcoran, M.D.

    1985-01-01

    A four-jet Monte Carlo calculation has been used to simulate hadron-hadron interactions which deposit high transverse energy into a large-solid-angle calorimeter and limited solid-angle regions of the calorimeter. The calculation uses first-order QCD cross sections to generate two scattered jets and also produces beam and target jets. Field-Feynman fragmentation has been used in the hadronization. The sensitivity of the results to a few features of the Monte Carlo program has been studied. The results are found to be very sensitive to the method used to ensure overall energy conservation after the fragmentation of the four jets is complete. Results are also sensitive to the minimum momentum transfer in the QCD subprocesses and to the distribution of p/sub T/ to the jet axis and the multiplicities in the fragmentation. With reasonable choices of these features of the Monte Carlo program, good agreement with data at Fermilab/CERN SPS energies is obtained, comparable to the agreement achieved with more sophisticated parton-shower models. With other choices, however, the calculation gives qualitatively different results which are in strong disagreement with the data. These results have important implications for extracting physics conclusions from Monte Carlo calculations. It is not possible to test the validity of a particular model or distinguish between different models unless the Monte Carlo results are unambiguous and different models exhibit clearly different behavior

  15. Study on random number generator in Monte Carlo code

    International Nuclear Information System (INIS)

    Oya, Kentaro; Kitada, Takanori; Tanaka, Shinichi

    2011-01-01

    The Monte Carlo code uses a sequence of pseudo-random numbers with a random number generator (RNG) to simulate particle histories. A pseudo-random number has its own period depending on its generation method and the period is desired to be long enough not to exceed the period during one Monte Carlo calculation to ensure the correctness especially for a standard deviation of results. The linear congruential generator (LCG) is widely used as Monte Carlo RNG and the period of LCG is not so long by considering the increasing rate of simulation histories in a Monte Carlo calculation according to the remarkable enhancement of computer performance. Recently, many kinds of RNG have been developed and some of their features are better than those of LCG. In this study, we investigate the appropriate RNG in a Monte Carlo code as an alternative to LCG especially for the case of enormous histories. It is found that xorshift has desirable features compared with LCG, and xorshift has a larger period, a comparable speed to generate random numbers, a better randomness, and good applicability to parallel calculation. (author)

  16. Monte Carlo studies of domain growth in two dimensions

    International Nuclear Information System (INIS)

    Yaldram, K.; Ahsan Khan, M.

    1983-07-01

    Monte Carlo simulations have been carried out to study the effect of temperature on the kinetics of domain growth. The concept of ''spatial entropy'' is introduced. It is shown that ''spatial entropy'' of the domain can be used to give a measure of the roughening of the domain. Most of the roughening is achieved during the initial time (t< or approx. 10 Monte Carlo cycles), the rate of roughening being greater for higher temperatures. For later times the roughening of the domain for different temperatures proceeds at essentially the same rate. (author)

  17. Grain-boundary melting: A Monte Carlo study

    DEFF Research Database (Denmark)

    Besold, Gerhard; Mouritsen, Ole G.

    1994-01-01

    Grain-boundary melting in a lattice-gas model of a bicrystal is studied by Monte Carlo simulation using the grand canonical ensemble. Well below the bulk melting temperature T(m), a disordered liquidlike layer gradually emerges at the grain boundary. Complete interfacial wetting can be observed...... when the temperature approaches T(m) from below. Monte Carlo data over an extended temperature range indicate a logarithmic divergence w(T) approximately - ln(T(m)-T) of the width of the disordered layer w, in agreement with mean-field theory....

  18. A Monte Carlo simulation study of associated liquid crystals

    Science.gov (United States)

    Berardi, R.; Fehervari, M.; Zannoni, C.

    We have performed a Monte Carlo simulation study of a system of ellipsoidal particles with donor-acceptor sites modelling complementary hydrogen-bonding groups in real molecules. We have considered elongated Gay-Berne particles with terminal interaction sites allowing particles to associate and form dimers. The changes in the phase transitions and in the molecular organization and the interplay between orientational ordering and dimer formation are discussed. Particle flip and dimer moves have been used to increase the convergency rate of the Monte Carlo (MC) Markov chain.

  19. Gestión y manejo de los residuos sólidos hospitalarios en el Centro de Salud Carlos Showing Ferrari, 2015

    OpenAIRE

    Mendoza Herrera, Francisca

    2016-01-01

    Objetivo. Determinar la relación entre la gestión y el manejo de los residuos sólidos hospitalarios en el Centro de Salud “Carlos Showing Ferrari” durante el año 2015. Metodología. Fue un estudio de tipo transversal, analítico, prospectivo y observacional, con diseño correlacional. La población lo conformaron los servicios asistenciales del Centro de Salud Carlos Showing. Se aplicó una ficha de observación de la gestión y manejo de residuos sólidos hospitalarios. El an...

  20. Monte Carlo Based Framework to Support HAZOP Study

    DEFF Research Database (Denmark)

    Danko, Matej; Frutiger, Jerome; Jelemenský, Ľudovít

    2017-01-01

    deviations in process parameters simultaneously, thereby bringing an improvement to the Hazard and Operability study (HAZOP), which normally considers only one at a time deviation in process parameters. Furthermore, Monte Carlo filtering was then used to identify operability and hazard issues including...

  1. Theoretical and practical study of the variance and efficiency of a Monte Carlo calculation due to Russian roulette

    International Nuclear Information System (INIS)

    Hoogenboom, J. E.

    2004-01-01

    Although Russian roulette is applied very often in Monte Carlo calculations, not much literature exists on its quantitative influence on the variance and efficiency of a Monte Carlo calculation. Elaborating on the work of Lux and Koblinger using moment equations, new relevant equations are derived to calculate the variance of a Monte Carlo simulation using Russian roulette. To demonstrate its practical application the theory is applied to a simplified transport model resulting in explicit analytical expressions for the variance of a Monte Carlo calculation and for the expected number of collisions per history. From these expressions numerical results are shown and compared with actual Monte Carlo calculations, showing an excellent agreement. By considering the number of collisions in a Monte Carlo calculation as a measure of the CPU time, also the efficiency of the Russian roulette can be studied. It opens the way for further investigations, including optimization of Russian roulette parameters. (authors)

  2. Monte Carlo numerical study of lattice field theories

    International Nuclear Information System (INIS)

    Gan Cheekwan; Kim Seyong; Ohta, Shigemi

    1997-01-01

    The authors are interested in the exact first-principle calculations of quantum field theories which are indeed exact ones. For quantum chromodynamics (QCD) at low energy scale, a nonperturbation method is needed, and the only known such method is the lattice method. The path integral can be evaluated by putting a system on a finite 4-dimensional volume and discretizing space time continuum into finite points, lattice. The continuum limit is taken by making the lattice infinitely fine. For evaluating such a finite-dimensional integral, the Monte Carlo numerical estimation of the path integral can be obtained. The calculation of light hadron mass in quenched lattice QCD with staggered quarks, 3-dimensional Thirring model calculation and the development of self-test Monte Carlo method have been carried out by using the RIKEN supercomputer. The motivation of this study, lattice QCD formulation, continuum limit, Monte Carlo update, hadron propagator, light hadron mass, auto-correlation and source size dependence are described on lattice QCD. The phase structure of the 3-dimensional Thirring model for a small 8 3 lattice has been mapped. The discussion on self-test Monte Carlo method is described again. (K.I.)

  3. Monte Carlo parameter studies and uncertainty analyses with MCNP5

    International Nuclear Information System (INIS)

    Brown, F. B.; Sweezy, J. E.; Hayes, R.

    2004-01-01

    A software tool called mcnp p study has been developed to automate the setup, execution, and collection of results from a series of MCNP5 Monte Carlo calculations. This tool provides a convenient means of performing parameter studies, total uncertainty analyses, parallel job execution on clusters, stochastic geometry modeling, and other types of calculations where a series of MCNP5 jobs must be performed with varying problem input specifications. (authors)

  4. Anybody can do Value at Risk: A Teaching Study using Parametric Computation and Monte Carlo Simulation

    Directory of Open Access Journals (Sweden)

    Yun Hsing Cheung

    2012-12-01

    Full Text Available The three main Value at Risk (VaR methodologies are historical, parametric and Monte Carlo Simulation.Cheung & Powell (2012, using a step-by-step teaching study, showed how a nonparametric historical VaRmodel could be constructed using Excel, thus benefitting teachers and researchers by providing them with areadily useable teaching study and an inexpensive and flexible VaR modelling option. This article extends thatwork by demonstrating how parametric and Monte Carlo Simulation VaR models can also be constructed inExcel, thus providing a total Excel modelling package encompassing all three VaR methods.

  5. Monte Carlo study of neutrino acceleration in supernova shocks

    International Nuclear Information System (INIS)

    Kazanas, Demosthenes; Ellison, D.C.; National Aeronautics and Space Administration, Greenbelt, MD

    1981-01-01

    The first order Fermi acceleration mechanism of cosmic rays in shocks may be at work for neutrinos in supernova shocks when the latter are at densities rho>10 13 g cm -3 at which the core material is opaque to neutrinos. A Monte Carlo approach to study this effect is employed and the emerging neutrino power law spectra are presented. The increased energy acquired by the neutrinos may facilitate their detection in supernova explosions and provide information about the physics of collapse

  6. A study of certain Monte Carlo search and optimisation methods

    International Nuclear Information System (INIS)

    Budd, C.

    1984-11-01

    Studies are described which might lead to the development of a search and optimisation facility for the Monte Carlo criticality code MONK. The facility envisaged could be used to maximise a function of k-effective with respect to certain parameters of the system or, alternatively, to find the system (in a given range of systems) for which that function takes a given value. (UK)

  7. Results of Monte-Carlo studies on backscattering and sputtering from 'pocket' and 'finned' structures

    International Nuclear Information System (INIS)

    Brown, K.P.

    1978-01-01

    A Monte-Carlo computer program which has been developed for studying backscattering and sputtering processes involving high energy particles in complex vacuum structures has been used to show that useful reductions in backscattering and sputtering can be achieved by pocketing or finning the wall surfaces of plasma containment vessels. (author)

  8. Solar Feasibility Study May 2013 - San Carlos Apache Tribe

    Energy Technology Data Exchange (ETDEWEB)

    Rapp, Jim [Parametrix; Duncan, Ken [San Carlos Apache Tribe; Albert, Steve [Parametrix

    2013-05-01

    The San Carlos Apache Tribe (Tribe) in the interests of strengthening tribal sovereignty, becoming more energy self-sufficient, and providing improved services and economic opportunities to tribal members and San Carlos Apache Reservation (Reservation) residents and businesses, has explored a variety of options for renewable energy development. The development of renewable energy technologies and generation is consistent with the Tribe’s 2011 Strategic Plan. This Study assessed the possibilities for both commercial-scale and community-scale solar development within the southwestern portions of the Reservation around the communities of San Carlos, Peridot, and Cutter, and in the southeastern Reservation around the community of Bylas. Based on the lack of any commercial-scale electric power transmission between the Reservation and the regional transmission grid, Phase 2 of this Study greatly expanded consideration of community-scale options. Three smaller sites (Point of Pines, Dudleyville/Winkleman, and Seneca Lake) were also evaluated for community-scale solar potential. Three building complexes were identified within the Reservation where the development of site-specific facility-scale solar power would be the most beneficial and cost-effective: Apache Gold Casino/Resort, Tribal College/Skill Center, and the Dudleyville (Winkleman) Casino.

  9. Studying the information content of TMDs using Monte Carlo generators

    Energy Technology Data Exchange (ETDEWEB)

    Avakian, H. [Thomas Jefferson National Accelerator Facility (TJNAF), Newport News, VA (United States); Matevosyan, H. [The Univ. of Adelaide, Adelaide (Australia); Pasquini, B. [Univ. of Pavia, Pavia (Italy); Schweitzer, P. [Univ. of Connecticut, Storrs, CT (United States)

    2015-02-05

    Theoretical advances in studies of the nucleon structure have been spurred by recent measurements of spin and/or azimuthal asymmetries worldwide. One of the main challenges still remaining is the extraction of the parton distribution functions, generalized to describe transverse momentum and spatial distributions of partons from these observables with no or minimal model dependence. In this topical review we present the latest developments in the field with emphasis on requirements for Monte Carlo event generators, indispensable for studies of the complex 3D nucleon structure, and discuss examples of possible applications.

  10. A Monte Carlo study of radiation trapping effects

    International Nuclear Information System (INIS)

    Wang, J.B.; Williams, J.F.; Carter, C.J.

    1997-01-01

    A Monte Carlo simulation of radiative transfer in an atomic beam is carried out to investigate the effects of radiation trapping on electron-atom collision experiments. The collisionally excited atom is represented by a simple electric dipole, for which the emission intensity distribution is well known. The spatial distribution, frequency and free path of this and the sequential dipoles were determined by a computer random generator according to the probabilities given by quantum theory. By altering the atomic number density at the target site, the pressure dependence of the observed atomic lifetime, the angular intensity distribution and polarisation of the radiation field is studied. 7 refs., 5 figs

  11. Shell-model Monte Carlo studies of nuclei

    International Nuclear Information System (INIS)

    Dean, D.J.

    1997-01-01

    The pair content and structure of nuclei near N = Z are described in the frwnework of shell-model Monte Carlo (SMMC) calculations. Results include the enhancement of J=0 T=1 proton-neutron pairing at N=Z nuclei, and the maxked difference of thermal properties between even-even and odd-odd N=Z nuclei. Additionally, a study of the rotational properties of the T=1 (ground state), and T=0 band mixing seen in 74 Rb is presented

  12. Monte Carlo study of quantum number retention in hadron jets

    International Nuclear Information System (INIS)

    Hayward, S.K.; Weiss, N.

    1992-01-01

    We present a Monte Carlo study in which we used weighted quantum numbers of hadron jets in an attempt to identify the parent parton of these jets. Two-jet events produced by e + e- annihilation were studied using the Lund Monte Carlo program. It was found that the sign of the charge of the leading parton could be determined in a majority of events and that the quark jet could be distinguished from the antiquark jet in a majority of events containing baryons. A careful selection of a subset of the events by making cuts on the value of these weighted quantum numbers increased significantly the accuracy with which both the charge and the baryon number of the leading parton could be determined. Some success was also made in differentiating light-quark from heavy-quark events and in determining the leading quark flavor in the light-quark events. Unfortunately quantum number retention does not differentiate gluon jets from quark jets. The consequences of this for three-jet events and for jet identification in other reactions is discussed

  13. Monte Carlo Simulations Validation Study: Vascular Brachytherapy Beta Sources

    International Nuclear Information System (INIS)

    Orion, I.; Koren, K.

    2004-01-01

    During the last decade many versions of angioplasty irradiation treatments have been proposed. The purpose of this unique brachytherapy is to administer a sufficient radiation dose into the vein walls in order to prevent restonosis, a clinical sequel to balloon angioplasty. The most suitable sources for this vascular brachytherapy are the β - emitters such as Re-188, P-32, and Sr-90/Y-90, with a maximum energy range of up to 2.1 MeV [1,2,3]. The radioactive catheters configurations offered for these treatments can be a simple wire [4], a fluid filled balloon or a coated stent. Each source is differently positioned inside the blood vessel, and the emitted electrons ranges therefore vary. Many types of sources and configurations were studied either experimentally or with the use of the Monte Carlo calculation technique, while most of the Monte Carlo simulations were carried out using EGS4 [5] or MCNP [6]. In this study we compared the beta-source absorbed-dose versus radial-distance of two treatment configurations using MCNP and EGS4 simulations. This comparison was aimed to discover the differences between the MCNP and the EGS4 simulation code systems in intermediate energies electron transport

  14. Monte Carlo simulations and dosimetric studies of an irradiation facility

    Energy Technology Data Exchange (ETDEWEB)

    Belchior, A. [Instituto Tecnologico e Nuclear, Estrada nacional no. 10, Apartado 21, 2686-953 Sacavem (Portugal)], E-mail: anabelchior@itn.pt; Botelho, M.L; Vaz, P. [Instituto Tecnologico e Nuclear, Estrada nacional no. 10, Apartado 21, 2686-953 Sacavem (Portugal)

    2007-09-21

    There is an increasing utilization of ionizing radiation for industrial applications. Additionally, the radiation technology offers a variety of advantages in areas, such as sterilization and food preservation. For these applications, dosimetric tests are of crucial importance in order to assess the dose distribution throughout the sample being irradiated. The use of Monte Carlo methods and computational tools in support of the assessment of the dose distributions in irradiation facilities can prove to be economically effective, representing savings in the utilization of dosemeters, among other benefits. One of the purposes of this study is the development of a Monte Carlo simulation, using a state-of-the-art computational tool-MCNPX-in order to determine the dose distribution inside an irradiation facility of Cobalt 60. This irradiation facility is currently in operation at the ITN campus and will feature an automation and robotics component, which will allow its remote utilization by an external user, under REEQ/996/BIO/2005 project. The detailed geometrical description of the irradiation facility has been implemented in MCNPX, which features an accurate and full simulation of the electron-photon processes involved. The validation of the simulation results obtained was performed by chemical dosimetry methods, namely a Fricke solution. The Fricke dosimeter is a standard dosimeter and is widely used in radiation processing for calibration purposes.

  15. BOMAB phantom manufacturing quality assurance study using Monte Carlo computations

    International Nuclear Information System (INIS)

    Mallett, M.W.

    1994-01-01

    Monte Carlo calculations have been performed to assess the importance of and quantify quality assurance protocols in the manufacturing of the Bottle-Manikin-Absorption (BOMAB) phantom for calibrating in vivo measurement systems. The parameters characterizing the BOMAB phantom that were examined included height, fill volume, fill material density, wall thickness, and source concentration. Transport simulation was performed for monoenergetic photon sources of 0.200, 0.662, and 1,460 MeV. A linear response was observed in the photon current exiting the exterior surface of the BOMAB phantom due to variations in these parameters. Sensitivity studies were also performed for an in vivo system in operation at the Pacific Northwest Laboratories in Richland, WA. Variations in detector current for this in vivo system are reported for changes in the BOMAB phantom parameters studied here. Physical justifications for the observed results are also discussed

  16. A 3D particle Monte Carlo approach to studying nucleation

    DEFF Research Database (Denmark)

    Köhn, Christoph; Bødker Enghoff, Martin; Svensmark, Henrik

    2018-01-01

    The nucleation of sulphuric acid molecules plays a key role in the formation of aerosols. We here present a three dimensional particle Monte Carlo model to study the growth of sulphuric acid clusters as well as its dependence on the ambient temperature and the initial particle density. We initiate...... a swarm of sulphuric acid–water clusters with a size of 0.329 nm with densities between 107 and and 108 cm-3 at temperatures between 200 and 300 K and a relative humidity of 50%. After every time step, we update the position of particles as a function of size-dependent diffusion coefficients. If two...... particles encounter, we merge them and add their volumes and masses. Inversely, we check after every time step whether a polymer evaporates liberating a molecule. We present the spatial distribution as well as the size distribution calculated from individual clusters. We also calculate the nucleation rate...

  17. Monte Carlo study of double exchange interaction in manganese oxide

    Energy Technology Data Exchange (ETDEWEB)

    Naa, Christian Fredy, E-mail: chris@cphys.fi.itb.ac.id [Physics Department, Faculty of Mathematics and Natural Science, Institut Teknologi Bandung, Jalan Ganesha 10 Bandung (Indonesia); Unité de Dynamique et Structure des Matérioux Moléculaires, Université Littoral Côte d’Opale, Maison de la Reserche Blaise Pascal 50, rue Ferdinand Buisson, Calais, France email (France); Suprijadi,, E-mail: supri@fi.itb.ac.id; Viridi, Sparisoma, E-mail: dudung@fi.itb.ac.id; Djamal, Mitra, E-mail: mitra@fi.itb.ac.id [Physics Department, Faculty of Mathematics and Natural Science, Institut Teknologi Bandung, Jalan Ganesha 10 Bandung (Indonesia); Fasquelle, Didier, E-mail: didier.fasquelle@univ-littoral.fr [Unité de Dynamique et Structure des Matérioux Moléculaires, Université Littoral Côte d’Opale, Maison de la Reserche Blaise Pascal 50, rue Ferdinand Buisson, Calais, France email (France)

    2015-09-30

    In this paper we study the magnetoresistance properties attributed by double exchange (DE) interaction in manganese oxide by Monte Carlo simulation. We construct a model based on mixed-valence Mn{sup 3+} and Mn{sup 4+} on the general system of Re{sub 2/3}Ae{sub 1/3}MnO{sub 3} in two dimensional system. The conduction mechanism is based on probability of e{sub g} electrons hopping from Mn{sup 3+} to Mn{sup 4+}. The resistivity dependence on temperature and the external magnetic field are presented and the validity with related experimental results are discussed. We use the resistivity power law to fit our data on metallic region and basic activated behavior on insulator region. On metallic region, we found our result agree well with the quantum theory of DE interaction. From general arguments, we found our simulation agree qualitatively with experimental results.

  18. Monte Carlo simulations and benchmark studies at CERN's accelerator chain

    CERN Document Server

    AUTHOR|(CDS)2083190; Brugger, Markus

    2016-01-01

    Mixed particle and energy radiation fields present at the Large Hadron Collider (LHC) and its accelerator chain are responsible for failures on electronic devices located in the vicinity of the accelerator beam lines. These radiation effects on electronics and, more generally, the overall radiation damage issues have a direct impact on component and system lifetimes, as well as on maintenance requirements and radiation exposure to personnel who have to intervene and fix existing faults. The radiation environments and respective radiation damage issues along the CERN’s accelerator chain were studied in the framework of the CERN Radiation to Electronics (R2E) project and are hereby presented. The important interplay between Monte Carlo simulations and radiation monitoring is also highlighted.

  19. Study of Gamma spectra by Monte Carlo simulation

    International Nuclear Information System (INIS)

    Cantaragiu, A.; Gheorghies, A.; Borcia, C.

    2008-01-01

    The purpose of this paper is obtaining gamma ray spectra by means of a scintillation detector applying the Monte Carlo statistic simulation method using the EGS4 program. The Monte Carlo algorithm implies that the physical system is described by the probability density function which allows generating random figures and the result is taken as an average of numbers which were observed. The EGS4 program allows the simulation of the following physical processes: the photo-electrical effect, the Compton effect, the electron positron pairs generation and the Rayleigh diffusion. The gamma rays recorded by the detector are converted into electrical pulses and the gamma ray spectra are acquired and processed by means of the Nomad Plus portable spectrometer connected to a computer. As a gamma ray sources 137Cs and 60Co are used whose spectra drawn and used for study the interaction of the gamma radiations with the scintillation detector. The parameters which varied during the acquisition of the gamma ray spectra are the distance between source and detector and the measuring time. Due to the statistical processes in the detector, the peak looks like a Gauss distribution. The identification of the gamma quantum energy value is achieved by the experimental spectra peaks, thus gathering information about the position of the peak, the width and the area of the peak respectively. By means of the EGS4 program a simulation is run using these parameters and an 'ideal' spectrum is obtained, a spectrum which is not influenced by the statistical processes which take place inside the detector. Then, the convolution of the spectra is achieved by means of a normalised Gauss function. There is a close match between the experimental results and those simulated in the EGS4 program because the interactions which occurred during the simulation have a statistical behaviour close to the real one. (authors)

  20. A Monte Carlo study on event-by-event transverse momentum fluctuation at RHIC

    International Nuclear Information System (INIS)

    Xu Mingmei

    2005-01-01

    The experimental observation on the multiplicity dependence of event-by-event transverse momentum fluctuation in relativistic heavy ion collisions is studied using Monte Carlo simulation. It is found that the Monte Carlo generator HIJING is unable to describe the experimental phenomenon well. A simple Monte Carlo model is proposed, which can recover the data and thus shed some light on the dynamical origin of the multiplicity dependence of event-by-event transverse momentum fluctuation. (authors)

  1. A 3D particle Monte Carlo approach to studying nucleation

    Science.gov (United States)

    Köhn, Christoph; Enghoff, Martin Bødker; Svensmark, Henrik

    2018-06-01

    The nucleation of sulphuric acid molecules plays a key role in the formation of aerosols. We here present a three dimensional particle Monte Carlo model to study the growth of sulphuric acid clusters as well as its dependence on the ambient temperature and the initial particle density. We initiate a swarm of sulphuric acid-water clusters with a size of 0.329 nm with densities between 107 and 108 cm-3 at temperatures between 200 and 300 K and a relative humidity of 50%. After every time step, we update the position of particles as a function of size-dependent diffusion coefficients. If two particles encounter, we merge them and add their volumes and masses. Inversely, we check after every time step whether a polymer evaporates liberating a molecule. We present the spatial distribution as well as the size distribution calculated from individual clusters. We also calculate the nucleation rate of clusters with a radius of 0.85 nm as a function of time, initial particle density and temperature. The nucleation rates obtained from the presented model agree well with experimentally obtained values and those of a numerical model which serves as a benchmark of our code. In contrast to previous nucleation models, we here present for the first time a code capable of tracing individual particles and thus of capturing the physics related to the discrete nature of particles.

  2. Monte Carlo simulations for generic granite repository studies

    Energy Technology Data Exchange (ETDEWEB)

    Chu, Shaoping [Los Alamos National Laboratory; Lee, Joon H [SNL; Wang, Yifeng [SNL

    2010-12-08

    In a collaborative study between Los Alamos National Laboratory (LANL) and Sandia National Laboratories (SNL) for the DOE-NE Office of Fuel Cycle Technologies Used Fuel Disposition (UFD) Campaign project, we have conducted preliminary system-level analyses to support the development of a long-term strategy for geologic disposal of high-level radioactive waste. A general modeling framework consisting of a near- and a far-field submodel for a granite GDSE was developed. A representative far-field transport model for a generic granite repository was merged with an integrated systems (GoldSim) near-field model. Integrated Monte Carlo model runs with the combined near- and farfield transport models were performed, and the parameter sensitivities were evaluated for the combined system. In addition, a sub-set of radionuclides that are potentially important to repository performance were identified and evaluated for a series of model runs. The analyses were conducted with different waste inventory scenarios. Analyses were also conducted for different repository radionuelide release scenarios. While the results to date are for a generic granite repository, the work establishes the method to be used in the future to provide guidance on the development of strategy for long-term disposal of high-level radioactive waste in a granite repository.

  3. Cohesion energetics of carbon allotropes: Quantum Monte Carlo study

    Energy Technology Data Exchange (ETDEWEB)

    Shin, Hyeondeok; Kang, Sinabro; Koo, Jahyun; Lee, Hoonkyung; Kwon, Yongkyung, E-mail: ykwon@konkuk.ac.kr [Division of Quantum Phases and Devices, School of Physics, Konkuk University, Seoul 143-701 (Korea, Republic of); Kim, Jeongnim, E-mail: jnkim@ornl.gov [Materials Science and Technology Division and Computer Science and Mathematics Division, Oak Ridge National Laboratory, Oak Ridge, Tennessee 37831 (United States)

    2014-03-21

    We have performed quantum Monte Carlo calculations to study the cohesion energetics of carbon allotropes, including sp{sup 3}-bonded diamond, sp{sup 2}-bonded graphene, sp–sp{sup 2} hybridized graphynes, and sp-bonded carbyne. The computed cohesive energies of diamond and graphene are found to be in excellent agreement with the corresponding values determined experimentally for diamond and graphite, respectively, when the zero-point energies, along with the interlayer binding in the case of graphite, are included. We have also found that the cohesive energy of graphyne decreases systematically as the ratio of sp-bonded carbon atoms increases. The cohesive energy of γ-graphyne, the most energetically stable graphyne, turns out to be 6.766(6) eV/atom, which is smaller than that of graphene by 0.698(12) eV/atom. Experimental difficulty in synthesizing graphynes could be explained by their significantly smaller cohesive energies. Finally, we conclude that the cohesive energy of a newly proposed graphyne can be accurately estimated with the carbon–carbon bond energies determined from the cohesive energies of graphene and three different graphynes considered here.

  4. Cohesion Energetics of Carbon Allotropes: Quantum Monte Carlo Study

    Energy Technology Data Exchange (ETDEWEB)

    Shin, Hyeondeok [Konkuk University, South Korea; Kang, Sinabro [Konkuk University, South Korea; Koo, Jahyun [Konkuk University, South Korea; Lee, Hoonkyung [Konkuk University, South Korea; Kim, Jeongnim [ORNL; Kwon, Yongkyung [Konkuk University, South Korea

    2014-01-01

    We have performed quantum Monte Carlo calculations to study the cohesion energetics of carbon allotropes, including sp3-bonded diamond, sp2-bonded graphene, sp-sp2 hybridized graphynes, and sp-bonded carbyne. The comput- ed cohesive energies of diamond and graphene are found to be in excellent agreement with the corresponding values de- termined experimentally for diamond and graphite, respectively, when the zero-point energies, along with the interlayer binding in the case of graphite, are included. We have also found that the cohesive energy of graphyne decreases system- atically as the ratio of sp-bonded carbon atoms increases. The cohesive energy of -graphyne, the most energetically- stable graphyne, turns out to be 6.766(6) eV/atom, which is smaller than that of graphene by 0.698(12) eV/atom. Experi- mental difficulty in synthesizing graphynes could be explained by their significantly smaller cohesive energies. Finally we conclude that the cohesive energy of a newly-proposed two-dimensional carbon network can be accurately estimated with the carbon-carbon bond energies determined from the cohesive energies of graphene and three different graphynes.

  5. Quantum Monte Carlo studies of superfluid Fermi gases

    International Nuclear Information System (INIS)

    Chang, S.Y.; Pandharipande, V.R.; Carlson, J.; Schmidt, K.E.

    2004-01-01

    We report results of quantum Monte Carlo calculations of the ground state of dilute Fermi gases with attractive short-range two-body interactions. The strength of the interaction is varied to study different pairing regimes which are characterized by the product of the s-wave scattering length and the Fermi wave vector, ak F . We report results for the ground-state energy, the pairing gap Δ, and the quasiparticle spectrum. In the weak-coupling regime, 1/ak F FG . When a>0, the interaction is strong enough to form bound molecules with energy E mol . For 1/ak F > or approx. 0.5, we find that weakly interacting composite bosons are formed in the superfluid gas with Δ and gas energy per particle approaching E mol /2. In this region, we seem to have Bose-Einstein condensation (BEC) of molecules. The behavior of the energy and the gap in the BCS-to-BEC transition region, -0.5 F <0.5, is discussed

  6. SU-E-J-144: Low Activity Studies of Carbon 11 Activation Via GATE Monte Carlo

    Energy Technology Data Exchange (ETDEWEB)

    Elmekawy, A; Ewell, L [Hampton University, Hampton, VA (United States); Butuceanu, C; Qu, L [Hampton University Proton Therapy Institute, Hampton, VA (United States)

    2015-06-15

    Purpose: To investigate the behavior of a Monte Carlo simulation code with low levels of activity (∼1,000Bq). Such activity levels are expected from phantoms and patients activated via a proton therapy beam. Methods: Three different ranges for a therapeutic proton radiation beam were examined in a Monte Carlo simulation code: 13.5, 17.0 and 21.0cm. For each range, the decay of an equivalent length{sup 11}C source and additional sources of length plus or minus one cm was studied in a benchmark PET simulation for activities of 1000, 2000 and 3000Bq. The ranges were chosen to coincide with a previous activation study, and the activities were chosen to coincide with the approximate level of isotope creation expected in a phantom or patient irradiated by a therapeutic proton beam. The GATE 7.0 simulation was completed on a cluster node, running Scientific Linux Carbon 6 (Red Hat©). The resulting Monte Carlo data were investigated with the ROOT (CERN) analysis tool. The half-life of{sup 11}C was extracted via a histogram fit to the number of simulated PET events vs. time. Results: The average slope of the deviation of the extracted carbon half life from the expected/nominal value vs. activity showed a generally positive value. This was unexpected, as the deviation should, in principal, decrease with increased activity and lower statistical uncertainty. Conclusion: For activity levels on the order of 1,000Bq, the behavior of a benchmark PET test was somewhat unexpected. It is important to be aware of the limitations of low activity PET images, and low activity Monte Carlo simulations. This work was funded in part by the Philips corporation.

  7. Monte Carlo study of MLC fields for cobalt therapy machine

    Directory of Open Access Journals (Sweden)

    Komanduri M Ayyangar

    2014-01-01

    Full Text Available An automated Multi-Leaf Collimator (MLC system has been developed as add-on for the cobalt-60 teletherapy machines available in India. The goal of the present computational study is to validate the MLC design using Monte Carlo (MC modeling. The study was based on the Kirloskar-supplied Phoenix model machines that closely match the Atomic Energy of Canada Limited (AECL theratron-80 machine. The MLC is a retrofit attachment to the collimator assembly, with 14 non-divergent leaf pairs of 40 mm thick, 7 mm wide, and 150 mm long tungsten alloy plates with rounded edges and 20 mm tongue and 2 mm groove in each leaf. In the present work, the source and collimator geometry has been investigated in detail to arrive at a model that best represents the measured dosimetric data. The authors have studied in detail the proto-I MLC built for cobalt-60. The MLC field sizes were MC simulated for 2 × 2 cm 2 to 14 × 14 cm 2 square fields as well as irregular fields, and the percent depth dose (PDD and profile data were compared with ROPS† treatment planning system (TPS. In addition, measured profiles using the IMATRIXX system‡ were also compared with the MC simulations. The proto-I MLC can define radiation fields up to 14 × 14 cm΂ within 3 mm accuracy. The maximum measured leakage through the leaf ends in closed condition was 3.4% and interleaf leakage observed was 7.3%. Good agreement between MC results, ROPS and IMATRIXX results has been observed. The investigation also supports the hypothesis that optical and radiation field coincidence exists for the square fields studied with the MLC. Plots of the percent depth dose (PDD data and profile data for clinically significant irregular fields have also been presented. The MC model was also investigated to speed up the calculations to allow calculations of clinically relevant conformal beams.

  8. A study on the shielding element using Monte Carlo simulation

    Energy Technology Data Exchange (ETDEWEB)

    Kim, Ki Jeong [Dept. of Radiology, Konkuk University Medical Center, Seoul (Korea, Republic of); Shim, Jae Goo [Dept. of Radiologic Technology, Daegu Health College, Daegu (Korea, Republic of)

    2017-06-15

    In this research, we simulated the elementary star shielding ability using Monte Carlo simulation to apply medical radiation shielding sheet which can replace existing lead. In the selection of elements, mainly elements and metal elements having a large atomic number, which are known to have high shielding performance, recently, various composite materials have improved shielding performance, so that weight reduction, processability, In consideration of activity etc., 21 elements were selected. The simulation tools were utilized Monte Carlo method. As a result of simulating the shielding performance by each element, it was estimated that the shielding ratio is the highest at 98.82% and 98.44% for tungsten and gold.

  9. A Monte Carlo Study of Levene's Test of Homogeneity of Variance: Empirical Frequencies of Type I Error in Normal Distributions.

    Science.gov (United States)

    Neel, John H.; Stallings, William M.

    An influential statistics test recommends a Levene text for homogeneity of variance. A recent note suggests that Levene's test is upwardly biased for small samples. Another report shows inflated Alpha estimates and low power. Neither study utilized more than two sample sizes. This Monte Carlo study involved sampling from a normal population for…

  10. Study of an extrapolation chamber in a standard diagnostic radiology beam by Monte Carlo simulation

    International Nuclear Information System (INIS)

    Vedovato, Uly Pita; Silva, Rayre Janaina Vieira; Neves, Lucio Pereira; Santos, William S.; Perini, Ana Paula; Belinato, Walmir

    2016-01-01

    In this work, we studied the influence of the components of an extrapolation ionization chamber in its response. This study was undertaken using the MCNP-5 Monte Carlo code, and the standard diagnostic radiology quality for direct beams (RQR5). Using tally F6 and 2.1 x 10"9 simulated histories, the results showed that the chamber design and material not alter significantly the energy deposited in its sensitive volume. The collecting electrode and support board were the components with more influence on the chamber response. (author)

  11. Monte Carlo studies of nuclei and quantum liquid drops

    International Nuclear Information System (INIS)

    Pandharipande, V.R.; Pieper, S.C.

    1989-01-01

    The progress in application of variational and Green's function Monte Carlo methods to nuclei is reviewed. The nature of single-particle orbitals in correlated quantum liquid drops is discussed, and it is suggested that the difference between quasi-particle and mean-field orbitals may be of importance in nuclear structure physics. 27 refs., 7 figs., 2 tabs

  12. Yet another Monte Carlo study of the Schwinger model

    International Nuclear Information System (INIS)

    Sogo, K.; Kimura, N.

    1986-01-01

    Some methodological improvements are introduced in the quantum Monte Carlo simulation of the 1 + 1 dimensional quantum electrodynamics (the Schwinger model). Properties at finite temperatures are investigated, concentrating on the existence of the chirality transition and of the deconfinement transition. (author)

  13. Monte Carlo studies of nuclei and quantum liquid drops

    Energy Technology Data Exchange (ETDEWEB)

    Pandharipande, V.R.; Pieper, S.C.

    1989-01-01

    The progress in application of variational and Green's function Monte Carlo methods to nuclei is reviewed. The nature of single-particle orbitals in correlated quantum liquid drops is discussed, and it is suggested that the difference between quasi-particle and mean-field orbitals may be of importance in nuclear structure physics. 27 refs., 7 figs., 2 tabs.

  14. Osmotic pressure of ring polymer solutions : A Monte Carlo study

    NARCIS (Netherlands)

    Flikkema, Edwin; Brinke, Gerrit ten

    2000-01-01

    Using the wall theorem, the osmotic pressure of ring polymers in solution has been determined using an off-lattice topology conserving Monte Carlo algorithm. The ring polymers are modeled as freely-jointed chains with point-like beads, i.e., under conditions corresponding to θ-conditions for the

  15. Yet another Monte Carlo study of the Schwinger model

    International Nuclear Information System (INIS)

    Sogo, K.; Kimura, N.

    1986-03-01

    Some methodological improvements are introduced in the quantum Monte Carlo simulation of the 1 + 1 dimensional quantum electrodynamics (the Schwinger model). Properties at finite temperatures are investigated, concentrating on the existence of the chirality transition and of the deconfinement transition. (author)

  16. Army Study Shows Decline In Behavioral Health Stigma

    Science.gov (United States)

    2012-01-01

    Army Study Shows Decline in Behavioral Health Stigma By Rob McIlvaine Army News Service WASHINGTON, Jan. 20, 2012 - A newly released Army study on...conference yesterday. The three-year study outlines the problem of suicide in the Army and related issues of substance abuse, spouse abuse and child abuse...REPORT TYPE 3. DATES COVERED 00-00-2012 to 00-00-2012 4. TITLE AND SUBTITLE Army Study Shows Decline In Behavioral Health Stigma 5a. CONTRACT

  17. Phase behaviour of heteronuclear dimers in three-dimensional systems-a Monte Carlo study

    International Nuclear Information System (INIS)

    Rzysko, W; Binder, K

    2008-01-01

    Monte Carlo simulation in the grand canonical ensemble, the histogram reweighting technique and finite size scaling are used to study the phase behaviour of dimers in three-dimensional systems. A single molecule is composed of two segments A and B, and the bond between them cannot be broken. The phase diagrams have been estimated for a set of model systems. Different structures formed by heteronuclear dimers have been found. The results show a great variety of vapour-liquid coexistence behaviour depending on the strength of the interactions between segments

  18. Monte Carlo Studies of Electron Transport In Semiconductor Nanostructures

    Science.gov (United States)

    Tierney, Brian David

    An Ensemble Monte Carlo (EMC) computer code has been developed to simulate, semi-classically, spin-dependent electron transport in quasi two-dimensional (2D) III-V semiconductors. The code accounts for both three-dimensional (3D) and quasi-2D transport, utilizing either 3D or 2D scattering mechanisms, as appropriate. Phonon, alloy, interface roughness, and impurity scattering mechanisms are included, accounting for the Pauli Exclusion Principle via a rejection algorithm. The 2D carrier states are calculated via a self-consistent 1D Schrodinger-3D-Poisson solution in which the charge distribution of the 2D carriers in the quantization direction is taken as the spatial distribution of the squared envelope functions within the Hartree approximation. The wavefunctions, subband energies, and 2D scattering rates are updated periodically by solving a series of 1D Schrodinger wave equations (SWE) over the real-space domain of the device at fixed time intervals. The electrostatic potential is updated by periodically solving the 3D Poisson equation. Spin-polarized transport is modeled via a spin density-matrix formalism that accounts for D'yakanov-Perel (DP) scattering. Also, the code allows for the easy inclusion of additional scattering mechanisms and structural modifications to devices. As an application of the simulator, the current voltage characteristics of an InGaAs/InAlAs HEMT are simulated, corresponding to nanoscale III-V HEMTs currently being fabricated by Intel Corporation. The comparative effects of various scattering parameters, material properties and structural attributes are investigated and compared with experiments where reasonable agreement is obtained. The spatial evolution of spin-polarized carriers in prototypical Spin Field Effect Transistor (SpinFET) devices is then simulated. Studies of the spin coherence times in quasi-2D structures is first investigated and compared to experimental results. It is found that the simulated spin coherence times for

  19. Quantum Monte Carlo studies in Hamiltonian lattice gauge theory

    International Nuclear Information System (INIS)

    Hamer, C.J.; Samaras, M.; Bursill, R.J.

    2000-01-01

    Full text: The application of Monte Carlo methods to the 'Hamiltonian' formulation of lattice gauge theory has been somewhat neglected, and lags at least ten years behind the classical Monte Carlo simulations of Euclidean lattice gauge theory. We have applied a Green's Function Monte Carlo algorithm to lattice Yang-Mills theories in the Hamiltonian formulation, combined with a 'forward-walking' technique to estimate expectation values and correlation functions. In this approach, one represents the wave function in configuration space by a discrete ensemble of random walkers, and application of the time development operator is simulated by a diffusion and branching process. The approach has been used to estimate the ground-state energy and Wilson loop values in the U(1) theory in (2+1)D, and the SU(3) Yang-Mills theory in (3+1)D. The finite-size scaling behaviour has been explored, and agrees with the predictions of effective Lagrangian theory, and weak-coupling expansions. Crude estimates of the string tension are derived, which agree with previous results at intermediate couplings; but more accurate results for larger loops will be required to establish scaling behaviour at weak couplings. A drawback to this method is that it is necessary to introduce a 'trial' or 'guiding wave function' to guide the walkers towards the most probable regions of configuration space, in order to achieve convergence and accuracy. The 'forward-walking' estimates should be independent of this guidance, but in fact for the SU(3) case they turn out to be sensitive to the choice of trial wave function. It would be preferable to use some sort of Metropolis algorithm instead to produce a correct distribution of walkers: this may point in the direction of a Path Integral Monte Carlo approach

  20. Monte Carlo studies of non-Abelian gauge theories

    International Nuclear Information System (INIS)

    Creutz, M.

    1980-05-01

    After some general remarks on the efficiency of various Monte Carlo algorithms for gauge theories, the calculation of the asymptotic freedom scales of SU(2) and SU(3) gauge theories in the absence of quarks was discussed. There are large numerical factors between these scales when defined in terms of the bare coupling of the lattice theory or when defined in terms of the physical force between external sources

  1. Radiation doses in volume-of-interest breast computed tomography—A Monte Carlo simulation study

    Energy Technology Data Exchange (ETDEWEB)

    Lai, Chao-Jen, E-mail: cjlai3711@gmail.com; Zhong, Yuncheng; Yi, Ying; Wang, Tianpeng; Shaw, Chris C. [Department of Imaging Physics, The University of Texas MD Anderson Cancer Center, Houston, Texas 77030-4009 (United States)

    2015-06-15

    Purpose: Cone beam breast computed tomography (breast CT) with true three-dimensional, nearly isotropic spatial resolution has been developed and investigated over the past decade to overcome the problem of lesions overlapping with breast anatomical structures on two-dimensional mammographic images. However, the ability of breast CT to detect small objects, such as tissue structure edges and small calcifications, is limited. To resolve this problem, the authors proposed and developed a volume-of-interest (VOI) breast CT technique to image a small VOI using a higher radiation dose to improve that region’s visibility. In this study, the authors performed Monte Carlo simulations to estimate average breast dose and average glandular dose (AGD) for the VOI breast CT technique. Methods: Electron–Gamma-Shower system code-based Monte Carlo codes were used to simulate breast CT. The Monte Carlo codes estimated were validated using physical measurements of air kerma ratios and point doses in phantoms with an ion chamber and optically stimulated luminescence dosimeters. The validated full cone x-ray source was then collimated to simulate half cone beam x-rays to image digital pendant-geometry, hemi-ellipsoidal, homogeneous breast phantoms and to estimate breast doses with full field scans. 13-cm in diameter, 10-cm long hemi-ellipsoidal homogeneous phantoms were used to simulate median breasts. Breast compositions of 25% and 50% volumetric glandular fractions (VGFs) were used to investigate the influence on breast dose. The simulated half cone beam x-rays were then collimated to a narrow x-ray beam with an area of 2.5 × 2.5 cm{sup 2} field of view at the isocenter plane and to perform VOI field scans. The Monte Carlo results for the full field scans and the VOI field scans were then used to estimate the AGD for the VOI breast CT technique. Results: The ratios of air kerma ratios and dose measurement results from the Monte Carlo simulation to those from the physical

  2. Feasibility Study of Core Design with a Monte Carlo Code for APR1400 Initial core

    Energy Technology Data Exchange (ETDEWEB)

    Kim, Jinsun; Chang, Do Ik; Seong, Kibong [KEPCO NF, Daejeon (Korea, Republic of)

    2014-10-15

    The Monte Carlo calculation becomes more popular and useful nowadays due to the rapid progress in computing power and parallel calculation techniques. There have been many attempts to analyze a commercial core by Monte Carlo transport code using the enhanced computer capability, recently. In this paper, Monte Carlo calculation of APR1400 initial core has been performed and the results are compared with the calculation results of conventional deterministic code to find out the feasibility of core design using Monte Carlo code. SERPENT, a 3D continuous-energy Monte Carlo reactor physics burnup calculation code is used for this purpose and the KARMA-ASTRA code system, which is used for a deterministic code of comparison. The preliminary investigation for the feasibility of commercial core design with Monte Carlo code was performed in this study. Simplified core geometry modeling was performed for the reactor core surroundings and reactor coolant model is based on two region model. The reactivity difference at HZP ARO condition between Monte Carlo code and the deterministic code is consistent with each other and the reactivity difference during the depletion could be reduced by adopting the realistic moderator temperature. The reactivity difference calculated at HFP, BOC, ARO equilibrium condition was 180 ±9 pcm, with axial moderator temperature of a deterministic code. The computing time will be a significant burden at this time for the application of Monte Carlo code to the commercial core design even with the application of parallel computing because numerous core simulations are required for actual loading pattern search. One of the remedy will be a combination of Monte Carlo code and the deterministic code to generate the physics data. The comparison of physics parameters with sophisticated moderator temperature modeling and depletion will be performed for a further study.

  3. A Benchmarking Study of High Energy Carbon Ion Induced Neutron Using Several Monte Carlo Codes

    Energy Technology Data Exchange (ETDEWEB)

    Kim, D. H.; Oh, J. H.; Jung, N. S.; Lee, H. S. [Pohang Accelerator Laboratory, Pohang (Korea, Republic of); Shin, Y. S.; Kwon, D. Y.; Kim, Y. M. [Catholic Univ., Gyeongsan (Korea, Republic of); Oranj, L. Mokhtari [POSTECH, Pohang (Korea, Republic of)

    2014-10-15

    In this study, the benchmarking study was done for the representative particle interaction of the heavy ion accelerator, especially carbon-induced reaction. The secondary neutron is an important particle in the shielding analysis to define the source term and penetration ability of radiation fields. The performance of each Monte Carlo codes were verified for selected codes: MCNPX 2.7, PHITS 2.64 and FLUKA 2011.2b.6. For this benchmarking study, the experimental data of Kurosawa et al. in the SINBAD database of NEA was applied. The calculated results of the differential neutron yield produced from several materials irradiated by high energy carbon beam reproduced the experimental data well in small uncertainty. But the MCNPX results showed large discrepancy with experimental data, especially at the forward angle. The calculated results were lower a little than the experimental and it was clear in the cases of lower incident carbon energy, thinner target and forward angle. As expected, the influence of different model was found clearly at forward direction. In the shielding analysis, these characteristics of each Monte Carlo codes should be considered and utilized to determine the safety margin of a shield thickness.

  4. A Benchmarking Study of High Energy Carbon Ion Induced Neutron Using Several Monte Carlo Codes

    International Nuclear Information System (INIS)

    Kim, D. H.; Oh, J. H.; Jung, N. S.; Lee, H. S.; Shin, Y. S.; Kwon, D. Y.; Kim, Y. M.; Oranj, L. Mokhtari

    2014-01-01

    In this study, the benchmarking study was done for the representative particle interaction of the heavy ion accelerator, especially carbon-induced reaction. The secondary neutron is an important particle in the shielding analysis to define the source term and penetration ability of radiation fields. The performance of each Monte Carlo codes were verified for selected codes: MCNPX 2.7, PHITS 2.64 and FLUKA 2011.2b.6. For this benchmarking study, the experimental data of Kurosawa et al. in the SINBAD database of NEA was applied. The calculated results of the differential neutron yield produced from several materials irradiated by high energy carbon beam reproduced the experimental data well in small uncertainty. But the MCNPX results showed large discrepancy with experimental data, especially at the forward angle. The calculated results were lower a little than the experimental and it was clear in the cases of lower incident carbon energy, thinner target and forward angle. As expected, the influence of different model was found clearly at forward direction. In the shielding analysis, these characteristics of each Monte Carlo codes should be considered and utilized to determine the safety margin of a shield thickness

  5. Monte Carlo studies for irradiation process planning at the Portuguese gamma irradiation facility

    International Nuclear Information System (INIS)

    Oliveira, C.; Salgado, J.; Botelho, M.L.M. Luisa; Ferreira, L.M.

    2000-01-01

    The paper describes a Monte Carlo study for planning the irradiation of test samples for microbiological validation of distinct products in the Portuguese Gamma Irradiation Facility. Three different irradiation geometries have been used. Simulated and experimental results are compared and good agreement is observed. It is shown that Monte Carlo simulation improves process understanding, predicts absorbed dose distributions and calculates dose uniformity in different products. Based on these results, irradiation planning of the product can be performed

  6. Study of the quantitative analysis approach of maintenance by the Monte Carlo simulation method

    International Nuclear Information System (INIS)

    Shimizu, Takashi

    2007-01-01

    This study is examination of the quantitative valuation by Monte Carlo simulation method of maintenance activities of a nuclear power plant. Therefore, the concept of the quantitative valuation of maintenance that examination was advanced in the Japan Society of Maintenology and International Institute of Universality (IUU) was arranged. Basis examination for quantitative valuation of maintenance was carried out at simple feed water system, by Monte Carlo simulation method. (author)

  7. Monte Carlo simulation of nuclear energy study (II). Annual report on Nuclear Code Evaluation Committee

    Energy Technology Data Exchange (ETDEWEB)

    NONE

    2001-01-01

    In the report, research results discussed in 1999 fiscal year at Nuclear Code Evaluation Committee of Nuclear Code Research Committee were summarized. Present status of Monte Carlo simulation on nuclear energy study was described. Especially, besides of criticality, shielding and core analyses, present status of applications to risk and radiation damage analyses, high energy transport and nuclear theory calculations of Monte Carlo Method was described. The 18 papers are indexed individually. (J.P.N.)

  8. Levy-Lieb-Based Monte Carlo Study of the Dimensionality Behaviour of the Electronic Kinetic Functional

    Directory of Open Access Journals (Sweden)

    Seshaditya A.

    2017-06-01

    Full Text Available We consider a gas of interacting electrons in the limit of nearly uniform density and treat the one dimensional (1D, two dimensional (2D and three dimensional (3D cases. We focus on the determination of the correlation part of the kinetic functional by employing a Monte Carlo sampling technique of electrons in space based on an analytic derivation via the Levy-Lieb constrained search principle. Of particular interest is the question of the behaviour of the functional as one passes from 1D to 3D; according to the basic principles of Density Functional Theory (DFT the form of the universal functional should be independent of the dimensionality. However, in practice the straightforward use of current approximate functionals in different dimensions is problematic. Here, we show that going from the 3D to the 2D case the functional form is consistent (concave function but in 1D becomes convex; such a drastic difference is peculiar of 1D electron systems as it is for other quantities. Given the interesting behaviour of the functional, this study represents a basic first-principle approach to the problem and suggests further investigations using highly accurate (though expensive many-electron computational techniques, such as Quantum Monte Carlo.

  9. Monte Carlo study of one hole in a quantum antiferromagnet

    International Nuclear Information System (INIS)

    Sorella, S.

    1992-01-01

    Using the standard Quantum Monte Carlo technique for the Hubbard model, I present here a numerical investigation of the hole propagation in a Quantum Antiferromagnet. The calculation is very well stabilized, using selected sized systems and special use of the trial wavefunction that satisfy the close shell condition in presence of an arbitrarily weak Zeeman magnetic field, vanishing in the thermodynamic limit. In this paper the author investigates the question of vanishing or nonvanishing quasiparticle weight, in order to clarify whether the Mott insulator should behave just as conventional insulator with an upper and lower Hubbard band. By comparing the present finite size scaling with several techniques predicting a finite quasiparticle weight the data seem more consistent with a vanishing quasiparticle weight, i.e., as recently suggested by P.W. Anderson the Hubbard-Mott insulator should be characterized by non-trivial excitations which cannot be interpreted in a simple quasi-particle picture. However it cannot be excluded, based only on numerical grounds, that a very small but non vanishing quasiparticle weight should survive in the thermodynamic limit

  10. Phase Transition between Black and Blue Phosphorenes: A Quantum Monte Carlo Study

    Science.gov (United States)

    Li, Lesheng; Yao, Yi; Reeves, Kyle; Kanai, Yosuke

    Phase transition of the more common black phosphorene to blue phosphorene is of great interest because they are predicted to exhibit unique electronic and optical properties. However, these two phases are predicted to be separated by a rather large energy barrier. In this work, we study the transition pathway between black and blue phosphorenes by using the variable cell nudge elastic band method combined with density functional theory calculation. We show how diffusion quantum Monte Carlo method can be used for determining the energetics of the phase transition and demonstrate the use of two approaches for removing finite-size errors. Finally, we predict how applied stress can be used to control the energetic balance between these two different phases of phosphorene.

  11. Monte Carlo study for the dynamical fluctuations inside a single jet in 2-jet events

    International Nuclear Information System (INIS)

    Zhang Kunshi; Liu Lianshou; Yin Jianwu; Chen Gang; Liu Chao

    2002-01-01

    The dynamical fluctuations inside a single jet in the 2-jet events produced in e + e - collisions at 91.2 GeV have been studied using Monte Carlo method. The results show that, the anisotropy of dynamical fluctuations inside a single jet changes remarkably with the variation of the cut parameter y cut . A transition point (γ p t = γ ψ ≠γ y ) exists, where the dynamical fluctuations are anisotropic in the longitudinal-transverse plan and isotropic in the transverse planes. It indicates that the y cut corresponding to the transition point is a physically reasonable cutting parameter for selecting jets and, meanwhile, the relative transverse momentum k t at the transition point is the scale for the determination of physical jets. This conclusion is in good agreement with the experimental fact that the third jet (gluon jet) was historically first discovered in the energy region 17-30 GeV in e + e - collisions

  12. Contrast to Noise Ratio and Contrast Detail Analysis in Mammography:A Monte Carlo Study

    International Nuclear Information System (INIS)

    Metaxas, V; Delis, H; Panayiotakis, G; Kalogeropoulou, C; Zampakis, P

    2015-01-01

    The mammographic spectrum is one of the major factors affecting image quality in mammography. In this study, a Monte Carlo (MC) simulation model was used to evaluate image quality characteristics of various mammographic spectra. The anode/filter combinations evaluated, were those traditionally used in mammography, for tube voltages between 26 and 30 kVp. The imaging performance was investigated in terms of Contrast to Noise Ratio (CNR) and Contrast Detail (CD) analysis, by involving human observers, utilizing a mathematical CD phantom. Soft spectra provided the best characteristics in terms of both CNR and CD scores, while tube voltage had a limited effect. W-anode spectra filtered with k-edge filters demonstrated an improved performance, that sometimes was better compared to softer x-ray spectra, produced by Mo or Rh anode. Regarding the filter material, k-edge filters showed superior performance compared to Al filters. (paper)

  13. Dose-image quality study in digital chest radiography using Monte Carlo simulation

    International Nuclear Information System (INIS)

    Correa, S.C.A.; Souza, E.M.; Silva, A.X.; Lopes, R.T.; Yoriyaz, H.

    2008-01-01

    One of the main preoccupations of diagnostic radiology is to guarantee a good image-sparing dose to the patient. In the present study, Monte Carlo simulations, with MCNPX code, coupled with an adult voxel female model (FAX) were performed to investigate how image quality and dose in digital chest radiography vary with tube voltage (80-150 kV) using air-gap technique and a computed radiography system. Calculated quantities were normalized to a fixed value of entrance skin exposure (ESE) of 0.0136 R. The results of the present analysis show that the image quality for chest radiography with imaging plate is improved and the dose reduced at lower tube voltage

  14. Monte Carlo study of the phase diagram for the two-dimensional Z(4) model

    International Nuclear Information System (INIS)

    Carneiro, G.M.; Pol, M.E.; Zagury, N.

    1982-05-01

    The phase diagram of the two-dimensional Z(4) model on a square lattice is determined using a Monte Carlo method. The results of this simulation confirm the general features of the phase diagram predicted theoretically for the ferromagnetic case, and show the existence of a new phase with perpendicular order. (Author) [pt

  15. Monte Carlo study of electron irradiation effect on YBCO dpa profiles

    International Nuclear Information System (INIS)

    Pinnera, I.; Cruz, C.; Abreu, Y.; Leyva, A.; Van Espen, P.

    2011-01-01

    The Monte Carlo assisted Classical Method (MCCM) consists on a calculation procedure for determining the displacements per atom (dpa) distribution in solid materials. This algorithm allows studying the gamma and electron irradiation damage in different materials. It is based on the electrons elastic scattering classic theories and the use of Monte Carlo simulation for the physical processes involved. The present study deals with the Monte Carlo simulation of electron irradiation effects on YBa 2 Cu 3 O 7-x (YBCO) slabs using the MCNPX code system. Displacements per atom distributions are obtained through the MCCM for electron irradiation up to 10 MeV. In-depth dpa profiles for electrons and positrons are obtained and analyzed. Also, for each atomic species in the material, the dpa distributions are calculated. All the results are discussed in the present contribution. (Author)

  16. Structural changes in the water tetramer. A combined Monte Carlo and DFT study

    Czech Academy of Sciences Publication Activity Database

    Vítek, A.; Kalus, R.; Paidarová, Ivana

    2010-01-01

    Roč. 12, č. 41 (2010), s. 13657-13666 ISSN 1463-9076 R&D Projects: GA AV ČR IAA401870702 Institutional research plan: CEZ:AV0Z40400503 Keywords : Monte Carlo Study * DFT study * water tetramer Subject RIV: CF - Physical ; Theoretical Chemistry Impact factor: 3.454, year: 2010

  17. Study of thermodynamic and structural properties of a flexible homopolymer chain using advanced Monte Carlo methods

    Directory of Open Access Journals (Sweden)

    Hammou Amine Bouziane

    2013-03-01

    Full Text Available We study the thermodynamic and structural properties of a flexible homopolymer chain using both multi canonical Monte Carlo method and Wang-Landau method. In this work, we focus on the coil-globule transition. Starting from a completely random chain, we have obtained a globule for different sizes of the chain. The implementation of these advanced Monte Carlo methods allowed us to obtain a flat histogram in energy space and calculate various thermodynamic quantities such as the density of states, the free energy and the specific heat. Structural quantities such as the radius of gyration where also calculated.

  18. Case Study Shows Disconnect on Civic Journalism's Role

    OpenAIRE

    Tully, M.; Harmsen, S.; Singer, J.; Ekdale, B.

    2017-01-01

    This in-depth case study examines attempts to transform a traditional newsroom to one oriented around civic journalism principles, offering a unique look at the resistance toward those principles even in a digital environment that facilitates new audience relationships. Civic journalism emphasizes understanding and addressing community concerns from a citizen perspective. This study finds that journalists still struggle to integrate citizens’ contributions into newsroom practice in meaningful...

  19. A Monte Carlo study of the two-dimensional melting mechanism

    NARCIS (Netherlands)

    Allen, M.P.; Frenkel, D.; Gignac, W.; Mctaque, J.P.

    1983-01-01

    We report here a Monte Carlo study of the thermodynamic and structural properties of a two-dimensional system of 2500 particles interacting by a repulsive inverse sixth power potential. Particular effort was made in the melting region, both to identify the defect structures and to ascertain the

  20. Hamiltonian Monte Carlo study of (1+1)-dimensional models with restricted supersymmetry on the lattice

    International Nuclear Information System (INIS)

    Ranft, J.; Schiller, A.

    1984-01-01

    Lattice versions with restricted suppersymmetry of simple (1+1)-dimensional supersymmetric models are numerically studied using a local hamiltonian Monte Carlo method. The pattern of supersymmetry breaking closely follows the expectations of Bartels and Bronzan obtain in an alternative lattice formulation. (orig.)

  1. Studies of Top Quark Monte Carlo Modelling with the ATLAS Detector

    CERN Document Server

    Asquith, Lily; The ATLAS collaboration

    2017-01-01

    The status of recent studies of modern Monte Carlo generator setups for the pair production of top quarks at the LHC. Samples at a center of mass energy of 13 TeV have been generated for a variety of generators and with different generator configurations. The predictions from these sample are compared to ATLAS data for a variety of kinematic observables.

  2. New family of probability distributions with applications to Monte Carlo studies

    International Nuclear Information System (INIS)

    Johnson, M.E.; Tietjen, G.L.; Beckman, R.J.

    1980-01-01

    A new probability distribution is presented that offers considerable potential for providing stochastic inputs to Monte Carlo simulation studies. The distribution includes the exponential power family as a special case. An efficient computational strategy is proposed for random variate generation. An example for testing the hypothesis of unit variance illustrates the advantages of the proposed distribution

  3. Oklahoma Cherokee formation study shows benefits of gas tax credits

    International Nuclear Information System (INIS)

    Stanley, B.J.; Cline, S.B.

    1994-01-01

    To no one's surprise, the administration's recently released energy initiative package does not advocate the use of tax incentives such as the Internal Revenue Code Sec. 29 (tight sand gas) credit that expired Dec. 31, 1992. This is unfortunate since tax credits do stimulate drilling, as the authors' recent study of Oklahoma's Pennsylvanian age Cherokee formation demonstrates. Within this 783,000 acre study area, more than 130 additional wells were drilled between 1991--92 because of tax credit incentives. And such tax credits also increase total federal tax revenues by causing wells to be drilled that would not have been drilled or accelerating the drilling of wells, thereby increasing taxable revenue. In short, tax credits create a win-win situation: they stimulate commerce, increase tax revenues, reduce the outflow of capital to foreign petroleum projects, and add to the nation's natural gas reserve, which is beneficial for national security, balance of payments, the environment, and gas market development. The paper discusses the study assumptions, study results, and the tax credit policy

  4. Flue gas adsorption by single-wall carbon nanotubes: A Monte Carlo study

    International Nuclear Information System (INIS)

    Romero-Hermida, M. I.; Romero-Enrique, J. M.; Morales-Flórez, V.; Esquivias, L.

    2016-01-01

    Adsorption of flue gases by single-wall carbon nanotubes (SWCNT) has been studied by means of Monte Carlo simulations. The flue gas is modeled as a ternary mixture of N 2 , CO 2 , and O 2 , emulating realistic compositions of the emissions from power plants. The adsorbed flue gas is in equilibrium with a bulk gas characterized by temperature T, pressure p, and mixture composition. We have considered different SWCNTs with different chiralities and diameters in a range between 7 and 20 Å. Our results show that the CO 2 adsorption properties depend mainly on the bulk flue gas thermodynamic conditions and the SWCNT diameter. Narrow SWCNTs with diameter around 7 Å show high CO 2 adsorption capacity and selectivity, but they decrease abruptly as the SWCNT diameter is increased. For wide SWCNT, CO 2 adsorption capacity and selectivity, much smaller in value than for the narrow case, decrease mildly with the SWCNT diameter. In the intermediate range of SWCNT diameters, the CO 2 adsorption properties may show a peculiar behavior, which depend strongly on the bulk flue gas conditions. Thus, for high bulk CO 2 concentrations and low temperatures, the CO 2 adsorption capacity remains high in a wide range of SWCNT diameters, although the corresponding selectivity is moderate. We correlate these findings with the microscopic structure of the adsorbed gas inside the SWCNTs.

  5. Flue gas adsorption by single-wall carbon nanotubes: A Monte Carlo study.

    Science.gov (United States)

    Romero-Hermida, M I; Romero-Enrique, J M; Morales-Flórez, V; Esquivias, L

    2016-08-21

    Adsorption of flue gases by single-wall carbon nanotubes (SWCNT) has been studied by means of Monte Carlo simulations. The flue gas is modeled as a ternary mixture of N2, CO2, and O2, emulating realistic compositions of the emissions from power plants. The adsorbed flue gas is in equilibrium with a bulk gas characterized by temperature T, pressure p, and mixture composition. We have considered different SWCNTs with different chiralities and diameters in a range between 7 and 20 Å. Our results show that the CO2 adsorption properties depend mainly on the bulk flue gas thermodynamic conditions and the SWCNT diameter. Narrow SWCNTs with diameter around 7 Å show high CO2 adsorption capacity and selectivity, but they decrease abruptly as the SWCNT diameter is increased. For wide SWCNT, CO2 adsorption capacity and selectivity, much smaller in value than for the narrow case, decrease mildly with the SWCNT diameter. In the intermediate range of SWCNT diameters, the CO2 adsorption properties may show a peculiar behavior, which depend strongly on the bulk flue gas conditions. Thus, for high bulk CO2 concentrations and low temperatures, the CO2 adsorption capacity remains high in a wide range of SWCNT diameters, although the corresponding selectivity is moderate. We correlate these findings with the microscopic structure of the adsorbed gas inside the SWCNTs.

  6. Flue gas adsorption by single-wall carbon nanotubes: A Monte Carlo study

    Energy Technology Data Exchange (ETDEWEB)

    Romero-Hermida, M. I. [Departamento de Química Física, Facultad de Ciencias, Universidad de Cádiz, Campus Río San Pedro s/n, 11510 Puerto Real (Spain); Departamento de Física Condensada, Universidad de Sevilla, Av. Reina Mercedes s/n, 41012 Sevilla (Spain); Romero-Enrique, J. M. [Departamento de Física Atómica, Molecular y Nuclear, Área de Física Teórica, Universidad de Sevilla, Av. Reina Mercedes s/n, 41012 Sevilla (Spain); Morales-Flórez, V.; Esquivias, L. [Departamento de Física Condensada, Universidad de Sevilla, Av. Reina Mercedes s/n, 41012 Sevilla (Spain); Instituto de Ciencia de Materiales de Sevilla (CSIC/US), Av. Américo Vespucio 49, 41092 Sevilla (Spain)

    2016-08-21

    Adsorption of flue gases by single-wall carbon nanotubes (SWCNT) has been studied by means of Monte Carlo simulations. The flue gas is modeled as a ternary mixture of N{sub 2}, CO{sub 2}, and O{sub 2}, emulating realistic compositions of the emissions from power plants. The adsorbed flue gas is in equilibrium with a bulk gas characterized by temperature T, pressure p, and mixture composition. We have considered different SWCNTs with different chiralities and diameters in a range between 7 and 20 Å. Our results show that the CO{sub 2} adsorption properties depend mainly on the bulk flue gas thermodynamic conditions and the SWCNT diameter. Narrow SWCNTs with diameter around 7 Å show high CO{sub 2} adsorption capacity and selectivity, but they decrease abruptly as the SWCNT diameter is increased. For wide SWCNT, CO{sub 2} adsorption capacity and selectivity, much smaller in value than for the narrow case, decrease mildly with the SWCNT diameter. In the intermediate range of SWCNT diameters, the CO{sub 2} adsorption properties may show a peculiar behavior, which depend strongly on the bulk flue gas conditions. Thus, for high bulk CO{sub 2} concentrations and low temperatures, the CO{sub 2} adsorption capacity remains high in a wide range of SWCNT diameters, although the corresponding selectivity is moderate. We correlate these findings with the microscopic structure of the adsorbed gas inside the SWCNTs.

  7. Experimental and Monte Carlo simulation studies of open cylindrical radon monitoring device using CR-39 detector

    Energy Technology Data Exchange (ETDEWEB)

    Rehman, Fazal-ur- E-mail: fazalr@kfupm.edu.sa; Jamil, K.; Zakaullah, M.; Abu-Jarad, F.; Mujahid, S.A

    2003-07-01

    There are several methods of measuring radon concentrations but nuclear track detector cylindrical dosimeters are widely employed. In this investigation, the consequence of effective volumes of the dosimeters on the registration of alpha tracks in a CR-39 detector was studied. In a series of experiments an optimum radius for a CR-39-based open cylindrical radon dosimeter was found to be about 3 cm. Monte Carlo simulation techniques hav been employed to verify the experimental results. In this context, a computer code Monte Carlo simulation dosimetry (MOCSID) was developed. Monte Carlo simulation experiments gave the optimum radius of the dosimeters as 3.0 cm. The experimental results are in good agreement with those obtained by Monte Carlo design calculations. In addition to this, plate-out effects of radon progeny were also studied. It was observed that the contribution of radon progeny ({sup 218}Po and {sup 214}Po) plated-out on the wall of the dosimeters increases with an increase of dosimeter radii and then decrease to 0 at a radius of about 3 cm if a point detector has been installed at the center of the dosimeter base. In the code MOCSID different types of random number generators were employed. The results of this research are very useful for designing an optimum size of radon dosimeters.

  8. Experimental and Monte Carlo simulation studies of open cylindrical radon monitoring device using CR-39 detector

    International Nuclear Information System (INIS)

    Rehman, Fazal-ur-; Jamil, K.; Zakaullah, M.; Abu-Jarad, F.; Mujahid, S.A.

    2003-01-01

    There are several methods of measuring radon concentrations but nuclear track detector cylindrical dosimeters are widely employed. In this investigation, the consequence of effective volumes of the dosimeters on the registration of alpha tracks in a CR-39 detector was studied. In a series of experiments an optimum radius for a CR-39-based open cylindrical radon dosimeter was found to be about 3 cm. Monte Carlo simulation techniques hav been employed to verify the experimental results. In this context, a computer code Monte Carlo simulation dosimetry (MOCSID) was developed. Monte Carlo simulation experiments gave the optimum radius of the dosimeters as 3.0 cm. The experimental results are in good agreement with those obtained by Monte Carlo design calculations. In addition to this, plate-out effects of radon progeny were also studied. It was observed that the contribution of radon progeny ( 218 Po and 214 Po) plated-out on the wall of the dosimeters increases with an increase of dosimeter radii and then decrease to 0 at a radius of about 3 cm if a point detector has been installed at the center of the dosimeter base. In the code MOCSID different types of random number generators were employed. The results of this research are very useful for designing an optimum size of radon dosimeters

  9. A Monte Carlo Study on Multiple Output Stochastic Frontiers

    DEFF Research Database (Denmark)

    Henningsen, Géraldine; Henningsen, Arne; Jensen, Uwe

    , dividing all other output quantities by the selected output quantity, and using these ratios as regressors (OD). Another approach is the stochastic ray production frontier (SR) which transforms the output quantities into their Euclidean distance as the dependent variable and their polar coordinates......In the estimation of multiple output technologies in a primal approach, the main question is how to handle the multiple outputs. Often an output distance function is used, where the classical approach is to exploit its homogeneity property by selecting one output quantity as the dependent variable...... of both specifications for the case of a Translog output distance function with respect to different common statistical problems as well as problems arising as a consequence of zero values in the output quantities. Although, our results partly show clear reactions to statistical misspecifications...

  10. Monte Carlo verification of polymer gel dosimetry applied to radionuclide therapy: a phantom study

    International Nuclear Information System (INIS)

    Gear, J I; Partridge, M; Flux, G D; Charles-Edwards, E

    2011-01-01

    This study evaluates the dosimetric performance of the polymer gel dosimeter 'Methacrylic and Ascorbic acid in Gelatin, initiated by Copper' and its suitability for quality assurance and analysis of I-131-targeted radionuclide therapy dosimetry. Four batches of gel were manufactured in-house and sets of calibration vials and phantoms were created containing different concentrations of I-131-doped gel. Multiple dose measurements were made up to 700 h post preparation and compared to equivalent Monte Carlo simulations. In addition to uniformly filled phantoms the cross-dose distribution from a hot insert to a surrounding phantom was measured. In this example comparisons were made with both Monte Carlo and a clinical scintigraphic dosimetry method. Dose-response curves generated from the calibration data followed a sigmoid function. The gels appeared to be stable over many weeks of internal irradiation with a delay in gel response observed at 29 h post preparation. This was attributed to chemical inhibitors and slow reaction rates of long-chain radical species. For this reason, phantom measurements were only made after 190 h of irradiation. For uniformly filled phantoms of I-131 the accuracy of dose measurements agreed to within 10% when compared to Monte Carlo simulations. A radial cross-dose distribution measured using the gel dosimeter compared well to that calculated with Monte Carlo. Small inhomogeneities were observed in the dosimeter attributed to non-uniform mixing of monomer during preparation. However, they were not detrimental to this study where the quantitative accuracy and spatial resolution of polymer gel dosimetry were far superior to that calculated using scintigraphy. The difference between Monte Carlo and gel measurements was of the order of a few cGy, whilst with the scintigraphic method differences of up to 8 Gy were observed. A manipulation technique is also presented which allows 3D scintigraphic dosimetry measurements to be compared to polymer

  11. Local dose enhancement in radiation therapy: Monte Carlo simulation study

    International Nuclear Information System (INIS)

    Silva, Laura E. da; Nicolucci, Patricia

    2014-01-01

    The development of nanotechnology has boosted the use of nanoparticles in radiation therapy in order to achieve greater therapeutic ratio between tumor and healthy tissues. Gold has been shown to be most suitable to this task due to the high biocompatibility and high atomic number, which contributes to a better in vivo distribution and for the local energy deposition. As a result, this study proposes to study, nanoparticle in the tumor cell. At a range of 11 nm from the nanoparticle surface, results have shown an absorbed dose 141 times higher for the medium with the gold nanoparticle compared to the water for an incident energy spectrum with maximum photon energy of 50 keV. It was also noted that when only scattered radiation is interacting with the gold nanoparticles, the dose was 134 times higher compared to enhanced local dose that remained significant even for scattered radiation. (author)

  12. Study of the multiple scattering effect in TEBENE using the Monte Carlo method

    International Nuclear Information System (INIS)

    Singkarat, Somsorn.

    1990-01-01

    The neutron time-of-flight and energy spectra, from the TEBENE set-up, have been calculated by a computer program using the Monte Carlo method. The neutron multiple scattering within the polyethylene scatterer ring is closely investigated. The results show that multiple scattering has a significant effect on the detected neutron yield. They also indicate that the thickness of the scatterer ring has to be carefully chosen. (author)

  13. A study of orientational disorder in ND4Cl by the reverse Monte Carlo method

    International Nuclear Information System (INIS)

    Belushkin, A.V.; Kozlenko, D.P.; Savenko, B.N.; McGreevy, R.L.; Zetterstroem, P.

    1998-01-01

    The total structure factor for deuterated ammonium chloride measured by neutron diffraction has been modeled using the reverse Monte Carlo method. The results show that the orientational disorder of the ammonium ions consists of a local librational motion with an average angular amplitude α = 17 deg and reorientations of ammonium ions by 90 deg jumps around two-fold axes. Reorientations around three-fold axes have a very low probability

  14. Study of a Monte Carlo program for the Cello experiment

    International Nuclear Information System (INIS)

    Lagraa, Mohamed.

    1979-01-01

    In the first part, the experimental Cello device is presented and the physics of the electron-positron collision rings in the Petra energy domain is discussed. In the second part, a detailed study is presented of the program that generates the e + e - reactions and simulates the answer of the detectors to these reactions. Such a program is necessary to make allowance for the true physical breaks due to the geometry of the detectors and in consequence is indispensable for the analysis of the rough data of the experiment [fr

  15. Study of Monte Carlo Simulation Method for Methane Phase Diagram Prediction using Two Different Potential Models

    KAUST Repository

    Kadoura, Ahmad

    2011-06-06

    Lennard‐Jones (L‐J) and Buckingham exponential‐6 (exp‐6) potential models were used to produce isotherms for methane at temperatures below and above critical one. Molecular simulation approach, particularly Monte Carlo simulations, were employed to create these isotherms working with both canonical and Gibbs ensembles. Experiments in canonical ensemble with each model were conducted to estimate pressures at a range of temperatures above methane critical temperature. Results were collected and compared to experimental data existing in literature; both models showed an elegant agreement with the experimental data. In parallel, experiments below critical temperature were run in Gibbs ensemble using L‐J model only. Upon comparing results with experimental ones, a good fit was obtained with small deviations. The work was further developed by adding some statistical studies in order to achieve better understanding and interpretation to the estimated quantities by the simulation. Methane phase diagrams were successfully reproduced by an efficient molecular simulation technique with different potential models. This relatively simple demonstration shows how powerful molecular simulation methods could be, hence further applications on more complicated systems are considered. Prediction of phase behavior of elemental sulfur in sour natural gases has been an interesting and challenging field in oil and gas industry. Determination of elemental sulfur solubility conditions helps avoiding all kinds of problems caused by its dissolution in gas production and transportation processes. For this purpose, further enhancement to the methods used is to be considered in order to successfully simulate elemental sulfur phase behavior in sour natural gases mixtures.

  16. A dynamic Monte Carlo study of anomalous current voltage behaviour in organic solar cells

    International Nuclear Information System (INIS)

    Feron, K.; Fell, C. J.; Zhou, X.; Belcher, W. J.; Dastoor, P. C.

    2014-01-01

    We present a dynamic Monte Carlo (DMC) study of s-shaped current-voltage (I-V) behaviour in organic solar cells. This anomalous behaviour causes a substantial decrease in fill factor and thus power conversion efficiency. We show that this s-shaped behaviour is induced by charge traps that are located at the electrode interface rather than in the bulk of the active layer, and that the anomaly becomes more pronounced with increasing trap depth or density. Furthermore, the s-shape anomaly is correlated with interface recombination, but not bulk recombination, thus highlighting the importance of controlling the electrode interface. While thermal annealing is known to remove the s-shape anomaly, the reason has been not clear, since these treatments induce multiple simultaneous changes to the organic solar cell structure. The DMC modelling indicates that it is the removal of aluminium clusters at the electrode, which act as charge traps, that removes the anomalous I-V behaviour. Finally, this work shows that the s-shape becomes less pronounced with increasing electron-hole recombination rate; suggesting that efficient organic photovoltaic material systems are more susceptible to these electrode interface effects

  17. STRONG CORRELATIONS AND ELECTRON-PHONON COUPLING IN HIGH-TEMPERATURE SUPERCONDUCTORS - A QUANTUM MONTE-CARLO STUDY

    NARCIS (Netherlands)

    MORGENSTERN, [No Value; FRICK, M; VONDERLINDEN, W

    We present quantum simulation studies for a system of strongly correlated fermions coupled to local anharmonic phonons. The Monte Carlo calculations are based on a generalized version of the Projector Quantum Monte Carlo Method allowing a simultaneous treatment of fermions and dynamical phonons. The

  18. Monte Carlo studies on photon interactions in radiobiological experiments

    Science.gov (United States)

    Shahmohammadi Beni, Mehrdad; Krstic, D.; Nikezic, D.

    2018-01-01

    X-ray and γ-ray photons have been widely used for studying radiobiological effects of ionizing radiations. Photons are indirectly ionizing radiations so they need to set in motion electrons (which are a directly ionizing radiation) to perform the ionizations. When the photon dose decreases to below a certain limit, the number of electrons set in motion will become so small that not all cells in an “exposed” cell population can get at least one electron hit. When some cells in a cell population are not hit by a directly ionizing radiation (in other words not irradiated), there will be rescue effect between the irradiated cells and non-irradiated cells, and the resultant radiobiological effect observed for the “exposed” cell population will be different. In the present paper, the mechanisms underlying photon interactions in radiobiological experiments were studied using our developed NRUphoton computer code, which was benchmarked against the MCNP5 code by comparing the photon dose delivered to the cell layer underneath the water medium. The following conclusions were reached: (1) The interaction fractions decreased in the following order: 16O > 12C > 14N > 1H. Bulges in the interaction fractions (versus water medium thickness) were observed, which reflected changes in the energies of the propagating photons due to traversals of different amount of water medium as well as changes in the energy-dependent photon interaction cross-sections. (2) Photoelectric interaction and incoherent scattering dominated for lower-energy (10 keV) and high-energy (100 keV and 1 MeV) incident photons. (3) The fractions of electron ejection from different nuclei were mainly governed by the photoelectric effect cross-sections, and the fractions from the 1s subshell were the largest. (4) The penetration fractions in general decreased with increasing medium thickness, and increased with increasing incident photon energy, the latter being explained by the corresponding reduction in

  19. Monte Carlo studies on photon interactions in radiobiological experiments.

    Directory of Open Access Journals (Sweden)

    Mehrdad Shahmohammadi Beni

    Full Text Available X-ray and γ-ray photons have been widely used for studying radiobiological effects of ionizing radiations. Photons are indirectly ionizing radiations so they need to set in motion electrons (which are a directly ionizing radiation to perform the ionizations. When the photon dose decreases to below a certain limit, the number of electrons set in motion will become so small that not all cells in an "exposed" cell population can get at least one electron hit. When some cells in a cell population are not hit by a directly ionizing radiation (in other words not irradiated, there will be rescue effect between the irradiated cells and non-irradiated cells, and the resultant radiobiological effect observed for the "exposed" cell population will be different. In the present paper, the mechanisms underlying photon interactions in radiobiological experiments were studied using our developed NRUphoton computer code, which was benchmarked against the MCNP5 code by comparing the photon dose delivered to the cell layer underneath the water medium. The following conclusions were reached: (1 The interaction fractions decreased in the following order: 16O > 12C > 14N > 1H. Bulges in the interaction fractions (versus water medium thickness were observed, which reflected changes in the energies of the propagating photons due to traversals of different amount of water medium as well as changes in the energy-dependent photon interaction cross-sections. (2 Photoelectric interaction and incoherent scattering dominated for lower-energy (10 keV and high-energy (100 keV and 1 MeV incident photons. (3 The fractions of electron ejection from different nuclei were mainly governed by the photoelectric effect cross-sections, and the fractions from the 1s subshell were the largest. (4 The penetration fractions in general decreased with increasing medium thickness, and increased with increasing incident photon energy, the latter being explained by the corresponding reduction in

  20. Kinetic Monte Carlo Study of Li Intercalation in LiFePO4.

    Science.gov (United States)

    Xiao, Penghao; Henkelman, Graeme

    2018-01-23

    Even as a commercial cathode material, LiFePO 4 remains of tremendous research interest for understanding Li intercalation dynamics. The partially lithiated material spontaneously separates into Li-poor and Li-rich phases at equilibrium. Phase segregation is a surprising property of LiFePO 4 given its high measured rate capability. Previous theoretical studies, aiming to describe Li intercalation in LiFePO 4 , include both atomic-scale density functional theory (DFT) calculations of static Li distributions and entire-particle-scale phase field models, based upon empirical parameters, studying the dynamics of the phase separation. Little effort has been made to bridge the gap between these two scales. In this work, DFT calculations are used to fit a cluster expansion for the basis of kinetic Monte Carlo calculations, which enables long time scale simulations with accurate atomic interactions. This atomistic model shows how the phases evolve in Li x FePO 4 without parameters from experiments. Our simulations reveal that an ordered Li 0.5 FePO4 phase with alternating Li-rich and Li-poor planes along the ac direction forms between the LiFePO 4 and FePO 4 phases, which is consistent with recent X-ray diffraction experiments showing peaks associated with an intermediate-Li phase. The calculations also help to explain a recent puzzling experiment showing that LiFePO 4 particles with high aspect ratios that are narrower along the [100] direction, perpendicular to the [010] Li diffusion channels, actually have better rate capabilities. Our calculations show that lateral surfaces parallel to the Li diffusion channels, as well as other preexisting sites that bind Li weakly, are important for phase nucleation and rapid cycling performance.

  1. A Monte Carlo dosimetry study using Henschke applicator for cervical brachytherapy

    International Nuclear Information System (INIS)

    Yu, Pei-Chieh; Chao, Tsi-Chian; Lee, Chung-Chi; Wu, Ching-Jung; Tung, Chuan-Jong

    2010-01-01

    In recent years the Henschke applicator has been widely used for gynecologic patients treated by brachytherapy in Taiwan. However, the commercial brachytherapy planning system did not properly evaluate the dose perturbation caused by the Henschke applicator. Since the European Society for Therapeutic Radiology and Oncology advised that the effect of source shielding should be incorporated into the brachytherapy planning system, it required calculation and comparison of the dose distribution around the applicator. This study used the Monte Carlo MCNP code to simulate the dose distribution in a water phantom that contained the Henschke applicator with one tandem and two ovoids. Three dwell positions of a high dose rate 192 Ir source were simulated by including and excluding the applicator. The mesh tally option of the MCNP was applied to facilitate the calculation of a large number of tallies in the phantom. The voxel size effect and the charge particle equilibrium were studied by comparing the results calculated with different tally options. The calculated results showed that the brachytherapy planning system overestimated the rectal dose and that the shielding material in the applicator contributed more than 40% to the rectal dose.

  2. Study of Monte Carlo approach to experimental uncertainty propagation with MSTW 2008 PDFs

    CERN Document Server

    Watt, G.

    2012-01-01

    We investigate the Monte Carlo approach to propagation of experimental uncertainties within the context of the established 'MSTW 2008' global analysis of parton distribution functions (PDFs) of the proton at next-to-leading order in the strong coupling. We show that the Monte Carlo approach using replicas of the original data gives PDF uncertainties in good agreement with the usual Hessian approach using the standard Delta(chi^2) = 1 criterion, then we explore potential parameterisation bias by increasing the number of free parameters, concluding that any parameterisation bias is likely to be small, with the exception of the valence-quark distributions at low momentum fractions x. We motivate the need for a larger tolerance, Delta(chi^2) > 1, by making fits to restricted data sets and idealised consistent or inconsistent pseudodata. Instead of using data replicas, we alternatively produce PDF sets randomly distributed according to the covariance matrix of fit parameters including appropriate tolerance values,...

  3. Monte Carlo study of the performance of a time-of-flight multichopper spectrometer

    International Nuclear Information System (INIS)

    Daemen, L.L.; Eckert, J.; Pynn, R.

    1995-01-01

    The Monte Carlo method is a powerful technique for neutron transport studies. While it has been applied for many years to the study of nuclear systems, there are few codes available for neutron transport in the optical regime. The recent surge of interest in so-called next generation spallation neutron sources and the desire to design new and optimized instruments for these facilities has led us to develop a Monte Carlo code geared toward the simulation of neutron scattering instruments. The time-of-flight multichopper spectrometer, of which IN5 at the ILL is the prototypical example, is the first spectrometer studied with the code. Some of the results of a comparison between the IN5 performance at a reactor and at a Long Pulse Spallation Source (LPSS) are summarized here

  4. Critical phenomena in Ising-type thin films by Monte Carlo study

    International Nuclear Information System (INIS)

    Masrour, R.; Jabar, A.; Benyoussef, A.; Hamedoun, M.

    2016-01-01

    The magnetic properties of ferrimagnetic spin-2 and 3/2 Ising-typed thin films are studied by Monte Carlo simulation. The critical temperature is obtained for different values of thickness of the thin film and for different exchange interactions. The total magnetization has been determined for different values of exchange interactions in surface and in bulk and different temperatures. The magnetic hysteresis cycle is obtained for different values of exchange interactions ferro and antiferromagnetic in the surface and in the bulk and for different values of temperatures for a fixed size of the film thickness. The coercive field increase with increasing the film thickness. - Highlights: • The magnetic properties of thin films are studied by Monte Carlo simulation. • The critical temperature is obtained for different values of thickness of thin film. • The magnetic hysteresis cycle is obtained in the surface and in the bulk. • The coercive field increase with increasing the thin film thickness.

  5. Domain-growth kinetics and aspects of pinning: A Monte Carlo simulation study

    DEFF Research Database (Denmark)

    Castán, T.; Lindgård, Per-Anker

    1991-01-01

    By means of Monte Carlo computer simulations we study the domain-growth kinetics after a quench across a first-order line to very low and moderate temperatures in a multidegenerate system with nonconserved order parameter. The model is a continuous spin model relevant for martensitic transformati......By means of Monte Carlo computer simulations we study the domain-growth kinetics after a quench across a first-order line to very low and moderate temperatures in a multidegenerate system with nonconserved order parameter. The model is a continuous spin model relevant for martensitic...... to cross over from n = 1/4 at T approximately 0 to n = 1/2 with temperature for models with pinnings of types (a) and (b). For topological pinnings at T approximately 0, n is consistent with n = 1/8, a value conceivable for several levels of hierarchically interrelated domain-wall movement. When...

  6. Critical phenomena in Ising-type thin films by Monte Carlo study

    Energy Technology Data Exchange (ETDEWEB)

    Masrour, R., E-mail: rachidmasrour@hotmail.com [Laboratory of Materials, Processes, Environment and Quality, Cady Ayyed University, National School of Applied Sciences, 63, 46000 Safi (Morocco); Laboratoire de Magnétisme et Physique des Hautes Energies L.M.P.H.E.URAC 12, Université Mohammed V, Faculté des Sciences, B.P. 1014, Rabat (Morocco); Jabar, A. [Laboratoire de Magnétisme et Physique des Hautes Energies L.M.P.H.E.URAC 12, Université Mohammed V, Faculté des Sciences, B.P. 1014, Rabat (Morocco); Benyoussef, A. [Laboratoire de Magnétisme et Physique des Hautes Energies L.M.P.H.E.URAC 12, Université Mohammed V, Faculté des Sciences, B.P. 1014, Rabat (Morocco); Institute of Nanomaterials and Nanotechnologies, MAScIR, Rabat (Morocco); Hassan II Academy of Science and Technology, Rabat (Morocco); Hamedoun, M. [Institute of Nanomaterials and Nanotechnologies, MAScIR, Rabat (Morocco)

    2016-04-01

    The magnetic properties of ferrimagnetic spin-2 and 3/2 Ising-typed thin films are studied by Monte Carlo simulation. The critical temperature is obtained for different values of thickness of the thin film and for different exchange interactions. The total magnetization has been determined for different values of exchange interactions in surface and in bulk and different temperatures. The magnetic hysteresis cycle is obtained for different values of exchange interactions ferro and antiferromagnetic in the surface and in the bulk and for different values of temperatures for a fixed size of the film thickness. The coercive field increase with increasing the film thickness. - Highlights: • The magnetic properties of thin films are studied by Monte Carlo simulation. • The critical temperature is obtained for different values of thickness of thin film. • The magnetic hysteresis cycle is obtained in the surface and in the bulk. • The coercive field increase with increasing the thin film thickness.

  7. Magnetic properties in kagomé lattice with RKKY interaction: A Monte Carlo study

    Energy Technology Data Exchange (ETDEWEB)

    Masrour, R., E-mail: rachidmasrour@hotmail.com [Laboratory of Materials, Processes, Environment and Quality, Cady Ayyed University, National School of Applied Sciences, 63, 46000 Safi (Morocco); Laboratoire de Magnétisme et Physique des Hautes Energies L.M.P.H.E.URAC 12, Université Mohammed V, Faculté des Sciences, B.P. 1014, Rabat (Morocco); Jabar, A. [Laboratoire de Magnétisme et Physique des Hautes Energies L.M.P.H.E.URAC 12, Université Mohammed V, Faculté des Sciences, B.P. 1014, Rabat (Morocco); Benyoussef, A. [Laboratoire de Magnétisme et Physique des Hautes Energies L.M.P.H.E.URAC 12, Université Mohammed V, Faculté des Sciences, B.P. 1014, Rabat (Morocco); Institute of Nanomaterials and Nanotechnologies, MAScIR, Rabat (Morocco); Hassan II Academy of Science and Technology, Rabat (Morocco); Hamedoun, M. [Institute of Nanomaterials and Nanotechnologies, MAScIR, Rabat (Morocco)

    2016-03-01

    The magnetic properties of the kagomé lattice have been studied with Ruderman–Kittel–Kasuya–Yosida (RKKY) exchange interactions in a spin-7/2 Ising model using Monte Carlo simulations. The RKKY interaction between the two magnetic layers is considered for different distances. The magnetizations and magnetic susceptibilities of this lattice are given for different triquadratic interactions around each triangular face. The critical temperature is obtained for a fixed size. The magnetic hysteresis cycle of kagomé lattice with RKKY interactions is obtained for different temperatures and for different crystal field with a fixed size of nonmagnetic layer. - Highlights: • We study the RKKY interaction in kagomé lattice using the Monte Carlo simulations. • The transition temperature is obtained for kagomé lattice with RKKY interaction. • The coercive field is obtained for kagomé lattice with RKKY interaction.

  8. Study on the propagation properties of laser in aerosol based on Monte Carlo simulation

    Science.gov (United States)

    Leng, Kun; Wu, Wenyuan; Zhang, Xi; Gong, Yanchun; Yang, Yuntao

    2018-02-01

    When laser propagate in the atmosphere, due to aerosol scattering and absorption, laser energy will continue to decline, affecting the effectiveness of the laser effect. Based on the Monte Carlo method, the relationship between the photon spatial energy distributions of the laser wavelengths of 10.6μm in marine, sand-type, water-soluble and soot aerosols ,and the propagation distance, visibility and the divergence angle were studied. The results show that for 10.6μm laser, the maximum number of attenuation of photons arriving at the receiving plane is sand-type aerosol, the minimal attenuation is water soluble aerosol; as the propagation distance increases, the number of photons arriving at the receiving plane decreases; as the visibility increases, the number of photons arriving at the receiving plane increases rapidly and then stabilizes; in the above cases, the photon energy distribution does not deviated from the Gaussian distribution; as the divergence angle increases, the number of photons arriving at the receiving plane is almost unchanged, but the photon energy distribution gradually deviates from the Gaussian distribution.

  9. A kinetic Monte Carlo study of coarsening resistance of novel core/shell precipitates

    International Nuclear Information System (INIS)

    Zhang, Xuan; Gao, Wenpei; Bellon, Pascal; Averback, Robert S.; Zuo, Jian-Min

    2014-01-01

    A novel approach towards the design of coarsening-resistant nanoprecipitates in structural alloys was investigated by kinetic Monte Carlo (KMC) simulation. The approach is motivated by recent experimental results in Cu–Nb–W alloys showing that room temperature ion irradiation resulted in W nanoprecipitation, leading to exceptional stability of W-rich-core/Nb-rich-shell nanoprecipitates formed following thermal annealing (Zhang et al., 2013 [11]). Here, image simulations of atomically resolved scanning transmission electron microscopy are performed to establish that these W nanoprecipitates are highly ramified. Thermal precipitate coarsening in an A–B–C ternary alloy similar to Cu–Nb–W is then studied by KMC simulations, where the highly immiscible and refractory C solute atoms are initially distributed into fractal nanoprecipitates, or cores, which become coated by a shell of B atoms during elevated temperature annealing. Compared with nanoprecipitates generated by compact C cores, the ramified nanoprecipitates result in exceptionally high trapping efficiency of B solute atoms during thermal coarsening, and the efficiency increases with the cluster size. The KMC results are analyzed and rationalized by noting that, owing to the Gibbs–Thomson effect, when the curvatures of the shell of the precipitates are zero or negative, the microstructure is coarsening-resistant. Such morphology can be realized by facets, or by dynamic balance within positive, negative and zero curvatures

  10. Effect of Pore Geometry on Gas Adsorption: Grand Canonical Monte Carlo Simulation Studies

    International Nuclear Information System (INIS)

    Lee, Eon Ji; Chang, Rak Woo; Han, Ji Hyung; Chung, Taek Dong

    2012-01-01

    In this study, we investigated the pure geometrical effect of porous materials in gas adsorption using the grand canonical Monte Carlo simulations of primitive gas-pore models with various pore geometries such as planar, cylindrical, and random pore geometries. Although the model does not possess atomistic level details of porous materials, our simulation results provided many insightful information in the effect of pore geometry on the adsorption behavior of gas molecules. First, the surface curvature of porous materials plays a significant role in the amount of adsorbed gas molecules: the concave surface such as in cylindrical pores induces more attraction between gas molecules and pore, which results in the enhanced gas adsorption. On the contrary, the convex surface of random pores gives the opposite effect. Second, this geometrical effect shows a nonmonotonic dependence on the gas-pore interaction strength and length. Third, as the external gas pressure is increased, the change in the gas adsorption due to pore geometry is reduced. Finally, the pore geometry also affects the collision dynamics of gas molecules. Since our model is based on primitive description of fluid molecules, our conclusion can be applied to any fluidic systems including reactant-electrode systems

  11. Capillary condensation hysteresis in overlapping spherical pores: a Monte Carlo simulation study.

    Science.gov (United States)

    Gor, Gennady Yu; Rasmussen, Christopher J; Neimark, Alexander V

    2012-08-21

    The mechanisms of hysteretic phase transformations in fluids confined to porous bodies depend on the size and shape of pores, as well as their connectivity. We present a Monte Carlo simulation study of capillary condensation and evaporation cycles in the course of Lennard-Jones fluid adsorption in the system of overlapping spherical pores. This model system mimics pore shape and connectivity in some mesoporous materials obtained by templating cubic surfactant mesophases or colloidal crystals. We show different mechanisms of capillary hysteresis depending on the size of the window between the pores. For the system with a small window, the hysteresis cycle is similar to that in a single spherical pore: capillary condensation takes place upon achieving the limit of stability of adsorption film and evaporation is triggered by cavitation. When the window is large enough, the capillary condensation shifts to a pressure higher than that of the isolated pore, and the possibility for the equilibrium mechanism of desorption is revealed. These finding may have important implications for practical problems of assessment of the pore size distributions in mesoporous materials with cagelike pore networks.

  12. Study of Atoms and Molecules with Auxiliary-Field Quantum Monte Carlo

    Science.gov (United States)

    Purwanto, Wirawan; Suewattana, Malliga; Krakauer, Henry; Zhang, Shiwei; Walter, Eric J.

    2006-03-01

    We study the ground-state properties of second-row atoms and molecules using the phaseless auxiliary-field quantum Monte Carlo (AF QMC) method. This method projects the many-body ground state from a trial wave function by means of random walks in the Slater-determinant space. We use a single Slater-determinant trial wave function obtained from density-functional theory (DFT) or Hartree-Fock (HF) calculations. The calculations were done with a plane-wave basis and supercells with periodic boundary condition. We investigate the finite-size effects and the accuracy of pseudopotentials within DFT, HF, and AF QMC frameworks. Pseudopotentials generated from both LDA (OPIUM) and HF are employed. We find that the many-body QMC calculations show a greater sensitivity to the accuracy of the pseudopotentials. With reliable pseudopotentials, the ionization potentials and dissociation energies obtained using AF QMC are in excellent agreement with the experimental results. S. Zhang and H. Krakauer, Phys. Rev. Lett. 90, 136401 (2003) http://opium.sourceforge.net I. Ovcharenko, A. Aspuru-Guzik, and W. A. Lester, J. Chem. Phys. 114, 7790 (2001)

  13. TRIMARAN: a three dimensional multigroup P1 Monte Carlo code for criticality studies

    International Nuclear Information System (INIS)

    Ermumcu, G.; Gonnord, J.; Nimal, J.C.

    1980-01-01

    TRIMARAN is developed for safety analysis of nuclear components containing fissionable materials: shipping casks, storage and cooling pools, manufacture and reprocessing plants. It solves the transport equation by Monte Carlo method, in general three dimensional geometry with multigroup P1 approximation. A special representation of cross sections and numbers has been developed in order to reduce considerably the computing cost and allow this three dimensional code to compete with standard numerical program used in parametric studies

  14. Effect of Polarization on the Mobility of C60: A Kinetic Monte Carlo Study.

    Science.gov (United States)

    Volpi, Riccardo; Kottravel, Sathish; Nørby, Morten Steen; Stafström, Sven; Linares, Mathieu

    2016-02-09

    We present a study of mobility field and temperature dependence for C60 with Kinetic Monte Carlo simulations. We propose a new scheme to take into account polarization effects in organic materials through atomic induced dipoles on nearby molecules. This leads to an energy correction for the single site energies and to an external reorganization happening after each hopping. The inclusion of polarization allows us to obtain a good agreement with experiments for both mobility field and temperature dependence.

  15. Monte Carlo study of the mechanisms of transport of fast neutrons in various media

    International Nuclear Information System (INIS)

    Ku, L.

    1976-01-01

    The technique of analyzing Monte Carlo histories was used to study the details of neutron transport and slowing down mechanisms. The statistical properties of life histories of ''exceptional'' neutrons, i.e., those staying closer to the source or penetrating to larger distances from the source, were compared to those of the general population. The macroscopic behavior of ''exceptional'' neutrons was also related to the interaction mechanics and to the microscopic properties of the medium

  16. Effect of the surface charge discretization on electric double layers. A Monte Carlo simulation study

    OpenAIRE

    Madurga Díez, Sergio; Martín-Molina, Alberto; Vilaseca i Font, Eudald; Mas i Pujadas, Francesc; Quesada-Pérez, Manuel

    2007-01-01

    The structure of the electric double layer in contact with discrete and continuously charged planar surfaces is studied within the framework of the primitive model through Monte Carlo simulations. Three different discretization models are considered together with the case of uniform distribution. The effect of discreteness is analyzed in terms of charge density profiles. For point surface groups,a complete equivalence with the situation of uniformly distributed charge is found if profiles are...

  17. TRIMARAN: a three dimensional multigroup P1 Monte Carlo code for criticallity studies

    International Nuclear Information System (INIS)

    Ermuncu, G.; Gonnord, J.; Nimal, J.C.

    1980-04-01

    TRIMARAN is developed for safety analysis of nuclar components containing fissionnable materials: shipping casks, storage and cooling pools, manufacture and reprocessing plants. It solves the transport equation by Monte Carlo method in general three dimensional geometry with multigroup P1 approximation. A special representation of cross sections and numbers has been developed in order to reduce considerably the computing cost and allow this three dimensional code to compete with standard numerical program used in parametric studies

  18. QCD Monte-Carlo model tuning studies with CMS data at 13 TeV

    CERN Document Server

    Sunar Cerci, Deniz

    2018-01-01

    New CMS PYTHIA 8 event tunes are presented. The new tunes are obtained using minimum bias and underlying event observables using Monte Carlo configurations with consistent parton distribution functions and strong coupling constant values in the matrix element and the parton shower. Validation and performance studies are presented by comparing the predictions of the new tune to various soft- and hard-QCD measurements at 7, 8 and 13 TeV with CMS.

  19. Variational Monte Carlo studies of electromagnetic structure of few-body nuclei

    International Nuclear Information System (INIS)

    Schiavilla, R.

    1990-01-01

    The electromagnetic structure and dynamic response of A = 2, 3 and 4 nuclei are studied with the Variational Monte Carlo method by using wave functions based on realistic nuclear interactions. Recent results obtained for the elastic form factors of 2 H, 3 H, 3 He and 4 He, the radiative neutron capture on 3 He at thermal energies, and the reaction 4 He(e,e'p) 3 H are reported. 24 refs., 5 figs

  20. Mobility field and mobility temperature dependence in PC61BM: A kinetic Monte-Carlo study

    Science.gov (United States)

    Sousa, Leonardo; Volpi, Riccardo; da Silva Filho, Demétrio Antônio; Linares, Mathieu

    2017-12-01

    A study of electron mobility in a PCBM system is performed by means of analytical considerations and Kinetic Monte Carlo simulations. Orbital energies are calculated at the ZINDO level of theory and successively corrected considering contributions from permanent charges and polarization interactions. The relative importance of these environmental effects is analyzed in details, furthermore the predicted mobilities are compared with experimental results and similar simulations performed in C60.

  1. A clinical study of lung cancer dose calculation accuracy with Monte Carlo simulation.

    Science.gov (United States)

    Zhao, Yanqun; Qi, Guohai; Yin, Gang; Wang, Xianliang; Wang, Pei; Li, Jian; Xiao, Mingyong; Li, Jie; Kang, Shengwei; Liao, Xiongfei

    2014-12-16

    The accuracy of dose calculation is crucial to the quality of treatment planning and, consequently, to the dose delivered to patients undergoing radiation therapy. Current general calculation algorithms such as Pencil Beam Convolution (PBC) and Collapsed Cone Convolution (CCC) have shortcomings in regard to severe inhomogeneities, particularly in those regions where charged particle equilibrium does not hold. The aim of this study was to evaluate the accuracy of the PBC and CCC algorithms in lung cancer radiotherapy using Monte Carlo (MC) technology. Four treatment plans were designed using Oncentra Masterplan TPS for each patient. Two intensity-modulated radiation therapy (IMRT) plans were developed using the PBC and CCC algorithms, and two three-dimensional conformal therapy (3DCRT) plans were developed using the PBC and CCC algorithms. The DICOM-RT files of the treatment plans were exported to the Monte Carlo system to recalculate. The dose distributions of GTV, PTV and ipsilateral lung calculated by the TPS and MC were compared. For 3DCRT and IMRT plans, the mean dose differences for GTV between the CCC and MC increased with decreasing of the GTV volume. For IMRT, the mean dose differences were found to be higher than that of 3DCRT. The CCC algorithm overestimated the GTV mean dose by approximately 3% for IMRT. For 3DCRT plans, when the volume of the GTV was greater than 100 cm(3), the mean doses calculated by CCC and MC almost have no difference. PBC shows large deviations from the MC algorithm. For the dose to the ipsilateral lung, the CCC algorithm overestimated the dose to the entire lung, and the PBC algorithm overestimated V20 but underestimated V5; the difference in V10 was not statistically significant. PBC substantially overestimates the dose to the tumour, but the CCC is similar to the MC simulation. It is recommended that the treatment plans for lung cancer be developed using an advanced dose calculation algorithm other than PBC. MC can accurately

  2. Study on critical effect in lattice homogenization via Monte Carlo method

    International Nuclear Information System (INIS)

    Li Mancang; Wang Kan; Yao Dong

    2012-01-01

    In contrast to the traditional deterministic lattice codes, generating the homogenization multigroup constants via Monte Carlo method overcomes the difficulties in geometry and treats energy in continuum. thus provides more accuracy parameters. An infinite lattice of identical symmetric motives is usually assumed when performing the homogenization. However, the finite size of a reactor is reality and it should influence the lattice calculation. In practice of the homogenization with Monte Carlo method, B N theory is applied to take the leakage effect into account. The fundamental mode with the buckling B is used as a measure of the finite size. The critical spectrum in the solution of 0-dimensional fine-group B 1 equations is used to correct the weighted spectrum for homogenization. A PWR prototype core is examined to verify that the presented method indeed generates few group constants effectively. In addition, a zero power physical experiment verification is performed. The results show that B N theory is adequate for leakage correction in the multigroup constants generation via Monte Carlo method. (authors)

  3. Study of the variance of a Monte Carlo calculation. Application to weighting; Etude de la variance d'un calcul de Monte Carlo. Application a la ponderation

    Energy Technology Data Exchange (ETDEWEB)

    Lanore, Jeanne-Marie [Commissariat a l' Energie Atomique - CEA, Centre d' Etudes Nucleaires de Fontenay-aux-Roses, Direction des Piles Atomiques, Departement des Etudes de Piles, Service d' Etudes de Protections de Piles (France)

    1969-04-15

    One of the main difficulties in Monte Carlo computations is the estimation of the results variance. Generally, only an apparent variance can be observed over a few calculations, often very different from the actual variance. By studying a large number of short calculations, the authors have tried to evaluate the real variance, and then to apply the obtained results to the optimization of the computations. The program used is the Poker one-dimensional Monte Carlo program. Calculations are performed in two types of fictitious environments: a body with constant cross section, without absorption, where all shocks are elastic and isotropic; a body with variable cross section (presenting a very pronounced peak and hole), with an anisotropy for high energy elastic shocks, and with the possibility of inelastic shocks (this body presents all the features that can appear in a real case)

  4. Simulation and study on the γ response spectrum of BGO detector by the application of monte carlo code MOCA

    International Nuclear Information System (INIS)

    Jia Wenbao; Chen Xiaowen; Xu Aiguo; Li Anmin

    2010-01-01

    Application of Monte Carlo method to build spectra library is useful to reduce experiment workload in Prompt Gamma Neutron Activation Analysis (PGNAA). The new Monte Carlo Code MOCA was used to simulate the response spectra of BGO detector for gamma rays from 137 Cs, 60 Co and neutron induced gamma rays from S and Ti. The results were compared with general code MCNP, show that the agreement of MOCA between simulation and experiment is better than MCNP. This research indicates that building spectra library by Monte Carlo method is feasible. (authors)

  5. Correction for FDG PET dose extravasations: Monte Carlo validation and quantitative evaluation of patient studies

    Energy Technology Data Exchange (ETDEWEB)

    Silva-Rodríguez, Jesús, E-mail: jesus.silva.rodriguez@sergas.es; Aguiar, Pablo, E-mail: pablo.aguiar.fernandez@sergas.es [Fundación Ramón Domínguez, Santiago de Compostela, Galicia (Spain); Servicio de Medicina Nuclear, Complexo Hospitalario Universidade de Santiago de Compostela (USC), 15782, Galicia (Spain); Grupo de Imaxe Molecular, Instituto de Investigación Sanitarias (IDIS), Santiago de Compostela, 15706, Galicia (Spain); Sánchez, Manuel; Mosquera, Javier; Luna-Vega, Víctor [Servicio de Radiofísica y Protección Radiológica, Complexo Hospitalario Universidade de Santiago de Compostela (USC), 15782, Galicia (Spain); Cortés, Julia; Garrido, Miguel [Servicio de Medicina Nuclear, Complexo Hospitalario Universitario de Santiago de Compostela, 15706, Galicia, Spain and Grupo de Imaxe Molecular, Instituto de Investigación Sanitarias (IDIS), Santiago de Compostela, 15706, Galicia (Spain); Pombar, Miguel [Servicio de Radiofísica y Protección Radiológica, Complexo Hospitalario Universitario de Santiago de Compostela, 15706, Galicia (Spain); Ruibal, Álvaro [Servicio de Medicina Nuclear, Complexo Hospitalario Universidade de Santiago de Compostela (USC), 15782, Galicia (Spain); Grupo de Imaxe Molecular, Instituto de Investigación Sanitarias (IDIS), Santiago de Compostela, 15706, Galicia (Spain); Fundación Tejerina, 28003, Madrid (Spain)

    2014-05-15

    Purpose: Current procedure guidelines for whole body [18F]fluoro-2-deoxy-D-glucose (FDG)-positron emission tomography (PET) state that studies with visible dose extravasations should be rejected for quantification protocols. Our work is focused on the development and validation of methods for estimating extravasated doses in order to correct standard uptake value (SUV) values for this effect in clinical routine. Methods: One thousand three hundred sixty-seven consecutive whole body FDG-PET studies were visually inspected looking for extravasation cases. Two methods for estimating the extravasated dose were proposed and validated in different scenarios using Monte Carlo simulations. All visible extravasations were retrospectively evaluated using a manual ROI based method. In addition, the 50 patients with higher extravasated doses were also evaluated using a threshold-based method. Results: Simulation studies showed that the proposed methods for estimating extravasated doses allow us to compensate the impact of extravasations on SUV values with an error below 5%. The quantitative evaluation of patient studies revealed that paravenous injection is a relatively frequent effect (18%) with a small fraction of patients presenting considerable extravasations ranging from 1% to a maximum of 22% of the injected dose. A criterion based on the extravasated volume and maximum concentration was established in order to identify this fraction of patients that might be corrected for paravenous injection effect. Conclusions: The authors propose the use of a manual ROI based method for estimating the effectively administered FDG dose and then correct SUV quantification in those patients fulfilling the proposed criterion.

  6. The proton therapy nozzles at Samsung Medical Center: A Monte Carlo simulation study using TOPAS

    Science.gov (United States)

    Chung, Kwangzoo; Kim, Jinsung; Kim, Dae-Hyun; Ahn, Sunghwan; Han, Youngyih

    2015-07-01

    To expedite the commissioning process of the proton therapy system at Samsung Medical Center (SMC), we have developed a Monte Carlo simulation model of the proton therapy nozzles by using TOol for PArticle Simulation (TOPAS). At SMC proton therapy center, we have two gantry rooms with different types of nozzles: a multi-purpose nozzle and a dedicated scanning nozzle. Each nozzle has been modeled in detail following the geometry information provided by the manufacturer, Sumitomo Heavy Industries, Ltd. For this purpose, the novel features of TOPAS, such as the time feature or the ridge filter class, have been used, and the appropriate physics models for proton nozzle simulation have been defined. Dosimetric properties, like percent depth dose curve, spreadout Bragg peak (SOBP), and beam spot size, have been simulated and verified against measured beam data. Beyond the Monte Carlo nozzle modeling, we have developed an interface between TOPAS and the treatment planning system (TPS), RayStation. An exported radiotherapy (RT) plan from the TPS is interpreted by using an interface and is then translated into the TOPAS input text. The developed Monte Carlo nozzle model can be used to estimate the non-beam performance, such as the neutron background, of the nozzles. Furthermore, the nozzle model can be used to study the mechanical optimization of the design of the nozzle.

  7. Scattered dose to thyroid from prophylactic cranial irradiation during childhood: a Monte Carlo study

    International Nuclear Information System (INIS)

    Mazonakis, Michalis; Tzedakis, Antonis; Damilakis, John; Varveris, Haris; Kachris, Stefanos; Gourtsoyiannis, Nicholas

    2006-01-01

    The purpose of this study was to estimate the scattered dose to thyroid from prophylactic cranial irradiation during childhood. The MCNP transport code and mathematical phantoms representing the average individual at ages 3, 5, 10, 15 and 18 years old were employed to simulate cranial radiotherapy using two lateral opposed fields. The mean radiation dose received by the thyroid gland was calculated. A 10 cm thick lead block placed on the patient's couch to shield the thyroid was simulated by MCNP code. The Monte Carlo model was validated by measuring the scattered dose to the unshielded and shielded thyroid using three different humanoid phantoms and thermoluminescense dosimetry. For a cranial dose of 18 Gy, the thyroid dose obtained by Monte Carlo calculations varied from 47 to 79 cGy depending upon the age of the child. Appropriate placement of the couch block resulted in a thyroid dose reduction by 39 to 54%. Thyroid dose values at all possible positions of the radiosensitive gland with respect to the inferior field edge at five different patient ages were found. The mean difference between Monte Carlo results and thyroid dose measurements was 9.6%. (note)

  8. Monte Carlo theory and practice

    International Nuclear Information System (INIS)

    James, F.

    1987-01-01

    Historically, the first large-scale calculations to make use of the Monte Carlo method were studies of neutron scattering and absorption, random processes for which it is quite natural to employ random numbers. Such calculations, a subset of Monte Carlo calculations, are known as direct simulation, since the 'hypothetical population' of the narrower definition above corresponds directly to the real population being studied. The Monte Carlo method may be applied wherever it is possible to establish equivalence between the desired result and the expected behaviour of a stochastic system. The problem to be solved may already be of a probabilistic or statistical nature, in which case its Monte Carlo formulation will usually be a straightforward simulation, or it may be of a deterministic or analytic nature, in which case an appropriate Monte Carlo formulation may require some imagination and may appear contrived or artificial. In any case, the suitability of the method chosen will depend on its mathematical properties and not on its superficial resemblance to the problem to be solved. The authors show how Monte Carlo techniques may be compared with other methods of solution of the same physical problem

  9. 3D calculation of absorbed dose for 131I-targeted radiotherapy: A Monte Carlo study

    International Nuclear Information System (INIS)

    Saeedzadeh, E.; Sarkar, S.; Abbaspour Tehrani-Fard, A.; Ay, M. R.; Khosravi, H. R.; Loudos, G.

    2008-01-01

    Various methods, such as those developed by the Medical Internal Radiation Dosimetry (MIRD) Committee of the Society of Nuclear Medicine or employing dose point kernels, have been applied to the radiation dosimetry of 131 I radionuclide therapy. However, studies have not shown a strong relationship between tumour absorbed dose and its overall therapeutic response, probably due in part to inaccuracies in activity and dose estimation. In the current study, the GATE Monte Carlo computer code was used to facilitate voxel-level radiation dosimetry for organ activities measured in an. 131 I-treated thyroid cancer patient. This approach allows incorporation of the size, shape and composition of organs (in the current study, in the Zubal anthropomorphic phantom) and intra-organ and intra-tumour inhomogeneities in the activity distributions. The total activities of the tumours and their heterogeneous distributions were measured from the SPECT images to calculate the dose maps. For investigating the effect of activity distribution on dose distribution, a hypothetical homogeneous distribution of the same total activity was considered in the tumours. It was observed that the tumour mean absorbed dose rates per unit cumulated activity were 0.65 E-5 and 0.61 E-5 mGY MBq -1 s -1 for the uniform and non-uniform distributions in the tumour, respectively, which do not differ considerably. However, the dose-volume histograms (DVH) show that the tumour non-uniform activity distribution decreases the absorbed dose to portions of the tumour volume. In such a case, it can be misleading to quote the mean or maximum absorbed dose, because overall response is likely limited by the tumour volume that receives low (i.e. non-cytocidal) doses. Three-dimensional radiation dosimetry, and calculation of tumour DVHs, may lead to the derivation of clinically reliable dose-response relationships and therefore may ultimately improve treatment planning as well as response assessment for radionuclide

  10. Intensity modulated radiation therapy using laser-accelerated protons: a Monte Carlo dosimetric study

    International Nuclear Information System (INIS)

    Fourkal, E; Li, J S; Xiong, W; Nahum, A; Ma, C-M

    2003-01-01

    In this paper we present Monte Carlo studies of intensity modulated radiation therapy using laser-accelerated proton beams. Laser-accelerated protons coming out of a solid high-density target have broad energy and angular spectra leading to dose distributions that cannot be directly used for therapeutic applications. Through the introduction of a spectrometer-like particle selection system that delivers small pencil beams of protons with desired energy spectra it is feasible to use laser-accelerated protons for intensity modulated radiotherapy. The method presented in this paper is a three-dimensional modulation in which the proton energy spectrum and intensity of each individual beamlet are modulated to yield a homogeneous dose in both the longitudinal and lateral directions. As an evaluation of the efficacy of this method, it has been applied to two prostate cases using a variety of beam arrangements. We have performed a comparison study between intensity modulated photon plans and those for laser-accelerated protons. For identical beam arrangements and the same optimization parameters, proton plans exhibit superior coverage of the target and sparing of neighbouring critical structures. Dose-volume histogram analysis of the resulting dose distributions shows up to 50% reduction of dose to the critical structures. As the number of fields is decreased, the proton modality exhibits a better preservation of the optimization requirements on the target and critical structures. It is shown that for a two-beam arrangement (parallel-opposed) it is possible to achieve both superior target coverage with 5% dose inhomogeneity within the target and excellent sparing of surrounding tissue

  11. Monte Carlo simulations of adult and pediatric computed tomography exams: Validation studies of organ doses with physical phantoms

    International Nuclear Information System (INIS)

    Long, Daniel J.; Lee, Choonsik; Tien, Christopher; Fisher, Ryan; Hoerner, Matthew R.; Hintenlang, David; Bolch, Wesley E.

    2013-01-01

    Purpose: To validate the accuracy of a Monte Carlo source model of the Siemens SOMATOM Sensation 16 CT scanner using organ doses measured in physical anthropomorphic phantoms. Methods: The x-ray output of the Siemens SOMATOM Sensation 16 multidetector CT scanner was simulated within the Monte Carlo radiation transport code, MCNPX version 2.6. The resulting source model was able to perform various simulated axial and helical computed tomographic (CT) scans of varying scan parameters, including beam energy, filtration, pitch, and beam collimation. Two custom-built anthropomorphic phantoms were used to take dose measurements on the CT scanner: an adult male and a 9-month-old. The adult male is a physical replica of University of Florida reference adult male hybrid computational phantom, while the 9-month-old is a replica of University of Florida Series B 9-month-old voxel computational phantom. Each phantom underwent a series of axial and helical CT scans, during which organ doses were measured using fiber-optic coupled plastic scintillator dosimeters developed at University of Florida. The physical setup was reproduced and simulated in MCNPX using the CT source model and the computational phantoms upon which the anthropomorphic phantoms were constructed. Average organ doses were then calculated based upon these MCNPX results. Results: For all CT scans, good agreement was seen between measured and simulated organ doses. For the adult male, the percent differences were within 16% for axial scans, and within 18% for helical scans. For the 9-month-old, the percent differences were all within 15% for both the axial and helical scans. These results are comparable to previously published validation studies using GE scanners and commercially available anthropomorphic phantoms. Conclusions: Overall results of this study show that the Monte Carlo source model can be used to accurately and reliably calculate organ doses for patients undergoing a variety of axial or helical CT

  12. Studies on top-quark Monte Carlo modelling for Top2016

    CERN Document Server

    The ATLAS collaboration

    2016-01-01

    This note summarises recent studies on Monte Carlo simulation setups of top-quark pair production used by the ATLAS experiment and presents a new method to deal with interference effects for the $Wt$ single-top-quark production which is compared against previous techniques. The main focus for the top-quark pair production is on the improvement of the modelling of the Powheg generator interfaced to the Pythia8 and Herwig7 shower generators. The studies are done using unfolded data at centre-of-mass energies of 7, 8, and 13 TeV.

  13. Monte Carlo study of radiation-induced demagnetization using the two-dimensional Ising model

    International Nuclear Information System (INIS)

    Samin, Adib; Cao, Lei

    2015-01-01

    A simple radiation-damage model based on the Ising model for magnets is proposed to study the effects of radiation on the magnetism of permanent magnets. The model is studied in two dimensions using a Monte Carlo simulation, and it accounts for the radiation through the introduction of a localized heat pulse. The model exhibits qualitative agreement with experimental results, and it clearly elucidates the role that the coercivity and the radiation particle’s energy play in the process. A more quantitative agreement with experiment will entail accounting for the long-range dipole–dipole interactions and the crystalline anisotropy.

  14. Monte Carlo study of radiation-induced demagnetization using the two-dimensional Ising model

    Energy Technology Data Exchange (ETDEWEB)

    Samin, Adib; Cao, Lei

    2015-10-01

    A simple radiation-damage model based on the Ising model for magnets is proposed to study the effects of radiation on the magnetism of permanent magnets. The model is studied in two dimensions using a Monte Carlo simulation, and it accounts for the radiation through the introduction of a localized heat pulse. The model exhibits qualitative agreement with experimental results, and it clearly elucidates the role that the coercivity and the radiation particle’s energy play in the process. A more quantitative agreement with experiment will entail accounting for the long-range dipole–dipole interactions and the crystalline anisotropy.

  15. Integrated logistic support studies using behavioral Monte Carlo simulation, supported by Generalized Stochastic Petri Nets

    International Nuclear Information System (INIS)

    Garnier, Robert; Chevalier, Marcel

    2000-01-01

    Studying large and complex industrial sites, requires more and more accuracy in modeling. In particular, when considering Spares, Maintenance and Repair / Replacement processes, determining optimal Integrated Logistic Support policies requires a high level modeling formalism, in order to make the model as close as possible to the real considered processes. Generally, numerical methods are used to process this kind of study. In this paper, we propose an alternate way to process optimal Integrated Logistic Support policy determination when dealing with large, complex and distributed multi-policies industrial sites. This method is based on the use of behavioral Monte Carlo simulation, supported by Generalized Stochastic Petri Nets. (author)

  16. Spin flip statistics and spin wave interference patterns in Ising ferromagnetic films: A Monte Carlo study.

    Science.gov (United States)

    Acharyya, Muktish

    2017-07-01

    The spin wave interference is studied in two dimensional Ising ferromagnet driven by two coherent spherical magnetic field waves by Monte Carlo simulation. The spin waves are found to propagate and interfere according to the classic rule of interference pattern generated by two point sources. The interference pattern of spin wave is observed in one boundary of the lattice. The interference pattern is detected and studied by spin flip statistics at high and low temperatures. The destructive interference is manifested as the large number of spin flips and vice versa.

  17. Applications of Monte Carlo codes to a study of gamma-ray buildup factors, skyshine and duct streaming

    Energy Technology Data Exchange (ETDEWEB)

    Hirayama, H. [High Energy Accelerator Research Organization (KEK), Ibaraki (Japan)

    2001-07-01

    Many shielding calculations for gamma-rays have continued to rely on point-kernel methods incorporating buildup factor data. Line beam or conical beam response functions, which are calculated using a Monte Carlo code, for skyshine problems are useful to estimate the skyshine dose from various facilities. A simple calculation method for duct streaming was proposed using the parameters calculated by the Monte Carlo code. It is therefore important to study, improve and produce basic parameters related to old, but still important, problems in the fields of radiation shielding using the Monte Carlo code. In this paper, these studies performed by several groups in Japan as applications of the Monte Carlo method are discussed. (orig.)

  18. EFECTIVIDAD DEL USO LOCAL DE INFUSION DE PIPER ANGUSTIFOLIUM (MATICO) EN COMPARACIÓN CON EL AGUA Y JABON EN LA CICATRIZACION DE LA EPISIORRAFIA EN PUERPERAS ATENDIDAS EN EL CENTRO DE SALUD CARLOS SHOWING FERRARI 2016

    OpenAIRE

    Luyo Marcellini, Delci Fiorella

    2017-01-01

    Objetivo: Determinar la Efectividad del uso local de infusión de Piper Angustifolium (matico) en comparación con el agua y jabón en la cicatrización de la Episiorrafia en puérperas atendidas en el Centro de Salud Carlos Showing Ferrari Showing Ferrari 2016. Metodología: Según la intervención del investigador será de tipo experimental. Según la planificación será de tipo prospectivo. Según la interacción de veces que se medirá las variables será de tipo longitudinal. Y según e la interacción d...

  19. Study of the response of a lithium yttrium borate scintillator based neutron rem counter by Monte Carlo radiation transport simulations

    Science.gov (United States)

    Sunil, C.; Tyagi, Mohit; Biju, K.; Shanbhag, A. A.; Bandyopadhyay, T.

    2015-12-01

    The scarcity and the high cost of 3He has spurred the use of various detectors for neutron monitoring. A new lithium yttrium borate scintillator developed in BARC has been studied for its use in a neutron rem counter. The scintillator is made of natural lithium and boron, and the yield of reaction products that will generate a signal in a real time detector has been studied by FLUKA Monte Carlo radiation transport code. A 2 cm lead introduced to enhance the gamma rejection shows no appreciable change in the shape of the fluence response or in the yield of reaction products. The fluence response when normalized at the average energy of an Am-Be neutron source shows promise of being used as rem counter.

  20. Study of the response of a lithium yttrium borate scintillator based neutron rem counter by Monte Carlo radiation transport simulations

    Energy Technology Data Exchange (ETDEWEB)

    Sunil, C., E-mail: csunil11@gmail.com [Accelerator Radiation Safety Section, Health Physics Division, Bhabha Atomic Research Centre, Mumbai 400085 (India); Tyagi, Mohit [Technical Physics Division, Bhabha Atomic Research Centre, Mumbai 400085 (India); Biju, K.; Shanbhag, A.A.; Bandyopadhyay, T. [Accelerator Radiation Safety Section, Health Physics Division, Bhabha Atomic Research Centre, Mumbai 400085 (India)

    2015-12-11

    The scarcity and the high cost of {sup 3}He has spurred the use of various detectors for neutron monitoring. A new lithium yttrium borate scintillator developed in BARC has been studied for its use in a neutron rem counter. The scintillator is made of natural lithium and boron, and the yield of reaction products that will generate a signal in a real time detector has been studied by FLUKA Monte Carlo radiation transport code. A 2 cm lead introduced to enhance the gamma rejection shows no appreciable change in the shape of the fluence response or in the yield of reaction products. The fluence response when normalized at the average energy of an Am–Be neutron source shows promise of being used as rem counter.

  1. Magnetic properties of Ni/Au core/shell studied by Monte Carlo simulations

    Energy Technology Data Exchange (ETDEWEB)

    Masrour, R., E-mail: rachidmasrour@hotmail.com [Laboratory of Materials, Processes, Environment and Quality, Cady Ayyed University, National School of Applied Sciences, Sidi Bouzid, Safi, 63 4600 (Morocco); LMPHE (URAC 12), Faculté des Sciences, Université Mohammed V-Agdal, Av. Ibn Batouta, B.P. 1014, Rabat (Morocco); Bahmad, L. [LMPHE (URAC 12), Faculté des Sciences, Université Mohammed V-Agdal, Av. Ibn Batouta, B.P. 1014, Rabat (Morocco); Hamedoun, M. [Institute of Nanomaterials and Nanotechnologies, MAScIR, Rabat (Morocco); Benyoussef, A. [LMPHE (URAC 12), Faculté des Sciences, Université Mohammed V-Agdal, Av. Ibn Batouta, B.P. 1014, Rabat (Morocco); Institute of Nanomaterials and Nanotechnologies, MAScIR, Rabat (Morocco); Hassan II Academy of Science and Technology, Rabat (Morocco); Hlil, E.K. [Institut Néel, CNRS et Université Joseph Fourier, BP 166, F-38042 Grenoble cedex 9 (France)

    2014-01-10

    The magnetic properties of ferromagnetic Ni/Au core/shell have been studied using Monte Carlo simulations within the Ising model framework. The considered Hamiltonian includes the exchange interactions between Ni–Ni, Au–Au and Ni–Au and the external magnetic field. The thermal total magnetizations and total magnetic susceptibilities of core/shell Ni/Au are computed. The critical temperature is deduced. The exchange interaction between Ni and Au atoms is obtained. In addition, the total magnetizations versus the external magnetic field and crystal filed for different temperature are also established.

  2. Exposition to 137Cs deposited in soil: A Monte Carlo study

    International Nuclear Information System (INIS)

    Silveira, Lucas M. da; Pereira, Marco A. M.; Belinato, Walmir

    2017-01-01

    In the event of environmental contamination with radioactive materials, one of the most dangerous materials is 137 Cs. In order to evaluate the radiation doses involved in an environmental contamination of soil, with 137 Cs, we carried out a computational dosimetric study. We determined the radiation doses conversion coefficients (CC) for E and H T , using a male and a female anthropomorphic phantom, coupled with the MCNPX (2.7.1) Monte Carlo simulation software, for three different types of soil. The highest CC[H T ] values were for the gonads and skin (male) and bone marrow and skin (female). We found no difference for the different types of soil. (author)

  3. Magnetic layering transitions in a polyamidoamine (PAMAM) dendrimer nano-structure: Monte Carlo study

    Science.gov (United States)

    Ziti, S.; Aouini, S.; Labrim, H.; Bahmad, L.

    2017-02-01

    We study the magnetic layering transitions in a polyamidoamine (PAMAM) dendrimer nano-structure, under the effect of an external magnetic field. We examine the magnetic properties, of this model of the spin S=1 Ising ferromagnetic in real nanostructure used in several scientific domains. For T=0, we give and discuss the ground state phase diagrams. At non null temperatures, we applied the Monte Carlo simulations giving important results summarized in the form of the phase diagrams. We also analyzed the effect of varying the external magnetic field, and found the layering transitions in the polyamidoamine (PAMAM) dendrimer nano-structure.

  4. Monte Carlo studies on Cathode Strip/Pad Chambers for the ALICE Di-Muon Arm

    Energy Technology Data Exchange (ETDEWEB)

    Wurzinger, R.; Le Bornec, Y.; Willis, N.

    1996-04-01

    A general overview about the properties of Cathode Strip and Pad Chambers is given. Position finding methods are discussed and compared within Monte Carlo studies. Noise contributions and their minimization are discussed. Pad chambers allow a two-dimensional readout with spatial resolution of {sigma} < 100 {mu}m in direction parallel to the anode wire. The resolution normal to the anode wire depends mainly on the wire spacing. Special attention is paid on the double-hit resolution capability of the pad chamber. An outlook is given on the possible utilisation of Cathode Pad Chambers in the Di-Muon Arm of the ALICE detector at LHC. (author). 44 refs.

  5. Monte Carlo simulation study of the muon-induced neutron flux at LNGS

    International Nuclear Information System (INIS)

    Persiani, R.; Garbini, M.; Massoli, F.; Sartorelli, G; Selvi, M.

    2011-01-01

    Muon-induced neutrons are ultimate background for all the experiments searching for rare events in underground laboratories. Several measurements and simulations were performed concerning the neutron production and propagation but there are disagreements between experimental data and simulations. In this work we present our Monte-Carlo simulation study, based on Geant4, to estimate the muon-induced neutron flux at LNGS. The obtained integral flux of neutrons above 1 MeV is 2.31 x 10 -10 n/cm 2 /s.

  6. Post-processing of Monte Carlo simulations for rapid BNCT source optimization studies

    International Nuclear Information System (INIS)

    Bleuel, D.L.; Chu, W.T.; Donahue, R.J.; Ludewigt, B.A.; Vujic, J.

    2000-01-01

    A great advantage of some neutron sources, such as accelerator-produced sources, is that they can be tuned to produce different spectra. Unfortunately, optimization studies are often time-consuming and difficult, as they require a lengthy Monte Carlo simulation for each source. When multiple characteristics, such as energy, angle, and spatial distribution of a neutron beam are allowed to vary, an overwhelming number of simulations may be required. Many optimization studies, therefore, suffer from a small number of datapoints, restrictive treatment conditions, or poor statistics. By scoring pertinent information from every particle tally in a Monte Carlo simulation, then applying appropriate source variable weight factors in a post-processing algorithm, a single simulation can be used to model any number of multiple sources. Through this method, the response to a new source can be modeled in minutes or seconds, rather than hours or days, allowing for the analysis of truly variable source conditions of much greater resolution than is normally possible when a new simulation must be run for each datapoint in a study. This method has been benchmarked and used to recreate optimization studies in a small fraction of the time spent in the original studies

  7. Post-processing of Monte Carlo simulations for rapid BNCT source optimization studies

    International Nuclear Information System (INIS)

    Bleuel, D.L.; Chu, W.T.; Donahue, R.J.; Ludewigt, B.A.; Vujic, J.

    2000-01-01

    A great advantage of some neutron sources, such as accelerator-produced sources, is that they can be tuned to produce different spectra. Unfortunately, optimization studies are often time-consuming and difficult, as they require a lengthy Monte Carlo simulation for each source. When multiple characteristics, such as energy, angle, and spatial distribution of a neutron beam are allowed to vary, an overwhelming number of simulations may be required. Many optimization studies, therefore, suffer from a small number of data points, restrictive treatment conditions, or poor statistics. By scoring pertinent information from every particle tally in a Monte Carlo simulation, then applying appropriate source variable weight factors in a post-processing algorithm; a single simulation can be used to model any number of multiple sources. Through this method, the response to a new source can be modeled in minutes or seconds, rather than hours or days, allowing for the analysis of truly variable source conditions of much greater resolution than is normally possible when a new simulation must be run for each data point in a study. This method has been benchmarked and used to recreate optimization studies in a small fraction of the time spent in the original studies. (author)

  8. Radiosteoplasty study in animal bone and radiodosimetric evaluation using Monte Carlo code

    Energy Technology Data Exchange (ETDEWEB)

    Silveira, Marcia Flavia; Campos, Tarcisio Passos Ribeiro [Universidade Federal de Minas Gerais (UFMG), Belo Horizonte, MG (Brazil). Dept. de Engenharia Nuclear]. E-mail: marciaflaviafisio@gmail.com; campos@nuclear.ufmg.br

    2007-07-01

    The radiosteoplasty is a procedure that consists of the injection of a radioactive biomaterial incorporated to the bone cement into the osseous structure affected by cancer. This technique has been developed with the major objective to control the tumor or the regional bone metastasis (in situ) besides pain reduction and structural resistance increasing. In the present study the radiosteoplasty is applied to the bovine and swine bones in vitro using non-radioactive cement. The objective is to know the spatial distribution of the cold compound (non radioactive) in pig and ox bones after implant. A 2 mm needle was introduced into the cortical bone previously perforated. The distribution of this biomaterial was observed trough radiological images obtained just after the compound application. Recent dosimetric studies using Monte Carlo N-Particle method (MCNP-5) concluded that the spatial dose distribution is suitable for the protocol namely radiosteoplasty applied to treat bone tumors on superior and inferior members. The Monte Carlo method simulates the present process and it is particularly interesting tool to solve the complex photon and electron particle transport problems that can not be modeled by codes based on deterministic methods. These related radiodosimetric studies are presented and discussed. (author)

  9. Monte Carlo study of one-dimensional confined fluids with Gay-Berne intermolecular potential

    Science.gov (United States)

    Moradi, M.; Hashemi, S.

    2011-11-01

    The thermodynamic quantities of a one dimensional system of particles with Gay-Berne model potential confined between walls have been obtained by means of Monte Carlo computer simulations. For a number of temperatures, the systems were considered and their density profiles, order parameter, pressure, configurational temperature and average potential energy per particle are reported. The results show that by decreasing the temperature, the soft particles become more ordered and they align to the walls and also they don't show any tendency to be near the walls at very low temperatures. We have also changed the structure of the walls by embedding soft ellipses in them, this change increases the total density near the wall whereas, increasing or decreasing the order parameter depend on the angle of embedded ellipses.

  10. A Monte Carlo study comparing PIV, ULS and DWLS in the estimation of dichotomous confirmatory factor analysis.

    Science.gov (United States)

    Nestler, Steffen

    2013-02-01

    We conducted a Monte Carlo study to investigate the performance of the polychoric instrumental variable estimator (PIV) in comparison to unweighted least squares (ULS) and diagonally weighted least squares (DWLS) in the estimation of a confirmatory factor analysis model with dichotomous indicators. The simulation involved 144 conditions (1,000 replications per condition) that were defined by a combination of (a) two types of latent factor models, (b) four sample sizes (100, 250, 500, 1,000), (c) three factor loadings (low, moderate, strong), (d) three levels of non-normality (normal, moderately, and extremely non-normal), and (e) whether the factor model was correctly specified or misspecified. The results showed that when the model was correctly specified, PIV produced estimates that were as accurate as ULS and DWLS. Furthermore, the simulation showed that PIV was more robust to structural misspecifications than ULS and DWLS. © 2012 The British Psychological Society.

  11. A preliminary Monte Carlo study for the treatment head of a carbon-ion radiotherapy facility using TOPAS

    Science.gov (United States)

    Liu, Hongdong; Zhang, Lian; Chen, Zhi; Liu, Xinguo; Dai, Zhongying; Li, Qiang; Xu, Xie George

    2017-09-01

    In medical physics it is desirable to have a Monte Carlo code that is less complex, reliable yet flexible for dose verification, optimization, and component design. TOPAS is a newly developed Monte Carlo simulation tool which combines extensive radiation physics libraries available in Geant4 code, easyto-use geometry and support for visualization. Although TOPAS has been widely tested and verified in simulations of proton therapy, there has been no reported application for carbon ion therapy. To evaluate the feasibility and accuracy of TOPAS simulations for carbon ion therapy, a licensed TOPAS code (version 3_0_p1) was used to carry out a dosimetric study of therapeutic carbon ions. Results of depth dose profile based on different physics models have been obtained and compared with the measurements. It is found that the G4QMD model is at least as accurate as the TOPAS default BIC physics model for carbon ions, but when the energy is increased to relatively high levels such as 400 MeV/u, the G4QMD model shows preferable performance. Also, simulations of special components used in the treatment head at the Institute of Modern Physics facility was conducted to investigate the Spread-Out dose distribution in water. The physical dose in water of SOBP was found to be consistent with the aim of the 6 cm ridge filter.

  12. Magnetic properties of a single iron atomic chain encapsulated in armchair carbon nanotubes: A Monte Carlo study

    Energy Technology Data Exchange (ETDEWEB)

    Masrour, R., E-mail: rachidmasrour@hotmail.com [Laboratory of Materials, Processes, Environment and Quality, Cady Ayyed University, National School of Applied Sciences, PB 63, 46000 Safi (Morocco); Jabar, A. [Laboratory of Materials, Processes, Environment and Quality, Cady Ayyed University, National School of Applied Sciences, PB 63, 46000 Safi (Morocco); Hamedoun, M. [Institute of Nanomaterials and Nanotechnologies, MAScIR, Rabat (Morocco); Benyoussef, A. [Institute of Nanomaterials and Nanotechnologies, MAScIR, Rabat (Morocco); Hassan II Academy of Science and Technology, Rabat (Morocco); Hlil, E.K. [Institut Néel, CNRS, Université Grenoble Alpes, 25 rue des Martyrs BP 166, 38042 Grenoble cedex 9 (France)

    2017-06-15

    Highlights: • Magnetic properties of Fe atom chain wrapped in armchair carbon nanotubes have been studied. • Transition temperature of iron and carbon have been calculated using Monte Carlo simulations. • The multiples magnetic hysteresis have been found. - Abstract: The magnetic properties have been investigated of FeCu{sub x}C{sub 1−x} for a Fe atom chain wrapped in armchair (N,N) carbon nanotubes (N = 4,6,8,10,12) diluted by Cu{sup 2+} ions using Monte Carlo simulations. The thermal total magnetization and magnetic susceptibility are found. The reduced transition temperatures of iron and carbon have been calculated for different N and the exchange interactions. The total magnetization is obtained for different exchange interactions and crystal field. The Magnetic hysteresis cycles are obtained for different N, the reduced temperatures and exchange interactions. The multiple magnetic hysteresis is found. This system shows it can be used as magnetic nanostructure possessing potential current and future applications in permanent magnetism, magnetic recording and spintronics.

  13. Underlying Event studies and Monte Carlo tunes for inelastic pp events with the ATLAS detector

    CERN Document Server

    Nurse, E; The ATLAS collaboration

    2010-01-01

    Studies of the momentum flow in inelastic collisions at 900 GeV and 7 TeV recorded with a minimum bias trigger strategy are reported. A single high pT track is selected, and the distribution of other tracks in the event is evaluated relative to this reference track. The evolution of the charged momentum flow in the rest of the event, as a function of the pT of the reference track, gives important information about the transition from minimum bias event structure to the full underlying event observed in high-pT collision events. Results are presented after correction and unfolding of detector effects to allow simpler comparison to Monte Carlo models. In addition, the PYTHIA Monte Carlo generator has been tuned to ATLAS measurements at 900 GeV and 7 TeV. Standard distributions from Minimum Bias events, as well as the Underlying Event studies are included in the first tunes to ATLAS measurements at the LHC. The tunes aim for one consistent description of the new measurements as well as data from the Tevatron and...

  14. Laser-wakefield accelerators for medical phase contrast imaging: Monte Carlo simulations and experimental studies

    Science.gov (United States)

    Cipiccia, S.; Reboredo, D.; Vittoria, Fabio A.; Welsh, G. H.; Grant, P.; Grant, D. W.; Brunetti, E.; Wiggins, S. M.; Olivo, A.; Jaroszynski, D. A.

    2015-05-01

    X-ray phase contrast imaging (X-PCi) is a very promising method of dramatically enhancing the contrast of X-ray images of microscopic weakly absorbing objects and soft tissue, which may lead to significant advancement in medical imaging with high-resolution and low-dose. The interest in X-PCi is giving rise to a demand for effective simulation methods. Monte Carlo codes have been proved a valuable tool for studying X-PCi including coherent effects. The laser-plasma wakefield accelerators (LWFA) is a very compact particle accelerator that uses plasma as an accelerating medium. Accelerating gradient in excess of 1 GV/cm can be obtained, which makes them over a thousand times more compact than conventional accelerators. LWFA are also sources of brilliant betatron radiation, which are promising for applications including medical imaging. We present a study that explores the potential of LWFA-based betatron sources for medical X-PCi and investigate its resolution limit using numerical simulations based on the FLUKA Monte Carlo code, and present preliminary experimental results.

  15. A united event grand canonical Monte Carlo study of partially doped polyaniline

    Energy Technology Data Exchange (ETDEWEB)

    Byshkin, M. S., E-mail: mbyshkin@unisa.it, E-mail: gmilano@unisa.it; Correa, A. [Modeling Lab for Nanostructure and Catalysis, Dipartimento di Chimica e Biologia and NANOMATES, University of Salerno, 84084, via Ponte don Melillo, Fisciano Salerno (Italy); Buonocore, F. [ENEA Casaccia Research Center, Via Anguillarese 301, 00123 Rome (Italy); Di Matteo, A. [STMicroelectronics, Via Remo de Feo, 1 80022 Arzano, Naples (Italy); IMAST Scarl Piazza Bovio 22, 80133 Naples (Italy); Milano, G., E-mail: mbyshkin@unisa.it, E-mail: gmilano@unisa.it [Modeling Lab for Nanostructure and Catalysis, Dipartimento di Chimica e Biologia and NANOMATES, University of Salerno, 84084, via Ponte don Melillo, Fisciano Salerno (Italy); IMAST Scarl Piazza Bovio 22, 80133 Naples (Italy)

    2013-12-28

    A Grand Canonical Monte Carlo scheme, based on united events combining protonation/deprotonation and insertion/deletion of HCl molecules is proposed for the generation of polyaniline structures at intermediate doping levels between 0% (PANI EB) and 100% (PANI ES). A procedure based on this scheme and subsequent structure relaxations using molecular dynamics is described and validated. Using the proposed scheme and the corresponding procedure, atomistic models of amorphous PANI-HCl structures were generated and studied at different doping levels. Density, structure factors, and solubility parameters were calculated. Their values agree well with available experimental data. The interactions of HCl with PANI have been studied and distribution of their energies has been analyzed. The procedure has also been extended to the generation of PANI models including adsorbed water and the effect of inclusion of water molecules on PANI properties has also been modeled and discussed. The protocol described here is general and the proposed United Event Grand Canonical Monte Carlo scheme can be easily extended to similar polymeric materials used in gas sensing and to other systems involving adsorption and chemical reactions steps.

  16. Design and study of parallel computing environment of Monte Carlo simulation for particle therapy planning using a public cloud-computing infrastructure

    International Nuclear Information System (INIS)

    Yokohama, Noriya

    2013-01-01

    This report was aimed at structuring the design of architectures and studying performance measurement of a parallel computing environment using a Monte Carlo simulation for particle therapy using a high performance computing (HPC) instance within a public cloud-computing infrastructure. Performance measurements showed an approximately 28 times faster speed than seen with single-thread architecture, combined with improved stability. A study of methods of optimizing the system operations also indicated lower cost. (author)

  17. Monte Carlo Studies of Phase Separation in Compressible 2-dim Ising Models

    Science.gov (United States)

    Mitchell, S. J.; Landau, D. P.

    2006-03-01

    Using high resolution Monte Carlo simulations, we study time-dependent domain growth in compressible 2-dim ferromagnetic (s=1/2) Ising models with continuous spin positions and spin-exchange moves [1]. Spins interact with slightly modified Lennard-Jones potentials, and we consider a model with no lattice mismatch and one with 4% mismatch. For comparison, we repeat calculations for the rigid Ising model [2]. For all models, large systems (512^2) and long times (10^ 6 MCS) are examined over multiple runs, and the growth exponent is measured in the asymptotic scaling regime. For the rigid model and the compressible model with no lattice mismatch, the growth exponent is consistent with the theoretically expected value of 1/3 [1] for Model B type growth. However, we find that non-zero lattice mismatch has a significant and unexpected effect on the growth behavior.Supported by the NSF.[1] D.P. Landau and K. Binder, A Guide to Monte Carlo Simulations in Statistical Physics, second ed. (Cambridge University Press, New York, 2005).[2] J. Amar, F. Sullivan, and R.D. Mountain, Phys. Rev. B 37, 196 (1988).

  18. Phase diagram of a symmetric electron–hole bilayer system: a variational Monte Carlo study

    Science.gov (United States)

    Sharma, Rajesh O.; Saini, L. K.; Prasad Bahuguna, Bhagwati

    2018-05-01

    We study the phase diagram of a symmetric electron–hole bilayer system at absolute zero temperature and in zero magnetic field within the quantum Monte Carlo approach. In particular, we conduct variational Monte Carlo simulations for various phases, i.e. the paramagnetic fluid phase, the ferromagnetic fluid phase, the anti-ferromagnetic Wigner crystal phase, the ferromagnetic Wigner crystal phase and the excitonic phase, to estimate the ground-state energy at different values of in-layer density and inter-layer spacing. Slater–Jastrow style trial wave functions, with single-particle orbitals appropriate for different phases, are used to construct the phase diagram in the (r s , d) plane by finding the relative stability of trial wave functions. At very small layer separations, we find that the fluid phases are stable, with the paramagnetic fluid phase being particularly stable at and the ferromagnetic fluid phase being particularly stable at . As the layer spacing increases, we first find that there is a phase transition from the ferromagnetic fluid phase to the ferromagnetic Wigner crystal phase when d reaches 0.4 a.u. at r s   =  20, and before there is a return to the ferromagnetic fluid phase when d approaches 1 a.u. However, for r s   Wigner crystal is stable over the considered range of r s and d. We also find that as r s increases, the critical layer separations for Wigner crystallization increase.

  19. Monte Carlo studies of two-dimensional random-anisotropy magnets

    Science.gov (United States)

    Denholm, D. R.; Sluckin, T. J.

    1993-07-01

    We have carried out a systematic set of Monte Carlo simulations of the Harris-Plischke-Zuckermann lattice model of random magnetic anisotropy on a two-dimensional square lattice, using the classical Metropolis algorithm. We have considered varying temperature T, external magnetic field H (both in the reproducible and irreproducible limits), time scale of the simulation τ in Monte Carlo steps and anisotropy ratio D/J. In the absence of randomness this model reduces to the XY model in two dimensions, which possesses the familiar Kosterlitz-Thouless low-temperature phase with algebraic but no long-range order. In the presence of random anisotropy we find evidence of a low-temperature phase with some disordered features, which might be identified with a spin-glass phase. The low-temperature Kosterlitz-Thouless phase survives at intermediate temperatures for low randomness, but is no longer present for large D/J. We have also studied the high-H approach to perfect order, for which there are theoretical predictions due to Chudnovsky.

  20. Quantum Monte Carlo study of the singlet-triplet transition in ethylene

    International Nuclear Information System (INIS)

    El Akramine, Ouafae; Kollias, Alexander C.; Lester, William A. Jr.

    2003-01-01

    A theoretical study is reported of the transition between the ground state ( 1 A g ) and the lowest triplet state (1 3 B 1u ) of ethylene based on the diffusion Monte Carlo (DMC) variant of the quantum Monte Carlo method. Using DMC trial functions constructed from Hartree-Fock, complete active space self-consistent field and multi-configuration self-consistent field wave functions, we have computed the atomization energy and the heat of formation of both states, and adiabatic and vertical energy differences between these states using both all-electron and effective core potential DMC. The ground state atomization energy and heat of formation are found to agree with experiment to within the error bounds of the computation and experiment. Predictions by DMC of the triplet state atomization energy and heat of formation are presented. The adiabatic singlet-triplet energy difference is found to differ by 5 kcal/mol from the value obtained in a recent photodissociation experiment

  1. Study on Quantification for Multi-unit Seismic PSA Model using Monte Carlo Sampling

    International Nuclear Information System (INIS)

    Oh, Kyemin; Han, Sang Hoon; Jang, Seung-cheol; Park, Jin Hee; Lim, Ho-Gon; Yang, Joon Eon; Heo, Gyunyoung

    2015-01-01

    In existing PSA, frequency for accident sequences occurred in single-unit has been estimated. While multi-unit PSA has to consider various combinations because accident sequence in each units can be different. However, it is difficult to quantify all of combination between inter-units using traditional method such as Minimal Cut Upper Bound (MCUB). For this reason, we used Monte Carlo sampling as a method to quantify multi-unit PSA model. In this paper, Monte Carlo method was used to quantify multi-unit PSA model. The advantage of this method is to consider all of combinations by the increase of number of unit and to calculate nearly exact value compared to other method. However, it is difficult to get detailed information such as minimal cut sets and accident sequence. To solve partially this problem, FTeMC was modified. In multi-unit PSA, quantification for both internal and external multi-unit accidents is the significant issue. Although our result above mentioned was one of the case studies to check application of method suggested in this paper, it is expected that this method can be used in practical assessment for multi-unit risk

  2. Study of magnetic properties for co double-nanorings: Monte Carlo simulation

    International Nuclear Information System (INIS)

    Ye, Qingying; Chen, Shuiyuan; Liu, Jingyao; Huang, Chao; Huang, Shengkai; Huang, Zhigao

    2016-01-01

    In this paper, cobalt double-nanorings (Co D-N-rings) structure model was constructed. Based on Monte-Carlo simulation (MC) method combining with Fast Fourier Transformation and Micromagnetism (FFTM) method, the magnetic properties of Co D-N-rings with different geometric dimensions have been studied. The simulated results indicate that, the magnetization steps in hysteresis loops is the result of the special spin configurations (SCs), i.e., onion-type state and vortex-type state, which are very different from that in many other nanostructures, such as nanometer thin-films, nanotubes, etc. Besides, Co D-N-rings with different geometric dimensions present interesting magnetization behavior, which is determined by the change of both SCs and exchange interaction in Co D-N-rings. - Highlights: • A double-nanorings structure (named as D-N-rings) was proposed to construct cobalt nanometer thin film. • Monte Carlo method combining with FFTM method was used to simulate magnetic properties of the Co D-N-rings. • Magnetization dynamic processes of the Co D-N-rings were obtained and interpreted through the evolutionary process of spin configurations. • Geometric dimensions deeply influence the magnetization behavior of the Co D-N-rings, which is determined by the change of both SCs and exchange interaction.

  3. Wetting and layering transitions in a nano-dendrimer PAMAM structure: Monte Carlo study

    Science.gov (United States)

    Aouini, S.; Ziti, S.; Labrim, H.; Bahmad, L.

    2016-10-01

    This study is based on a nano-model of the dendrimer polyamidoamine (PAMAM). The idea is to examine the magnetic properties of such models in the context of wetting and the layering transitions. The studied system consists of spins σ ={1/2} Ising ferromagnetic in real nanostructure found in different scientific domains. To study this system, we perform Monte Carlo simulations leading to interesting results recapitulated in two classes. The former is the ground state phase diagrams study. The latter is the magnetic properties at non null temperatures. Also, we analyzed the effect of the terms present in the Hamiltonian governing our system such as the external magnetic field and the exchange couplings interactions.

  4. Scatter correction using a primary modulator for dual energy digital radiography: A Monte Carlo simulation study

    Science.gov (United States)

    Jo, Byung-Du; Lee, Young-Jin; Kim, Dae-Hong; Kim, Hee-Joung

    2014-08-01

    In conventional digital radiography (DR) using a dual energy subtraction technique, a significant fraction of the detected photons are scattered within the body, making up the scatter component. Scattered radiation can significantly deteriorate image quality in diagnostic X-ray imaging systems. Various methods of scatter correction, including both measurement- and non-measurement-based methods, have been proposed in the past. Both methods can reduce scatter artifacts in images. However, non-measurement-based methods require a homogeneous object and have insufficient scatter component correction. Therefore, we employed a measurement-based method to correct for the scatter component of inhomogeneous objects from dual energy DR (DEDR) images. We performed a simulation study using a Monte Carlo simulation with a primary modulator, which is a measurement-based method for the DEDR system. The primary modulator, which has a checkerboard pattern, was used to modulate the primary radiation. Cylindrical phantoms of variable size were used to quantify the imaging performance. For scatter estimates, we used discrete Fourier transform filtering, e.g., a Gaussian low-high pass filter with a cut-off frequency. The primary modulation method was evaluated using a cylindrical phantom in the DEDR system. The scatter components were accurately removed using a primary modulator. When the results acquired with scatter correction and without scatter correction were compared, the average contrast-to-noise ratio (CNR) with the correction was 1.35 times higher than that obtained without the correction, and the average root mean square error (RMSE) with the correction was 38.00% better than that without the correction. In the subtraction study, the average CNR with the correction was 2.04 (aluminum subtraction) and 1.38 (polymethyl methacrylate (PMMA) subtraction) times higher than that obtained without the correction. The analysis demonstrated the accuracy of the scatter correction and the

  5. Monte Carlo Study on Gas Pressure Response of He-3 Tube in Neutron Porosity Logging

    Directory of Open Access Journals (Sweden)

    TIAN Li-li;ZHANG Feng;WANG Xin-guang;LIU Jun-tao

    2016-10-01

    Full Text Available Thermal neutrons are detected by (n,p reaction of Helium-3 tube in the compensated neutron logging. The helium gas pressure in the counting area influences neutron detection efficiency greatly, and then it is an important parameter for neutron porosity measurement accuracy. The variation law of counting rates of a near detector and a far one with helium gas pressure under different formation condition was simulated by Monte Carlo method. The results showed that with the increasing of helium pressure the counting rate of these detectors increased firstly and then leveled off. In addition, the neutron counting rate ratio and porosity sensitivity increased slightly, the porosity measurement error decreased exponentially, which improved the measurement accuracy. These research results can provide technical support for selecting the type of Helium-3 detector in developing neutron porosity logging.

  6. Properties of Confined Star-Branched and Linear Chains. A Monte Carlo Simulation Study

    International Nuclear Information System (INIS)

    Romiszowski, P.; Sikorski, A.

    2004-01-01

    A model of linear and star-branched polymer chains confined between two parallel and impenetrable surfaces was built. The polymer chains were restricted to a simple cubic lattice. Two macromolecular architectures of the chain: linear and star branched (consisted of f = 3 branches of equal length) were studied. The excluded volume was the only potential introduced into the model (the athermal system). Monte Carlo simulations were carried out using a sampling algorithm based on chain's local changes of conformation. The simulations were carried out at different confinement conditions: from light to high chain's compression. The scaling of chain's size with the chain length was studied and discussed. The influence of the confinement and the macromolecular architecture on the shape of a chain was studied. The differences in the shape of linear and star-branched chains were pointed out. (author)

  7. Targeting mitochondria in cancer cells using gold nanoparticle-enhanced radiotherapy: A Monte Carlo study

    Energy Technology Data Exchange (ETDEWEB)

    Kirkby, Charles, E-mail: charles.kirkby@albertahealthservices.ca; Ghasroddashti, Esmaeel [Department of Medical Physics, Jack Ady Cancer Centre, Lethbridge, Alberta T1J 1W5 (Canada); Department of Physics and Astronomy, University of Calgary, Calgary, Alberta T2N 1N4 (Canada); Department of Oncology, University of Calgary, Calgary, Alberta T2N 4N2 (Canada)

    2015-02-15

    enhanced, as these simulations show, this work suggests the potential for both a tool to study the role of mitochondria in cellular response to radiation and a novel avenue for radiation therapy in that the mitochondria may be targeted, rather than the nuclear DNA.

  8. Semiclassical Monte Carlo simulation studies of spin dephasing in InP and InSb nanowires

    Directory of Open Access Journals (Sweden)

    Ashish Kumar

    2012-03-01

    Full Text Available We use semiclassical Monte Carlo approach to investigate spin polarized transport in InP and InSb nanowires. D’yakonov-Perel (DP relaxation and Elliott-Yafet (EY relaxation are the two main relaxation mechanisms for spin dephasing in III-V channels. The DP relaxation occurs because of bulk inversion asymmetry (Dresselhaus spin-orbit interaction and structural inversion asymmetry (Rashba spin-orbit interaction. The injection polarization direction studied is that along the length of the channel. The dephasing rate is found to be very strong for InSb as compared to InP which has larger spin dephasing lengths. The ensemble averaged spin components vary differently for both InP and InSb nanowires. The steady state spin distribution also shows a difference between the two III-V nanowires.

  9. Monte Carlo study of internal energy and specific heat of a nano-graphene bilayer in a longitudinal magnetic field

    Energy Technology Data Exchange (ETDEWEB)

    Luo, Xiao-hong; Wang, Wei, E-mail: ww9803@126.com; Chen, Dong-dong; Xu, Si-yuan

    2016-06-15

    The thermodynamic properties of a nano-graphene bilayer, consisting of the upper layer A of spin-3/2 with antiferromagnetic intralayer exchange coupling and the bottom layer B of spin-5/2 with ferromagnetic intralayer exchange coupling, have been studied by the use of Monte Carlo simulation. We find a number of characteristic phenomena. The effects of the exchange coupling, the single-ion anisotropy and the longitudinal magnetic field on the internal energy, the specific heat and the blocking temperature of the mixed-spin bilayer system have been investigated in detail. The internal energy and the specific heat profiles are clarified. In particular, we have found that the specific heat curve may show two peaks phenomenon for appropriate values of the system parameters.

  10. Probability distribution of pitting corrosion depth and rate in underground pipelines: A Monte Carlo study

    International Nuclear Information System (INIS)

    Caleyo, F.; Velazquez, J.C.; Valor, A.; Hallen, J.M.

    2009-01-01

    The probability distributions of external-corrosion pit depth and pit growth rate were investigated in underground pipelines using Monte Carlo simulations. The study combines a predictive pit growth model developed by the authors with the observed distributions of the model variables in a range of soils. Depending on the pipeline age, any of the three maximal extreme value distributions, i.e. Weibull, Frechet or Gumbel, can arise as the best fit to the pitting depth and rate data. The Frechet distribution best fits the corrosion data for long exposure periods. This can be explained by considering the long-term stabilization of the diffusion-controlled pit growth. The findings of the study provide reliability analysts with accurate information regarding the stochastic characteristics of the pitting damage in underground pipelines.

  11. Probability distribution of pitting corrosion depth and rate in underground pipelines: A Monte Carlo study

    Energy Technology Data Exchange (ETDEWEB)

    Caleyo, F. [Departamento de Ingenieria Metalurgica, ESIQIE, IPN, UPALM Edif. 7, Zacatenco, 07738 Mexico, D.F. (Mexico)], E-mail: fcaleyo@gmail.com; Velazquez, J.C. [Departamento de Ingenieria Metalurgica, ESIQIE, IPN, UPALM Edif. 7, Zacatenco, 07738 Mexico, D.F. (Mexico); Valor, A. [Facultad de Fisica, Universidad de La Habana, San Lazaro y L, Vedado, 10400, La Habana (Cuba); Hallen, J.M. [Departamento de Ingenieria Metalurgica, ESIQIE, IPN, UPALM Edif. 7, Zacatenco, 07738 Mexico, D.F. (Mexico)

    2009-09-15

    The probability distributions of external-corrosion pit depth and pit growth rate were investigated in underground pipelines using Monte Carlo simulations. The study combines a predictive pit growth model developed by the authors with the observed distributions of the model variables in a range of soils. Depending on the pipeline age, any of the three maximal extreme value distributions, i.e. Weibull, Frechet or Gumbel, can arise as the best fit to the pitting depth and rate data. The Frechet distribution best fits the corrosion data for long exposure periods. This can be explained by considering the long-term stabilization of the diffusion-controlled pit growth. The findings of the study provide reliability analysts with accurate information regarding the stochastic characteristics of the pitting damage in underground pipelines.

  12. The study of thin film growth by using Monte Carlo method

    International Nuclear Information System (INIS)

    Tandogan, M.; Aktas, S.

    2010-01-01

    Thin film growth was studied by using Monte Carlo simulation method. Three basic models were used in this study. Model A, the gas particles used for the formation of film were under no external effects until they stick on the surface or to another particle which already stickled on the surface to form the film. Model B, gases were drifted towards the surface by an external agent. Model C, where the gas particles in the closed container were always distributed uniformly throughout the container while they are in gas state. The simulations revealed the fact that for an ideal thin film growth Model C gave the best result to prepare a thin film while a thicker but a better quality could be obtained by Model B.

  13. Uni-directional trail sharing by two species of ants a Monte Carlo study

    International Nuclear Information System (INIS)

    Kunduraci, T; Kayacan, O

    2015-01-01

    We study insect traffic, specifically ant traffic on a uni-directional trail which is shared by two species of ants, one of which is ‘good’ at smelling and the other ‘poor’. The two distinct species of ants are placed mixed on the same trail and individuals of both are permitted to make a U-turn when they encounter another ant in front of them. The theoretical scheme for the ant traffic is based on an asymmetric simple exclusion model. The ant traffic on the uni-directional trail is studied as a function of the number of ‘good-smelling’ ants and the evaporation probability of pheromones by keeping the number of ‘poor-smelling ants’ constant during Monte Carlo simulations. (paper)

  14. A Monte Carlo Study of Lambda Hyperon Polarization at BM@N

    Science.gov (United States)

    Suvarieva, D.; Gudima, K.; Zinchenko, A.

    2018-03-01

    Heavy strange objects (hyperons) can provide essential signatures of the excited and compressed baryonic matter. At NICA, it is planned to study hyperons both in the collider mode (MPD detector) and the fixed-target one (BM@N setup). Measurements of strange hyperon polarization can give additional information on the strong interaction mechanisms. In heavy-ion collisions, such measurements are even more valuable since the polarization is expected to be sensitive to characteristics of the QCD medium (vorticity, hydrodynamic helicity) and to QCD anomalous transport. In this analysis, the possibility to measure at BM@N the polarization of the lightest strange hyperon Λ is studied in Monte Carlo event samples of Au + Au collisions produced with the DCM-QGSM generator. It is shown that the detector will allow to measure polarization with a precision required to check the model predictions.

  15. Monte Carlo study of the magnetic properties of GdSb alloys

    Energy Technology Data Exchange (ETDEWEB)

    Masrour, R., E-mail: rachidmasrour@hotmail.com [Laboratory of Materials, Processes, Environment and Quality, Cady Ayyed University, National School of Applied Sciences, Sidi Bouzid, Safi, BP, 46000 63 (Morocco); LMPHE (URAC 12), Faculté des Sciences, Université Mohammed V-Agdal, Av. Ibn Batouta, B.P. 1014, Rabat (Morocco); Bahmad, L. [LMPHE (URAC 12), Faculté des Sciences, Université Mohammed V-Agdal, Av. Ibn Batouta, B.P. 1014, Rabat (Morocco); Hlil, E.K. [Institut Néel, CNRS et Université Joseph Fourier, BP 166, F-38042 Grenoble cedex 9 (France); Hamedoun, M. [Institute of Layers and Nanotechnologies, MAScIR, Rabat (Morocco); Benyoussef, A. [LMPHE (URAC 12), Faculté des Sciences, Université Mohammed V-Agdal, Av. Ibn Batouta, B.P. 1014, Rabat (Morocco); Institute of Layers and Nanotechnologies, MAScIR, Rabat (Morocco); Hassan II Academy of Science and Technology, Rabat (Morocco)

    2014-03-15

    The magnetic properties of antiferromagnetic GdSb layers have been studied using Monte Carlo simulations within the Ising model framework. The considered Hamiltonian includes first nearest-neighbor, an external magnetic field and a crystal field. The thermal magnetizations and magnetic susceptibilities are computed for a fixed size. In addition, the Néel temperature is deduced. The magnetization versus the exchange interactions and crystal field are studied for a fixed system size, N=5, 7 and 9 sites. The magnetic hysteresis cycle versus temperature is also established. - Highlights: • Determination of the Néel temperature of GdSb by MC simulations. • Magnetic hysteresis cycle of GdSb. • Determination of saturation magnetization and field coercive in GdSb.

  16. Toward high-efficiency and detailed Monte Carlo simulation study of the granular flow spallation target

    Science.gov (United States)

    Cai, Han-Jie; Zhang, Zhi-Lei; Fu, Fen; Li, Jian-Yang; Zhang, Xun-Chao; Zhang, Ya-Ling; Yan, Xue-Song; Lin, Ping; Xv, Jian-Ya; Yang, Lei

    2018-02-01

    The dense granular flow spallation target is a new target concept chosen for the Accelerator-Driven Subcritical (ADS) project in China. For the R&D of this kind of target concept, a dedicated Monte Carlo (MC) program named GMT was developed to perform the simulation study of the beam-target interaction. Owing to the complexities of the target geometry, the computational cost of the MC simulation of particle tracks is highly expensive. Thus, improvement of computational efficiency will be essential for the detailed MC simulation studies of the dense granular target. Here we present the special design of the GMT program and its high efficiency performance. In addition, the speedup potential of the GPU-accelerated spallation models is discussed.

  17. Dynamic Monte Carlo study of isolated-gate InAs/AlSb HEMTs

    International Nuclear Information System (INIS)

    Rodilla, H; González, T; Mateos, J; Moschetti, G; Grahn, J

    2011-01-01

    In this work, by means of Monte Carlo simulations, the static and dynamic behavior of isolated-gate InAs/AlSb high electron mobility transistors (Sb-HEMTs) has been studied and compared with experimental results. The influence of the existence of a native oxide under the gate, the value of the surface charges in the gate recess and the possible variation of electron sheet carrier density, n s , have been studied. A decrease in the gate-source capacitance, transconductance and intrinsic cutoff frequency is observed because of the presence of the native oxide, while changes in the value of the surface charges in the recess only introduce a threshold voltage shift. The increase of n s shifts the maximum of the transconductance and intrinsic cutoff frequency to higher values of drain current and improves the agreement with the experimental results

  18. Size effect on magnetic properties of a nano-graphene bilayer structure: A Monte Carlo study

    Energy Technology Data Exchange (ETDEWEB)

    Masrour, R. [Laboratory of Materials, Process, Environment and Quality, Cady Ayyad University, National School of Applied Sciences, Safi (Morocco); Laboratoire de Magnetisme et Physique des Hautes Energies L.M.P.H.E.URAC 12, Universite Mohammed V-Agdal, Faculte des Sciences, B.P. 1014 Rabat (Morocco); Bahmad, L., E-mail: bahmad@fsr.ac.ma [Laboratoire de Magnetisme et Physique des Hautes Energies L.M.P.H.E.URAC 12, Universite Mohammed V-Agdal, Faculte des Sciences, B.P. 1014 Rabat (Morocco); Benyoussef, A. [Laboratoire de Magnetisme et Physique des Hautes Energies L.M.P.H.E.URAC 12, Universite Mohammed V-Agdal, Faculte des Sciences, B.P. 1014 Rabat (Morocco)

    2012-11-15

    In this paper we use the Monte Carlo simulations to investigate the magnetic properties of an Ising ferromagnetic-antiferromagnetic model. The system is based on a nano-graphene structure-like bilayer with two bloc sizes: N=24 and 42 spins. For each size N, the upper layer A is formed with spin -3/2, whereas the lower layer B is composed of spin -5/2. We only consider the first nearest-neighbor interactions between the sites i and j. The magnetic properties are studied, in the absence as well as in the presence of a crystal magnetic field, and an external magnetic field. The increasing temperature and crystal field as well as the inter-layer coupling constant, are also studied for this system sizes N=24 and 42 spins. The zero-field-cooled and the field cooled magnetization behaviors are investigated for different values of external magnetic field and a fixed value of exchange interaction between the two blocs. The magnetizations as well as the magnetic susceptibilities versus the temperature are used in order to obtain blocking temperature. The saturation magnetization and coercive field are also obtained for the two sizes of the studied system. It is found that the blocking temperature decreases on increasing the crystal magnetic field and/or the external magnetic field, for a fixed system size. On the other hand, it is found that the blocking temperature increases on increasing the system size from N=24 to 42 spins, for fixed values of external and the crystal magnetic fields. - Highlights: Black-Right-Pointing-Pointer Magnetic properties of an Ising ferromagnetic-antiferromagnetic bilayer is studied. Black-Right-Pointing-Pointer Monte Carlo simulations are used. Black-Right-Pointing-Pointer Zero-field-cooled (ZFC) and field cooled (FC) magnetization behaviors for nano-graphene are obtained.

  19. SU-F-T-656: Monte Carlo Study On Air Activation Around a Medical Electron Linac

    International Nuclear Information System (INIS)

    Horst, F; Fehrenbacher, G; Zink, K

    2016-01-01

    Purpose: In high energy photon therapy, several radiation protection issues result from photonuclear reactions. The activation of air - directly by photonuclear reactions as well as indirectly by capture of photoneutrons generated inside the linac head - is a major point of concern for the medical staff. The purpose of this study was to estimate the annual effective dose to medical workers due to activated air around a medical high energy electron linac by means of Monte Carlo simulations. Methods: The treatment head of a Varian Clinac in 18 MV-X mode as well as the surrounding concrete bunker were modeled and the radiation transport was simulated using the Monte Carlo code FLUKA, starting from the primary electron striking the bremsstrahlung target. The activation yields in air from photo-disintegration of O-16 and N-14 nuclei as well as from neutron capture on Ar-40 nuclei were obtained from the simulations. The activation build-up, radioactive decay and air ventilation were studied using a mathematical model. The annual effective dose to workers was estimated by using published isotope specific conversion factors. Results: The oxygen and nitrogen activation yields were in contrast to the argon activation yield found to be field size dependent. The impact of the treatment room ventilation on the different air activation products was investigated and quantified. An estimate with very conservative assumptions gave an annual effective dose to workers of < 1 mSv/a. Conclusion: From the results of this study it can be concluded that the contribution of air activation to the radiation exposure to medical workers should be negligible in modern photon therapy, especially when it is compared to the dose due to prompt neutrons and the activation of heavy solid materials such as the jaws and the collimators inside the linac head.

  20. SU-F-T-656: Monte Carlo Study On Air Activation Around a Medical Electron Linac

    Energy Technology Data Exchange (ETDEWEB)

    Horst, F [Institute of Medical Physics and Radiation Protection, University of Applied Sciences, Giessen (Germany); GSI Helmholtz Centre for Heavy Ion Research, Darmstadt (Germany); Fehrenbacher, G [GSI Helmholtz Centre for Heavy Ion Research, Darmstadt (Germany); Zink, K [Institute of Medical Physics and Radiation Protection, University of Applied Sciences, Giessen (Germany); University Hospital Giessen-Marburg, Marburg (Germany)

    2016-06-15

    Purpose: In high energy photon therapy, several radiation protection issues result from photonuclear reactions. The activation of air - directly by photonuclear reactions as well as indirectly by capture of photoneutrons generated inside the linac head - is a major point of concern for the medical staff. The purpose of this study was to estimate the annual effective dose to medical workers due to activated air around a medical high energy electron linac by means of Monte Carlo simulations. Methods: The treatment head of a Varian Clinac in 18 MV-X mode as well as the surrounding concrete bunker were modeled and the radiation transport was simulated using the Monte Carlo code FLUKA, starting from the primary electron striking the bremsstrahlung target. The activation yields in air from photo-disintegration of O-16 and N-14 nuclei as well as from neutron capture on Ar-40 nuclei were obtained from the simulations. The activation build-up, radioactive decay and air ventilation were studied using a mathematical model. The annual effective dose to workers was estimated by using published isotope specific conversion factors. Results: The oxygen and nitrogen activation yields were in contrast to the argon activation yield found to be field size dependent. The impact of the treatment room ventilation on the different air activation products was investigated and quantified. An estimate with very conservative assumptions gave an annual effective dose to workers of < 1 mSv/a. Conclusion: From the results of this study it can be concluded that the contribution of air activation to the radiation exposure to medical workers should be negligible in modern photon therapy, especially when it is compared to the dose due to prompt neutrons and the activation of heavy solid materials such as the jaws and the collimators inside the linac head.

  1. Ground state energy of an hydrogen atom confined in carbon nano-structures: a diffusion quantum Monte Carlo study

    International Nuclear Information System (INIS)

    Molayem, M.; Tayebi-Rad, Gh.; Esmaeli, L.; Namiranian, A.; Fouladvand, M. E.; Neek-Amal, M.

    2006-01-01

    Using the diffusion quantum monte Carlo method, the ground state energy of an Hydrogen atom confined in a carbon nano tube and a C60 molecule is calculated. For Hydrogen atom confined in small diameter tubes, the ground state energy shows significant deviation from a free Hydrogen atom, while with increasing the diameter this deviation tends to zero.

  2. Spin-1 and -2 bilayer Bethe lattice: A Monte Carlo study

    International Nuclear Information System (INIS)

    Masrour, R.; Jabar, A.; Benyoussef, A.; Hamedoun, M.

    2016-01-01

    The magnetic behaviors of bilayer with spin-1 and 2 Ising model on the Bethe lattice are investigated using the Monte Carlo simulations. The thermal magnetizations, the magnetic susceptibilities and the transition temperature of the bilayer spin-1 and 2 on the Bethe lattice are studied for different values of crystal field and intralayer coupling constants of the two layers and interlayer coupling constant between the layers. The thermal and magnetic hysteresis cycles are given for different values of the crystal field, for different temperatures and for different exchange interactions. - Highlights: • The magnetic properties of bilayer on the Bethe lattice have been investigated. • The transition temperature has been deduced. • The magnetic coercive filed has been established.

  3. Exposition to {sup 137}Cs deposited in soil: A Monte Carlo study

    Energy Technology Data Exchange (ETDEWEB)

    Silveira, Lucas M. da; Pereira, Marco A. M. [Universidade Federal de Uberlândia (UFU), MG (Brazil). Instituto de Geografia; Neves, Lucio P. Neves; Perini, Ana P.; Santos, William S., E-mail: william@ufu.br [Universidade Federal de Uberlândia (UFU), MG (Brazil). Instituto de Física; Caldas, Linda V.E. [Instituto de Pesquisas Energéticas e Nucleares (IPEN/CNEN-SP), São Paulo, SP (Brazil); Belinato, Walmir [Instituto Federal de Educação, Ciência e Tecnologia da Bahia (IBA), Vitória da Conquista, BA (Brazil)

    2017-07-01

    In the event of environmental contamination with radioactive materials, one of the most dangerous materials is {sup 137}Cs. In order to evaluate the radiation doses involved in an environmental contamination of soil, with {sup 137}Cs, we carried out a computational dosimetric study. We determined the radiation doses conversion coefficients (CC) for E and H{sub T}, using a male and a female anthropomorphic phantom, coupled with the MCNPX (2.7.1) Monte Carlo simulation software, for three different types of soil. The highest CC[H{sub T}] values were for the gonads and skin (male) and bone marrow and skin (female). We found no difference for the different types of soil. (author)

  4. Exposure to 137Cs deposited in soil – A Monte Carlo study

    Science.gov (United States)

    da Silveira, Lucas M.; Pereira, Marco A. M.; Neves, Lucio P.; Perini, Ana P.; Belinato, Walmir; Caldas, Linda V. E.; Santos, William S.

    2018-03-01

    In the event of an environmental contamination with radioactive materials, one of the most dangerous materials is 137Cs. In order to evaluate the radiation doses involved in an environmental contamination of soil, with 137Cs, we carried out a computational dosimetric study. We determined the radiation conversion coefficients (CC) for effective (E) and equivalent (H T) doses, using a male and a female anthropomorphic phantoms. These phantoms were coupled with the MCNPX (2.7.0) Monte Carlo simulation software, for three different types of soil. The highest CC[H T] values were for the gonads and skin (male) and bone marrow and skin (female). We found no difference for the different types of soil.

  5. A Monte Carlo study for the shielding of γ backgrounds induced by radionuclides for CDEX

    International Nuclear Information System (INIS)

    Li Lei; Tang Changjian; Yue Qian; Cheng Jianping; Kang Kejun; Li Jianmin; Li Jin; Li Yulan; Li Yuanjing; Ma Hao; Xue Tao; Zeng Zhi; Wong, H.T.

    2011-01-01

    The CDEX (China Dark matter EXperiment) Collaboration will carry out a direct search for WIMPs (Weakly Interacting Massive Particles) using an Ultra-Low Energy Threshold High Purity Germanium (ULE-HPGe) detector at the CJPL (China JinPing deep underground Laboratory). A complex shielding system was designed to reduce backgrounds and a detailed GEANT4 Monte Carlo simulation was performed to study the achievable reduction of γ rays induced by radionuclides and neutron backgrounds by D(γ,n)p reaction. Furthermore, the upper level of allowed radio purity of shielding materials was estimated under the constraint of the expected goal. Compared with the radio purity reported by other low-background rare-event experiments, it indicates that the shielding used in the CDEX can be made out of materials with obtainable radiopurity. (authors)

  6. Dose distribution close to metal implants in Gamma Knife Radiosurgery: A Monte Carlo study

    International Nuclear Information System (INIS)

    Cheung, Joel Y.C.; Yu, K.N.; Chan, Josie F.K.; Ho, Robert T.K.; Yu, C.P.

    2003-01-01

    Materials with high atomic numbers favor the occurrence of the photoelectric effect when they are irradiated with gamma rays. Therefore, the photoelectric effects of metal implants within the target regions in Gamma Knife Radiosurgery are worth studying. In the present work, Monte Carlo simulations using EGS4 were employed to investigate the resulting dose enhancements. A dose enhancement as high as 10% was observed close to a platinum implant along the x and y axes, while no significant dose enhancements were observed for silver, stainless steel 301, and titanium ones. A dose enhancement as high as 20% was observed close to the platinum implant along the z axis at the superior position of the metal-phantom interface and was 10% higher for other metal implants

  7. Effect of the surface charge discretization on electric double layers: a Monte Carlo simulation study.

    Science.gov (United States)

    Madurga, Sergio; Martín-Molina, Alberto; Vilaseca, Eudald; Mas, Francesc; Quesada-Pérez, Manuel

    2007-06-21

    The structure of the electric double layer in contact with discrete and continuously charged planar surfaces is studied within the framework of the primitive model through Monte Carlo simulations. Three different discretization models are considered together with the case of uniform distribution. The effect of discreteness is analyzed in terms of charge density profiles. For point surface groups, a complete equivalence with the situation of uniformly distributed charge is found if profiles are exclusively analyzed as a function of the distance to the charged surface. However, some differences are observed moving parallel to the surface. Significant discrepancies with approaches that do not account for discreteness are reported if charge sites of finite size placed on the surface are considered.

  8. A Monte Carlo transport code study of the space radiation environment using FLUKA and ROOT

    CERN Document Server

    Wilson, T; Carminati, F; Brun, R; Ferrari, A; Sala, P; Empl, A; MacGibbon, J

    2001-01-01

    We report on the progress of a current study aimed at developing a state-of-the-art Monte-Carlo computer simulation of the space radiation environment using advanced computer software techniques recently available at CERN, the European Laboratory for Particle Physics in Geneva, Switzerland. By taking the next-generation computer software appearing at CERN and adapting it to known problems in the implementation of space exploration strategies, this research is identifying changes necessary to bring these two advanced technologies together. The radiation transport tool being developed is tailored to the problem of taking measured space radiation fluxes impinging on the geometry of any particular spacecraft or planetary habitat and simulating the evolution of that flux through an accurate model of the spacecraft material. The simulation uses the latest known results in low-energy and high-energy physics. The output is a prediction of the detailed nature of the radiation environment experienced in space as well a...

  9. Spin-1 and -2 bilayer Bethe lattice: A Monte Carlo study

    Energy Technology Data Exchange (ETDEWEB)

    Masrour, R., E-mail: rachidmasrour@hotmail.com [Laboratory of Materials, Processes, Environment and Quality, Cady Ayyed University, National School of Applied Sciences, 63 46000 Safi (Morocco); Laboratoire de Magnétisme et Physique des Hautes Energies L.M.P.H.E.URAC 12, Université Mohammed V, Faculté des Sciences, B.P. 1014 Rabat (Morocco); Jabar, A. [Laboratoire de Magnétisme et Physique des Hautes Energies L.M.P.H.E.URAC 12, Université Mohammed V, Faculté des Sciences, B.P. 1014 Rabat (Morocco); Benyoussef, A. [Laboratoire de Magnétisme et Physique des Hautes Energies L.M.P.H.E.URAC 12, Université Mohammed V, Faculté des Sciences, B.P. 1014 Rabat (Morocco); Institute of Nanomaterials and Nanotechnologies, MAScIR, Rabat (Morocco); Hassan II Academy of Science and Technology, Rabat (Morocco); Hamedoun, M. [Institute of Nanomaterials and Nanotechnologies, MAScIR, Rabat (Morocco)

    2016-03-01

    The magnetic behaviors of bilayer with spin-1 and 2 Ising model on the Bethe lattice are investigated using the Monte Carlo simulations. The thermal magnetizations, the magnetic susceptibilities and the transition temperature of the bilayer spin-1 and 2 on the Bethe lattice are studied for different values of crystal field and intralayer coupling constants of the two layers and interlayer coupling constant between the layers. The thermal and magnetic hysteresis cycles are given for different values of the crystal field, for different temperatures and for different exchange interactions. - Highlights: • The magnetic properties of bilayer on the Bethe lattice have been investigated. • The transition temperature has been deduced. • The magnetic coercive filed has been established.

  10. Size and diluted magnetic properties of diamond shaped graphene quantum dots: Monte Carlo study

    Science.gov (United States)

    Masrour, R.; Jabar, A.

    2018-05-01

    The magnetic properties of diamond shaped graphene quantum dots have been investigated by varying their sizes with the Monte Carlo simulation. The magnetizations and magnetic susceptibilities have been studied with dilutions x (magnetic atom), several sizes L (carbon atom) and exchange interaction J between the magnetic atoms. The all magnetic susceptibilities have been situated at the transitions temperatures of each parameters. The obtained values increase when increases the values of x, L and J. The effect of exchanges interactions and crystal field on the magnetization has been discussed. The magnetic hysteresis cycles for several dilutions x, sizes L, exchange interactions J and temperatures T. The magnetic coercive increases with increasing the exchange interactions and decreases when the temperatures values increasing.

  11. Lateral electron transport in monolayers of short chains at interfaces: A Monte Carlo study

    International Nuclear Information System (INIS)

    George, Christopher B.; Szleifer, Igal; Ratner, Mark A.

    2010-01-01

    Graphical abstract: Electron hopping between electroactive sites in a monolayer composed of redox-active and redox-passive molecules. - Abstract: Using Monte Carlo simulations, we study lateral electronic diffusion in dense monolayers composed of a mixture of redox-active and redox-passive chains tethered to a surface. Two charge transport mechanisms are considered: the physical diffusion of electroactive chains and electron hopping between redox-active sites. Results indicate that by varying the monolayer density, the mole fraction of electroactive chains, and the electron hopping range, the dominant charge transport mechanism can be changed. For high density monolayers in a semi-crystalline phase, electron diffusion proceeds via electron hopping almost exclusively, leading to static percolation behavior. In fluid monolayers, the diffusion of chains may contribute more to the overall electronic diffusion, reducing the observed static percolation effects.

  12. Numerical study of the systematic error in Monte Carlo schemes for semiconductors

    Energy Technology Data Exchange (ETDEWEB)

    Muscato, Orazio [Univ. degli Studi di Catania (Italy). Dipt. di Matematica e Informatica; Di Stefano, Vincenza [Univ. degli Studi di Messina (Italy). Dipt. di Matematica; Wagner, Wolfgang [Weierstrass-Institut fuer Angewandte Analysis und Stochastik (WIAS) im Forschungsverbund Berlin e.V. (Germany)

    2008-07-01

    The paper studies the convergence behavior of Monte Carlo schemes for semiconductors. A detailed analysis of the systematic error with respect to numerical parameters is performed. Different sources of systematic error are pointed out and illustrated in a spatially one-dimensional test case. The error with respect to the number of simulation particles occurs during the calculation of the internal electric field. The time step error, which is related to the splitting of transport and electric field calculations, vanishes sufficiently fast. The error due to the approximation of the trajectories of particles depends on the ODE solver used in the algorithm. It is negligible compared to the other sources of time step error, when a second order Runge-Kutta solver is used. The error related to the approximate scattering mechanism is the most significant source of error with respect to the time step. (orig.)

  13. Slow coarsening of B2-ordered domains at low temperatures: A kinetic Monte Carlo study

    International Nuclear Information System (INIS)

    Le Floc'h, D.; Bellon, P.; Athenes, M.

    2000-01-01

    The kinetics of the ordering and coarsening of B2-ordered domains is studied using atomistic kinetic Monte Carlo simulations. Special emphasis is put on the effect of annealing temperature, alloy composition, and atom dynamics on the coarsening behavior. When atomic diffusion proceeds by vacancy jumps to nearest-neighbor sites, a transient slow coarsening regime is observed at temperatures below half the order-disorder transition temperature T c . It results in apparent coarsening exponents that decrease with decreasing the annealing temperature. Values as low as 0.14 are measured at 0.25T c . Slow transients take place in both stoichiometric and nonstoichiometric alloys. These regimes are correlated with the transient creation of excess antisites during domain disappearance. Since antiphase boundary mobility decreases with increasing antisite concentration, this transient excess results in the slow coarsening observed in simulations. (c) 2000 The American Physical Society

  14. A Monte Carlo study of radon detection in cylindrical diffusion chambers

    Energy Technology Data Exchange (ETDEWEB)

    Rickards, Jorge, E-mail: rickards@fisica.unam.m [Instituto de Fisica, Universidad Nacional Autonoma de Mexico, Circuito de la Investigacion Cientifica, Ciudad Universitaria, Delegacion Coyoacan, 04520 Mexico, D.F. (Mexico); Golzarri, Jose-Ignacio, E-mail: golzarri@fisica.unam.m [Instituto de Fisica, Universidad Nacional Autonoma de Mexico, Circuito de la Investigacion Cientifica, Ciudad Universitaria, Delegacion Coyoacan, 04520 Mexico, D.F. (Mexico); Espinosa, Guillermo, E-mail: espinosa@fisica.unam.m [Instituto de Fisica, Universidad Nacional Autonoma de Mexico, Circuito de la Investigacion Cientifica, Ciudad Universitaria, Delegacion Coyoacan, 04520 Mexico, D.F. (Mexico)

    2010-05-15

    The functioning of radon diffusion chambers was studied using the Monte Carlo code RAMMX developed here. The alpha particles from radon are assumed randomly produced in the volume of the cylinder, and those from the progeny are assumed to originate randomly at the cylindrical surface. The energy spectrum, the distribution of incident angles, and the distribution of path lengths of the alpha particles on the detector were obtained. These quantities vary depending on input parameters such as initial alpha particle energy, radius and depth of the diffusion chamber, detector size and atmospheric pressure. The calculated energy spectrum for both {sup 222}Rn and {sup 220}Rn was compared with experiment, permitting the identification of each peak and its origin, and a better understanding of radon monitoring. Three aspects not considered in previous calculations are progeny alphas coming from surfaces of the monitor, taking into account the atmospheric pressure, and including the isotope {sup 220}Rn.

  15. Kinetic Monte Carlo study on the evolution of silicon surface roughness under hydrogen thermal treatment

    Energy Technology Data Exchange (ETDEWEB)

    Wang, Gang; Wang, Yu; Wang, Junzhuan; Pan, Lijia; Yu, Linwei; Zheng, Youdou; Shi, Yi, E-mail: yshi@nju.edu.cn

    2017-08-31

    Highlights: • The KMC method is adopted to investigate the relationships between surface evolution and hydrogen thermal treatment conditions. • The reduction in surface roughness is divided into two stages at relatively low temperatures, both exhibiting exponential dependence on the time. • The optimized surface structure can be obtained by precisely adjusting thermal treatment temperatures and hydrogen pressures. - Abstract: The evolution of a two-dimensional silicon surface under hydrogen thermal treatment is studied by kinetic Monte Carlo simulations, focusing on the dependence of the migration behaviors of surface atoms on both the temperature and hydrogen pressure. We adopt different activation energies to analyze the influence of hydrogen pressure on the evolution of surface morphology at high temperatures. The reduction in surface roughness is divided into two stages, both exhibiting exponential dependence on the equilibrium time. Our results indicate that a high hydrogen pressure is conducive to obtaining optimized surfaces, as a strategy in the applications of three-dimensional devices.

  16. Thermodynamic properties of water in confined environments: a Monte Carlo study

    Science.gov (United States)

    Gladovic, Martin; Bren, Urban; Urbic, Tomaž

    2018-05-01

    Monte Carlo simulations of Mercedes-Benz water in a crowded environment were performed. The simulated systems are representative of both composite, porous or sintered materials and living cells with typical matrix packings. We studied the influence of overall temperature as well as the density and size of matrix particles on water density, particle distributions, hydrogen bond formation and thermodynamic quantities. Interestingly, temperature and space occupancy of matrix exhibit a similar effect on water properties following the competition between the kinetic and the potential energy of the system, whereby temperature increases the kinetic and matrix packing decreases the potential contribution. A novel thermodynamic decomposition approach was applied to gain insight into individual contributions of different types of inter-particle interactions. This decomposition proved to be useful and in good agreement with the total thermodynamic quantities especially at higher temperatures and matrix packings, where higher-order potential-energy mixing terms lose their importance.

  17. Study of the replacement correction factors for ionization chamber dosimetry by Monte Carlo simulations

    Science.gov (United States)

    Wang, Lilie

    In ionization chamber radiation dosimetry, the introduction of the ion chamber into medium will unavoidably distort the radiation field near the chamber because the chamber cavity material (air) is different from the medium. A replacement correction factor, Prepl was introduced in order to correct the chamber readings to give an accurate radiation dose in the medium without the presence of the chamber. Generally it is very hard to measure the values of Prepl since they are intertwined with the chamber wall effect. In addition, the P repl values always come together with the stopping-power ratio of the two media involved. This makes the problem of determining the P repl values even more complicated. Monte Carlo simulation is an ideal method to investigate the replacement correction factors. In this study, four different methods of calculating the values of Prepl by Monte Carlo simulation are discussed. Two of the methods are designated as 'direct' methods in the sense that the evaluation of the stopping-power ratio is not necessary. The systematic uncertainties of the two direct methods are estimated to be about 0.1-0.2% which comes from the ambiguous definition of the energy cutoff Delta used in the Spencer-Attix cavity theory. The two direct methods are used to calculate the values of P repl for both plane-parallel chambers and cylindrical thimble chambers in either electron beams or photon beams. The calculation results are compared to measurements. For electron beams, good agreements are obtained. For thimble chambers in photon beams, significant discrepancies are observed between calculations and measurements. The experiments are thus investigated and the procedures are simulated by the Monte Carlo method. It is found that the interpretation of the measured data as the replacement correction factors in dosimetry protocols are not correct. In applying the calculation to the BIPM graphite chamber in a 60Co beam, the calculated values of P repl differ from those

  18. Quantitative study of fluctuation effects by fast lattice Monte Carlo simulations: Compression of grafted homopolymers

    International Nuclear Information System (INIS)

    Zhang, Pengfei; Wang, Qiang

    2014-01-01

    Using fast lattice Monte Carlo (FLMC) simulations [Q. Wang, Soft Matter 5, 4564 (2009)] and the corresponding lattice self-consistent field (LSCF) calculations, we studied a model system of grafted homopolymers, in both the brush and mushroom regimes, in an explicit solvent compressed by an impenetrable surface. Direct comparisons between FLMC and LSCF results, both of which are based on the same Hamiltonian (thus without any parameter-fitting between them), unambiguously and quantitatively reveal the fluctuations/correlations neglected by the latter. We studied both the structure (including the canonical-ensemble averages of the height and the mean-square end-to-end distances of grafted polymers) and thermodynamics (including the ensemble-averaged reduced energy density and the related internal energy per chain, the differences in the Helmholtz free energy and entropy per chain from the uncompressed state, and the pressure due to compression) of the system. In particular, we generalized the method for calculating pressure in lattice Monte Carlo simulations proposed by Dickman [J. Chem. Phys. 87, 2246 (1987)], and combined it with the Wang-Landau–Optimized Ensemble sampling [S. Trebst, D. A. Huse, and M. Troyer, Phys. Rev. E 70, 046701 (2004)] to efficiently and accurately calculate the free energy difference and the pressure due to compression. While we mainly examined the effects of the degree of compression, the distance between the nearest-neighbor grafting points, the reduced number of chains grafted at each grafting point, and the system fluctuations/correlations in an athermal solvent, the θ-solvent is also considered in some cases

  19. Study of dose distribution in dental radiology using the Monte Carlo Simulation; Estudo da distribuicao de dose em radiologia odontologica usando simulacao Monte Carlo

    Energy Technology Data Exchange (ETDEWEB)

    Bonzoumet, S P.J.; Braz, D; Lopes, R T [Nuclear Instrumentation Laboratory, COPPE/UFRJ, Rio de Janeiro (Brazil); Anjos, M J [Nuclear Instrumentation Laboratory, COPPE/UFRJ, Rio de Janeiro (Brazil); Universidade do Estado do Rio de Janeiro, Rio de Janeiro (Brazil). Instituto de Fisica; Barroso, R C.S. [Universidade do Estado do Rio de Janeiro, Rio de Janeiro (Brazil). Instituto de Fisica

    2003-11-15

    Full text: The purpose of this study was to study the absorbed dose in mouth due to scattering in teeth in dental radiography using the monte carlo simulation. The Electron Gamma Shower (EGS-4) system of computer codes was used, which is a general purpose package for monte carlo simulation of the coupled transport of electrons and photons in an arbitrary geometry for particles with energies above a few keV up to several TeV. In the case of a X ray dental the low energy photons beam, are removed of the spectrum by the filtration. These low energy photons beam do not contribute in the obtaining of the radiographic image, but they will be contribute in the dose to the patient, however when the incident radiation crosses the tooth it generates a scattering radiation that contributes in the dose received by the patient in the oral cavity (cheek, tooth and oral cavity). Dental radiography is one of the largest single groups of radiographic examination accounting for 32% of radiographs taken in the Brazil. A number of relatively recent improvements in technology, equipment and techniques have the potential to reduce patient radiation dose and improve image quality. To optimize radiation protection all reasonable means should be employed to minimize the dose of each exposure. Dentists therefore need to keep up to date with changes in techniques and equipment and modify their own practice. In preliminary analysis could be notice that the energy below the 30 keV (low energy) is deposited in the cheek. To 30 keV photons there is the maximum absorbed energy in the tooth (about 60%). In 40 keV could be notice that deposited energy is same to teeth and cheek, but up to 40 keV just a small part of energy is deposited, e.g., the great part of energy is transmitted to the inner mouth (oral cavity). (orig.)

  20. A parallelization study of the general purpose Monte Carlo code MCNP4 on a distributed memory highly parallel computer

    International Nuclear Information System (INIS)

    Yamazaki, Takao; Fujisaki, Masahide; Okuda, Motoi; Takano, Makoto; Masukawa, Fumihiro; Naito, Yoshitaka

    1993-01-01

    The general purpose Monte Carlo code MCNP4 has been implemented on the Fujitsu AP1000 distributed memory highly parallel computer. Parallelization techniques developed and studied are reported. A shielding analysis function of the MCNP4 code is parallelized in this study. A technique to map a history to each processor dynamically and to map control process to a certain processor was applied. The efficiency of parallelized code is up to 80% for a typical practical problem with 512 processors. These results demonstrate the advantages of a highly parallel computer to the conventional computers in the field of shielding analysis by Monte Carlo method. (orig.)

  1. Contributions at the Tripoli Monte Carlo code qualifying on critical experiences and at neutronic interaction study of fissile units

    International Nuclear Information System (INIS)

    Nouri, A.

    1994-01-01

    Criticality studies in nuclear fuel cycle are based on Monte Carlo method. These codes use multigroup cross sections which can verify by experimental configurations or by use of reference codes such Tripoli 2. In this Tripoli 2 code nuclear data are errors attached and asked for experimental studies with critical experiences. This is one of the aim of this thesis. To calculate the keff of interacted fissile units we have used the multigroup Monte Carlo code Moret with convergence problems. A new estimator of reactions rates permit to better approximate the neutrons exchange between units and a new importance function has been tested. 2 annexes

  2. Monte Carlo method applied to medical physics

    International Nuclear Information System (INIS)

    Oliveira, C.; Goncalves, I.F.; Chaves, A.; Lopes, M.C.; Teixeira, N.; Matos, B.; Goncalves, I.C.; Ramalho, A.; Salgado, J.

    2000-01-01

    The main application of the Monte Carlo method to medical physics is dose calculation. This paper shows some results of two dose calculation studies and two other different applications: optimisation of neutron field for Boron Neutron Capture Therapy and optimization of a filter for a beam tube for several purposes. The time necessary for Monte Carlo calculations - the highest boundary for its intensive utilisation - is being over-passed with faster and cheaper computers. (author)

  3. Image quality and dose assessment in digital breast tomosynthesis: A Monte Carlo study

    International Nuclear Information System (INIS)

    Baptista, M.; Di Maria, S.; Oliveira, N.; Matela, N.; Janeiro, L.; Almeida, P.; Vaz, P.

    2014-01-01

    Mammography is considered a standard technique for the early detection of breast cancer. However, its sensitivity is limited essentially due to the issue of the overlapping breast tissue. This limitation can be partially overcome, with a relatively new technique, called digital breast tomosynthesis (DBT). For this technique, optimization of acquisition parameters which maximize image quality, whilst complying with the ALARA principle, continues to be an area of considerable research. The aim of this work was to study the best quantum energies that optimize the image quality with the lowest achievable dose in DBT and compare these results with the digital mammography (DM) ones. Monte Carlo simulations were performed using the state-of-the-art computer program MCNPX 2.7.0 in order to generate several 2D cranio-caudal (CC) projections obtained during an acquisition of a standard DBT examination. Moreover, glandular absorbed doses and photon flux calculations, for each projection image, were performed. A homogeneous breast computational phantom with 50%/50% glandular/adipose tissue composition was used and two compressed breast thicknesses were evaluated: 4 cm and 8 cm. The simulated projection images were afterwards reconstructed with an algebraic reconstruction tool and the signal difference to noise ratio (SDNR) was calculated in order to evaluate the image quality in DBT and DM. Finally, a thorough comparison between the results obtained in terms of SDNR and dose assessment in DBT and DM was performed. - Highlights: • Optimization of the image quality in digital breast tomosynthesis. • Calculation of photon energies that maximize the signal difference to noise ratio. • Projections images and dose calculations through the Monte Carlo (MC) method. • Tumor masses and microcalcifications included in the MC model. • A dose saving of about 30% can be reached if optimal photon energies are used

  4. Phase diagram of a symmetric electron-hole bilayer system: a variational Monte Carlo study.

    Science.gov (United States)

    Sharma, Rajesh O; Saini, L K; Bahuguna, Bhagwati Prasad

    2018-05-10

    We study the phase diagram of a symmetric electron-hole bilayer system at absolute zero temperature and in zero magnetic field within the quantum Monte Carlo approach. In particular, we conduct variational Monte Carlo simulations for various phases, i.e. the paramagnetic fluid phase, the ferromagnetic fluid phase, the anti-ferromagnetic Wigner crystal phase, the ferromagnetic Wigner crystal phase and the excitonic phase, to estimate the ground-state energy at different values of in-layer density and inter-layer spacing. Slater-Jastrow style trial wave functions, with single-particle orbitals appropriate for different phases, are used to construct the phase diagram in the (r s , d) plane by finding the relative stability of trial wave functions. At very small layer separations, we find that the fluid phases are stable, with the paramagnetic fluid phase being particularly stable at [Formula: see text] and the ferromagnetic fluid phase being particularly stable at [Formula: see text]. As the layer spacing increases, we first find that there is a phase transition from the ferromagnetic fluid phase to the ferromagnetic Wigner crystal phase when d reaches 0.4 a.u. at r s   =  20, and before there is a return to the ferromagnetic fluid phase when d approaches 1 a.u. However, for r s   Wigner crystal is stable over the considered range of r s and d. We also find that as r s increases, the critical layer separations for Wigner crystallization increase.

  5. Carlos Bruch: pionero de los estudios entomológicos en la Argentina Carlos Bruch: pioneer of the entomological studies in Argentina

    Directory of Open Access Journals (Sweden)

    Analía A. Lanteri

    2012-12-01

    Full Text Available Este artículo proporciona una síntesis de los principales aportes de Carlos Bruch (1869-1943 a la entomología argentina. Se reseñan sus viajes para la recolección de insectos, sus principales publicaciones y los datos de sus colecciones, depositadas en el Museo Argentino de Ciencias Naturales “Bernardino Rivadavia” y en el Museo de La Plata. Se destaca su habilidad para la fotografía y la ilustración científica, así como para observar y describir los comportamientos y las asociaciones particulares de hormigas y escarabajos: termitofilia y mirmecofilia. Se brinda información sobre sus logros académicos y el reconocimiento que supo ganarse entre sus contemporáneos, que le dedicaron casi cuatrocientos nombres científicos, y no dudaron en señalarlo como uno de los entomólogos más destacados de América del Sur.In this article we provide a synthesis of the main contributions of Carlos Bruch (1869-1943 to entomological studies in Argentina. We supply information on Bruch’s scientific trips, publications and collections of insects, held by the Museo Argentino de Ciencias Naturales “Bernardino Rivadavia” and the Museo de La Plata. We highlight his capacity as a photographer and scientific illustrator, and for making observations regarding special associations and behaviors of ants and beetles: termitophily and myrmecophily. We summarize his main academic achievements and the recognition of his colleagues, who have dedicated almost four hundreds of scientific names to him and recognize him as one of the most outstanding South American entomologists.

  6. Monte Carlo study of LDR seed dosimetry with an application in a clinical brachytherapy breast implant.

    Science.gov (United States)

    Furstoss, C; Reniers, B; Bertrand, M J; Poon, E; Carrier, J-F; Keller, B M; Pignol, J P; Beaulieu, L; Verhaegen, F

    2009-05-01

    A Monte Carlo (MC) study was carried out to evaluate the effects of the interseed attenuation and the tissue composition for two models of 125I low dose rate (LDR) brachytherapy seeds (Medi-Physics 6711, IBt InterSource) in a permanent breast implant. The effect of the tissue composition was investigated because the breast localization presents heterogeneities such as glandular and adipose tissue surrounded by air, lungs, and ribs. The absolute MC dose calculations were benchmarked by comparison to the absolute dose obtained from experimental results. Before modeling a clinical case of an implant in heterogeneous breast, the effects of the tissue composition and the interseed attenuation were studied in homogeneous phantoms. To investigate the tissue composition effect, the dose along the transverse axis of the two seed models were calculated and compared in different materials. For each seed model, three seeds sharing the same transverse axis were simulated to evaluate the interseed effect in water as a function of the distance from the seed. A clinical study of a permanent breast 125I implant for a single patient was carried out using four dose calculation techniques: (1) A TG-43 based calculation, (2) a full MC simulation with realistic tissues and seed models, (3) a MC simulation in water and modeled seeds, and (4) a MC simulation without modeling the seed geometry but with realistic tissues. In the latter, a phase space file corresponding to the particles emitted from the external surface of the seed is used at each seed location. The results were compared by calculating the relevant clinical metrics V85, V100, and V200 for this kind of treatment in the target. D90 and D50 were also determined to evaluate the differences in dose and compare the results to the studies published for permanent prostate seed implants in literature. The experimental results are in agreement with the MC absolute doses (within 5% for EBT Gafchromic film and within 7% for TLD-100

  7. A Monte Carlo study of time-aggregation in continuous-time and discrete-time parametric hazard models.

    NARCIS (Netherlands)

    Hofstede, ter F.; Wedel, M.

    1998-01-01

    This study investigates the effects of time aggregation in discrete and continuous-time hazard models. A Monte Carlo study is conducted in which data are generated according to various continuous and discrete-time processes, and aggregated into daily, weekly and monthly intervals. These data are

  8. Oxygen distribution in tumors: A qualitative analysis and modeling study providing a novel Monte Carlo approach

    International Nuclear Information System (INIS)

    Lagerlöf, Jakob H.; Kindblom, Jon; Bernhardt, Peter

    2014-01-01

    end, due to anoxia, but smaller tumors showed undisturbed oxygen distributions. The six different models with correlated parameters generated three classes of oxygen distributions. The first was a hypothetical, negative covariance between vessel proximity and pO 2 (VPO-C scenario); the second was a hypothetical positive covariance between vessel proximity and pO 2 (VPO+C scenario); and the third was the hypothesis of no correlation between vessel proximity and pO 2 (UP scenario). The VPO-C scenario produced a distinctly different oxygen distribution than the two other scenarios. The shape of the VPO-C scenario was similar to that of the nonvariable DOC model, and the larger the tumor, the greater the similarity between the two models. For all simulations, the mean oxygen tension decreased and the hypoxic fraction increased with tumor size. The absorbed dose required for definitive tumor control was highest for the VPO+C scenario, followed by the UP and VPO-C scenarios. Conclusions: A novel MC algorithm was presented which simulated oxygen distributions and radiation response for various biological parameter values. The analysis showed that the VPO-C scenario generated a clearly different oxygen distribution from the VPO+C scenario; the former exhibited a lower hypoxic fraction and higher radiosensitivity. In future studies, this modeling approach might be valuable for qualitative analyses of factors that affect oxygen distribution as well as analyses of specific experimental and clinical situations

  9. Photon energy-modulated radiotherapy: Monte Carlo simulation and treatment planning study

    Energy Technology Data Exchange (ETDEWEB)

    Park, Jong Min; Kim, Jung-in; Heon Choi, Chang; Chie, Eui Kyu; Kim, Il Han; Ye, Sung-Joon [Interdiciplinary Program in Radiation Applied Life Science, Seoul National University, Seoul, 110-744, Korea and Department of Radiation Oncology, Seoul National University Hospital, Seoul, 110-744 (Korea, Republic of); Interdiciplinary Program in Radiation Applied Life Science, Seoul National University, Seoul, 110-744 (Korea, Republic of); Department of Radiation Oncology, Seoul National University Hospital, Seoul, 110-744 (Korea, Republic of); Interdiciplinary Program in Radiation Applied Life Science, Seoul National University, Seoul, 110-744 (Korea, Republic of) and Department of Radiation Oncology, Seoul National University Hospital, Seoul, 110-744 (Korea, Republic of); Interdiciplinary Program in Radiation Applied Life Science, Seoul National University, Seoul, 110-744 (Korea, Republic of); Department of Radiation Oncology, Seoul National University Hospital, Seoul, 110-744 (Korea, Republic of) and Department of Intelligent Convergence Systems, Seoul National University, Seoul, 151-742 (Korea, Republic of)

    2012-03-15

    periphery while maintaining the similar quality of target coverage, homogeneity, and conformity. Conclusions: The MC study for the designed energy modulator demonstrated the feasibility of energy-modulated photon beams available during beam-on time. The planning study showed an advantage of energy-and intensity modulated radiotherapy in terms of integral dose without sacrificing any quality of IMRT plan.

  10. Fate of the open-shell singlet ground state in the experimentally accessible acenes: A quantum Monte Carlo study

    Science.gov (United States)

    Dupuy, Nicolas; Casula, Michele

    2018-04-01

    By means of the Jastrow correlated antisymmetrized geminal power (JAGP) wave function and quantum Monte Carlo (QMC) methods, we study the ground state properties of the oligoacene series, up to the nonacene. The JAGP is the accurate variational realization of the resonating-valence-bond (RVB) ansatz proposed by Pauling and Wheland to describe aromatic compounds. We show that the long-ranged RVB correlations built in the acenes' ground state are detrimental for the occurrence of open-shell diradical or polyradical instabilities, previously found by lower-level theories. We substantiate our outcome by a direct comparison with another wave function, tailored to be an open-shell singlet (OSS) for long-enough acenes. By comparing on the same footing the RVB and OSS wave functions, both optimized at a variational QMC level and further projected by the lattice regularized diffusion Monte Carlo method, we prove that the RVB wave function has always a lower variational energy and better nodes than the OSS, for all molecular species considered in this work. The entangled multi-reference RVB state acts against the electron edge localization implied by the OSS wave function and weakens the diradical tendency for higher oligoacenes. These properties are reflected by several descriptors, including wave function parameters, bond length alternation, aromatic indices, and spin-spin correlation functions. In this context, we propose a new aromatic index estimator suitable for geminal wave functions. For the largest acenes taken into account, the long-range decay of the charge-charge correlation functions is compatible with a quasi-metallic behavior.

  11. A Monte Carlo simulation study of boron profiles as-implanted into LPCVD NiDoS polycrystalline thin films

    Science.gov (United States)

    Boukezzata, M.; Ait-Kaki, A.; Temple-Boyer, P.; Scheid, E.

    2003-03-01

    This work presents a Monte Carlo simulation study of boron profiles obtained from as-implanted ions into thin films nitrogen doped silicon (NiDoS) thin films. These films are performed by LPCVD technique from Si2H6 and NH3 gas sources, four values deliberately chosen, of the ratio NH3/Si2H6 to obtain samples, differently in situ nitrogen-doped. Taking into account the effect of the codoping case, and the structure specificity of these films, an accurate Monte Carlo model based on binary collisions in a multi-atomic target was performed. Nitrogen atoms present in the target is shown to affect the boron profiles and confirms clearly a reduction penetration effect which becomes more significant at high nitrogen concentrations. Whereas, the fine-grained polysilicon structure, and thus the presence of grains (G) and grain boundaries (GB), is known to enhance the opposite phenomenon by assuming an effective role played by GB's in the scattering calculation process of the incident ions. This role is represented by the change in direction of the incident ion after interaction with GB without corresponding loss in its energy. The results obtained show an enhancement of the stopping parameter when nitrogen concentration increases, while the GB interaction remains very important. This behavior is due to a great number of GB's interactions with boron atoms which gave low deflection angles. So that, the average positions described by the sequences of trajectories took place farther than what expected with channeling effect in crystal silicon materials.

  12. Study on MPI/OpenMP hybrid parallelism for Monte Carlo neutron transport code

    International Nuclear Information System (INIS)

    Liang Jingang; Xu Qi; Wang Kan; Liu Shiwen

    2013-01-01

    Parallel programming with mixed mode of messages-passing and shared-memory has several advantages when used in Monte Carlo neutron transport code, such as fitting hardware of distributed-shared clusters, economizing memory demand of Monte Carlo transport, improving parallel performance, and so on. MPI/OpenMP hybrid parallelism was implemented based on a one dimension Monte Carlo neutron transport code. Some critical factors affecting the parallel performance were analyzed and solutions were proposed for several problems such as contention access, lock contention and false sharing. After optimization the code was tested finally. It is shown that the hybrid parallel code can reach good performance just as pure MPI parallel program, while it saves a lot of memory usage at the same time. Therefore hybrid parallel is efficient for achieving large-scale parallel of Monte Carlo neutron transport. (authors)

  13. Monte Carlo study of superconductivity in the three-band Emery model

    International Nuclear Information System (INIS)

    Frick, M.; Pattnaik, P.C.; Morgenstern, I.; Newns, D.M.; von der Linden, W.

    1990-01-01

    We have examined the three-band Hubbard model for the copper oxide planes in high-temperature superconductors using the projector quantum Monte Carlo method. We find no evidence for s-wave superconductivity

  14. Monte Carlo simulation on nuclear energy study. Annual report of Nuclear Code Evaluation Committee

    International Nuclear Information System (INIS)

    Sakurai, Kiyoshi; Yamamoto, Toshihiro

    1999-03-01

    In this report, research results discussed in 1998 fiscal year at Nuclear Code Evaluation Special Committee of Nuclear Code Committee were summarised. Present status of Monte Carlo calculation in high energy region investigated / discussed at Monte Carlo simulation working-group and automatic compilation system for MCNP cross sections developed at MCNP high temperature library compilation working-group were described. The 6 papers are indexed individually. (J.P.N.)

  15. Monte Carlo study of correction factors for the use of plastic phantoms in clinical electron dosimetry

    International Nuclear Information System (INIS)

    Araki, Fujio

    2007-01-01

    In some recent dosimetry protocols, plastic is allowed as a phantom material for the determination of an absorbed dose to water in electron beams, especially for low energy with beam qualities R 50 2 . In electron dosimetry with plastic, a depth-scaling factor, c pl , and a chamber-dependent fluence correction factor, h pl , are needed to convert the dose measured at a water-equivalent reference depth in plastic to a dose at a reference depth in water. The purpose of this study is to calculate correction factors for the use of plastic phantoms for clinical electron dosimetry using the EGSnrc Monte Carlo code system. RMI-457 and WE-211 were investigated as phantom materials. First the c pl values for plastic materials were calculated as a function of a half-value depth of maximum ionization, I 50 , in plastic. The c pl values for RMI-457 and WE-211 varied from 0.992 to 1.002 and from 0.971 to 0.979, respectively, in a range of nominal energies from 4 MeV to 18 MeV, and varied slightly as a function of I 50 in plastic. Since h pl values depend on the wall correction factor, P wall , of the chamber used, they are evaluated using a pure electron fluence correction factor, φ pl w , and P wall w and P wall pl for a combination of water or plastic phantoms and plane-parallel ionization chambers (NACP-02, Markus and Roos). The φ pl w and P wall (P wall w and P wall pl ) values were calculated as a function of the water-equivalent depth in plastic materials and at a reference depth as a function of R 50 in water, respectively. The φ pl w values varied from 1.024 at 4 MeV to 1.013 at 18 MeV for RMI-457, and from 1.025 to 1.016 for WE-211. P wall w values for plane-parallel chambers showed values in the order of 1.5% to 2% larger than unity at 4 MeV, consistent with earlier results. The P wall pl values of RMI-457 and WE-211 were close to unity for all the energy beams. Finally, calculated h pl values of RMI-457 ranged from 1.009 to 1.005, from 1.010 to 1.003 and from 1

  16. Cherenkov radiation-based three-dimensional position-sensitive PET detector: A Monte Carlo study.

    Science.gov (United States)

    Ota, Ryosuke; Yamada, Ryoko; Moriya, Takahiro; Hasegawa, Tomoyuki

    2018-05-01

    Cherenkov radiation has recently received attention due to its prompt emission phenomenon, which has the potential to improve the timing performance of radiation detectors dedicated to positron emission tomography (PET). In this study, a Cherenkov-based three-dimensional (3D) position-sensitive radiation detector was proposed, which is composed of a monolithic lead fluoride (PbF 2 ) crystal and a photodetector array of which the signals can be readout independently. Monte Carlo simulations were performed to estimate the performance of the proposed detector. The position- and time resolution were evaluated under various practical conditions. The radiator size and various properties of the photodetector, e.g., readout pitch and single photon timing resolution (SPTR), were parameterized. The single photon time response of the photodetector was assumed to be a single Gaussian for the simplification. The photo detection efficiency of the photodetector was ideally 100% for all wavelengths. Compton scattering was included in simulations, but partly analyzed. To estimate the position at which a γ-ray interacted in the Cherenkov radiator, the center-of-gravity (COG) method was employed. In addition, to estimate the depth-of-interaction (DOI) principal component analysis (PCA), which is a multivariate analysis method and has been used to identify the patterns in data, was employed. The time-space distribution of Cherenkov photons was quantified to perform PCA. To evaluate coincidence time resolution (CTR), the time difference of two independent γ-ray events was calculated. The detection time was defined as the first photon time after the SPTR of the photodetector was taken into account. The position resolution on the photodetector plane could be estimated with high accuracy, by using a small number of Cherenkov photons. Moreover, PCA showed an ability to estimate the DOI. The position resolution heavily depends on the pitch of the photodetector array and the radiator

  17. Hybrid method coupling molecular dynamics and Monte Carlo simulations to study the properties of gases in microchannels and nanochannels

    NARCIS (Netherlands)

    Nedea, S.V.; Frijns, A.J.H.; Steenhoven, van A.A.; Markvoort, Albert. J.; Hilbers, P.A.J.

    2005-01-01

    We combine molecular dynamics (MD) and Monte Carlo (MC) simulations to study the properties of gas molecules confined between two hard walls of a microchannel or nanochannel. The coupling between MD and MC simulations is introduced by performing MD near the boundaries for accuracy and MC in the bulk

  18. A Monte Carlo simulation study of the impact of novel scintillation crystals on performance characteristics of PET scanners

    DEFF Research Database (Denmark)

    Ghabrial, Amir; Franklin, Daniel; Zaidi, Habib

    2018-01-01

    Objective: The purpose of this study is to validate a Monte Carlo simulation model for the clinical Siemens Biograph mCT PET scanner using the GATE simulation toolkit, and to evaluate the performance of six different scintillation materials in this model using the National Electrical Manufactures...

  19. Solvent effect on Rb+ to K+ ion mutation: Monte Carlo simulation study

    International Nuclear Information System (INIS)

    Kim, Hag Sung

    2000-01-01

    The solvent effects on the relative free energies of solvation and the difference in partition coefficients (log P) for Rb + to K + mutation in several solvents have been investigated using Monte Carlo simulation (MCS) of statistical perturbation theory (SPT). In comparing the relative free energies for interconversion of one ion pair, Rb + to K + , in H 2 O (TIP4P) in this study with the relative free energies of the computer simulations and the experimental, we found that the figure in this study is -5.00 ± 0.11 kcal/mol. There is good agreement among various studies, taking into account both methods used to obtain the hydration free energies and standard deviations. There is also good agreement between the calculated structural properties of this study and the simulations, ab initio and the experimental results. We have explained the deviation of the relationship between the free energy difference and the Onsager dielectric function of solvents by the electron pair donor properties of the solvents. For the Rb + and K + ion pair, the Onsager dielectric function of solvents (or solvent permittivity), donor number of solvent and the differences in solvation dominate the differences in the relative free energies of solvation and partition coefficients

  20. A Grand Canonical Monte Carlo Molecular Study of a Weak Polyampholyte

    KAUST Repository

    Jimenez, Arturo Martinez

    2016-05-01

    Over the last few decades, there has been an increasing interest in the study of charged polymers for applications such as desalination of water, flocculation, sewage treatment, and enhanced oil recovery. Polyelectrolyte chains containing both positively and negatively charged units (polyampholytes) have been recently studied as viscosity-control agents in enhanced oil recovery, and as entrapping macromolecules for protection and delayed release of enzymes in hydraulic fracturing. In this study we performed Monte Carlo molecular simulations in a grand canonical ensemble to study the behavior of a weak polyampholyte in a dilute regime. Weak polyampholytes have the ability to dissociate in a limited pH, which makes them interesting for applications that require a pH-triggerable response. The titration behaviors of diblock and random polyampholytes are simulated as a function of solvent quality, electrostatic strength, and salt concentration. For diblock polyampholyte chains in hydrophobic solvents, transition between tadpole-like and globule conformation occurs with variations in the solution pH. Random polyampholytes present extended, globule, and pearl-necklace conformations at different solvent conditions and pH values. At high ionic strength, electrostatic interactions in the polyampholytes become screened and the chains are mostly in globule state.

  1. Collapse transitions in thermosensitive multi-block copolymers: A Monte Carlo study

    International Nuclear Information System (INIS)

    Rissanou, Anastassia N.; Tzeli, Despoina S.; Anastasiadis, Spiros H.; Bitsanis, Ioannis A.

    2014-01-01

    Monte Carlo simulations are performed on a simple cubic lattice to investigate the behavior of a single linear multiblock copolymer chain of various lengths N. The chain of type (A n B n ) m consists of alternating A and B blocks, where A are solvophilic and B are solvophobic and N = 2nm. The conformations are classified in five cases of globule formation by the solvophobic blocks of the chain. The dependence of globule characteristics on the molecular weight and on the number of blocks, which participate in their formation, is examined. The focus is on relative high molecular weight blocks (i.e., N in the range of 500–5000 units) and very differing energetic conditions for the two blocks (very good—almost athermal solvent for A and bad solvent for B). A rich phase behavior is observed as a result of the alternating architecture of the multiblock copolymer chain. We trust that thermodynamic equilibrium has been reached for chains of N up to 2000 units; however, for longer chains kinetic entrapments are observed. The comparison among equivalent globules consisting of different number of B-blocks shows that the more the solvophobic blocks constituting the globule the bigger its radius of gyration and the looser its structure. Comparisons between globules formed by the solvophobic blocks of the multiblock copolymer chain and their homopolymer analogs highlight the important role of the solvophilic A-blocks

  2. Monte Carlo simulation study of magnetocaloric effect in NdMnO{sub 3} perovskite

    Energy Technology Data Exchange (ETDEWEB)

    Masrour, R., E-mail: rachidmasrour@hotmail.com [Laboratory of Materials, Processes, Environment and Quality, Cady Ayyed University, National School of Applied Sciences, PB 63 46000 Safi (Morocco); Laboratoire de Magnétisme et Physique des Hautes Energies L.M.P.H.E.URAC 12, Université Mohammed V, Faculté des Sciences, B.P. 1014, Rabat (Morocco); Jabar, A. [Laboratoire de Magnétisme et Physique des Hautes Energies L.M.P.H.E.URAC 12, Université Mohammed V, Faculté des Sciences, B.P. 1014, Rabat (Morocco); Benyoussef, A. [Laboratoire de Magnétisme et Physique des Hautes Energies L.M.P.H.E.URAC 12, Université Mohammed V, Faculté des Sciences, B.P. 1014, Rabat (Morocco); Institute of Nanomaterials and Nanotechnologies, MAScIR, Rabat (Morocco); Hassan II Academy of Science and Technology, Rabat (Morocco); Hamedoun, M. [Institute of Nanomaterials and Nanotechnologies, MAScIR, Rabat (Morocco); Hlil, E.K. [Institut Curie, CNRS et Université Joseph Fourier, BP 166, F-38042 Grenoble Cedex 9 (France)

    2016-03-01

    The magnetocaloric effect in NdMnO{sub 3} perovskite is investigated by using the Monte Carlo simulations. The Curie temperature T{sub C} of NdMnO{sub 3} compound is deduced from the variation of the magnetization vs. the temperature with different values of external magnetic field. The variation of magnetization with the external magnetic field H is given. The specific heat with the temperature is established for different external magnetic field. The thermal magnetic entropy for different external magnetic field and different exchange interactions in NdMnO{sub 3} compound is obtained. The adiabatic temperature change is obtained. The relative cooling power with different external magnetic field is established. The magnetocaloric effect has been investigated from magnetization. - Highlights: • Results obtained show that the PM–FM transition is of second order in NdMnO{sub 3}. • Critical properties of NdSi at the FM–PM transition have been analyzed. • The Curie temperature and magnetic entropy have been obtained.

  3. Quantum Monte Carlo studies of a metallic spin-density wave transition

    Energy Technology Data Exchange (ETDEWEB)

    Gerlach, Max Henner

    2017-01-20

    Plenty experimental evidence indicates that quantum critical phenomena give rise to much of the rich physics observed in strongly correlated itinerant electron systems such as the high temperature superconductors. A quantum critical point of particular interest is found at the zero-temperature onset of spin-density wave order in two-dimensional metals. The appropriate low-energy theory poses an exceptionally hard problem to analytic theory, therefore the unbiased and controlled numerical approach pursued in this thesis provides important contributions on the road to comprehensive understanding. After discussing the phenomenology of quantum criticality, a sign-problem-free determinantal quantum Monte Carlo approach is introduced and an extensive toolbox of numerical methods is described in a self-contained way. By the means of large-scale computer simulations we have solved a lattice realization of the universal effective theory of interest. The finite-temperature phase diagram, showing both a quasi-long-range spin-density wave ordered phase and a d-wave superconducting dome, is discussed in its entirety. Close to the quantum phase transition we find evidence for unusual scaling of the order parameter correlations and for non-Fermi liquid behavior at isolated hot spots on the Fermi surface.

  4. Collapse transitions in thermosensitive multi-block copolymers: A Monte Carlo study

    Science.gov (United States)

    Rissanou, Anastassia N.; Tzeli, Despoina S.; Anastasiadis, Spiros H.; Bitsanis, Ioannis A.

    2014-05-01

    Monte Carlo simulations are performed on a simple cubic lattice to investigate the behavior of a single linear multiblock copolymer chain of various lengths N. The chain of type (AnBn)m consists of alternating A and B blocks, where A are solvophilic and B are solvophobic and N = 2nm. The conformations are classified in five cases of globule formation by the solvophobic blocks of the chain. The dependence of globule characteristics on the molecular weight and on the number of blocks, which participate in their formation, is examined. The focus is on relative high molecular weight blocks (i.e., N in the range of 500-5000 units) and very differing energetic conditions for the two blocks (very good—almost athermal solvent for A and bad solvent for B). A rich phase behavior is observed as a result of the alternating architecture of the multiblock copolymer chain. We trust that thermodynamic equilibrium has been reached for chains of N up to 2000 units; however, for longer chains kinetic entrapments are observed. The comparison among equivalent globules consisting of different number of B-blocks shows that the more the solvophobic blocks constituting the globule the bigger its radius of gyration and the looser its structure. Comparisons between globules formed by the solvophobic blocks of the multiblock copolymer chain and their homopolymer analogs highlight the important role of the solvophilic A-blocks.

  5. Collapse transitions in thermosensitive multi-block copolymers: A Monte Carlo study

    Energy Technology Data Exchange (ETDEWEB)

    Rissanou, Anastassia N., E-mail: rissanou@tem.uoc.gr [Department of Mathematics and Applied Mathematics, University of Crete, GR-71003 Heraklion Crete, Greece and Archimedes Center for Analysis, Modeling and Computation, University of Crete, P.O. Box 2208, GR-71003 Heraklion Crete (Greece); Tzeli, Despoina S. [Department of Materials Science and Technology, University of Crete, GR-71003 Heraklion Crete (Greece); Anastasiadis, Spiros H. [Department of Chemistry, University of Crete, P.O. Box 2208, 710 03 Heraklion Crete (Greece); Institute of Electronic Structure and Laser, Foundation for Research and Technology-Hellas, GR-71110 Heraklion Crete (Greece); Bitsanis, Ioannis A. [Institute of Electronic Structure and Laser, Foundation for Research and Technology-Hellas, GR-71110 Heraklion Crete (Greece)

    2014-05-28

    Monte Carlo simulations are performed on a simple cubic lattice to investigate the behavior of a single linear multiblock copolymer chain of various lengths N. The chain of type (A{sub n}B{sub n}){sub m} consists of alternating A and B blocks, where A are solvophilic and B are solvophobic and N = 2nm. The conformations are classified in five cases of globule formation by the solvophobic blocks of the chain. The dependence of globule characteristics on the molecular weight and on the number of blocks, which participate in their formation, is examined. The focus is on relative high molecular weight blocks (i.e., N in the range of 500–5000 units) and very differing energetic conditions for the two blocks (very good—almost athermal solvent for A and bad solvent for B). A rich phase behavior is observed as a result of the alternating architecture of the multiblock copolymer chain. We trust that thermodynamic equilibrium has been reached for chains of N up to 2000 units; however, for longer chains kinetic entrapments are observed. The comparison among equivalent globules consisting of different number of B-blocks shows that the more the solvophobic blocks constituting the globule the bigger its radius of gyration and the looser its structure. Comparisons between globules formed by the solvophobic blocks of the multiblock copolymer chain and their homopolymer analogs highlight the important role of the solvophilic A-blocks.

  6. Applying the reciprocal dose principle to heterogeneous phantoms: practical experience from Monte Carlo studies

    International Nuclear Information System (INIS)

    Cristy, M.; Williams, L.R.

    1983-01-01

    The reciprocity theorem states that for any pair of regions in a uniform isotropic or uniform scatterless model, the specific fraction (PHI) is independent of which region is designated source and which is designated target. Although the conditions of these models are not met by phantoms heterogeneous in tissue composition and density, calculations with a Monte Carlo radiation transport code show that in many cases the reciprocal PHIs from photon radiation are approximately equal. This 'reciprocity principle' is valid within a factor of 2(Snyder) or about 20% (Mayneord and Clarke), except when one of the organs in the pair considered is the skeleton, where the reciprocal PHIs may differ by as much as a factor of 4. The principle holds within at least 10% when both organs are of near-unit-density. When one of the organs is near the tissue-vacuum boundary (skin, breasts, or testes), reciprocal PHIs may differ by as much as 10% or so at energies where scattering is marked. When one of the organs is the lungs or the whole body, a comparable error may occur at some energies. (author)

  7. Size dependence study of the ordering temperature in the Fast Monte Carlo method

    Energy Technology Data Exchange (ETDEWEB)

    Velasquez, E. A., E-mail: eavelas@gmail.com [Universidad de San Buenaventura Seccional Medellin, Grupo de Investigacion en Modelamiento y Simulacion Computacional, Facultad de Ingenierias (Colombia); Mazo-Zuluaga, J., E-mail: johanmazo@gmail.com [Universidad de Antioquia, Grupo de Estado Solido, Grupo de Instrumentacion Cientifica y Microelectronica, Instituto de Fisica-FCEN (Colombia); Mejia-Lopez, J., E-mail: jmejia@puc.cl [Universidad de Antioquia, Instituto de Fisica-FCEN (Colombia)

    2013-02-15

    Based on the framework of the Fast Monte Carlo approach, we study the diameter dependence of the ordering temperature in magnetic nanostructures of cylindrical shape. For the purposes of this study, Fe cylindrical-shaped samples of different sizes (20 nm height, 30-100 nm in diameter) have been chosen, and their magnetic properties have been computed as functions of the scaled temperature. Two main set of results are concluded: (a) the ordering temperature of nanostructures follows a linear scaling relationship as a function of the scaling factor x, for all the studied sizes. This finding rules out a scaling relation T Prime {sub c} = x{sup 3{eta}}T{sub c} (where {eta} is a scaling exponent, and T Prime {sub c} and T{sub c} are the scaled and true ordering temperatures) that has been proposed in the literature, and suggests that temperature should scale linearly with the scaling factor x. (b) For the nanostructures, there are three different order-disorder magnetic transition modes depending on the system's size, in very good agreement with previous experimental reports.

  8. New Advancements in the Study of the Uniform Electron Gas with Full Configuration Interaction Quantum Monte Carlo

    Science.gov (United States)

    Ruggeri, Michele; Luo, Hongjun; Alavi, Ali

    Full Configuration Interaction Quantum Monte Carlo (FCIQMC) is able to give remarkably accurate results in the study of atoms and molecules. The study of the uniform electron gas (UEG) on the other hand has proven to be much harder, particularly in the low density regime. The source of this difficulty comes from the strong interparticle correlations that arise at low density, and essentially forbid the study of the electron gas in proximity of Wigner crystallization. We extend a previous study on the three dimensional electron gas computing the energy of a fully polarized gas for N=27 electrons at high and medium density (rS = 0 . 5 to 5 . 0). We show that even when dealing with a polarized UEG the computational cost of the study of systems with rS > 5 . 0 is prohibitive; in order to deal with correlations and to extend the density range that to be studied we introduce a basis of localized states and an effective transcorrelated Hamiltonian.

  9. Evaluation of penetration and scattering components in conventional pinhole SPECT: phantom studies using Monte Carlo simulation

    International Nuclear Information System (INIS)

    Deloar, Hossain M; Watabe, Hiroshi; Aoi, Toshiyuki; Iida, Hidehiro

    2003-01-01

    In quantitative pinhole SPECT, photon penetration through the collimator edges (penetration), and photon scattering by the object (object scatter) and collimator (collimator scatter) have not been investigated rigorously. Monte Carlo simulation was used to evaluate these three physical processes for different tungsten knife-edge pinhole collimators using uniform, hotspot and donut phantoms filled with 201 Tl, 99m Tc, 123 I and 131 I solutions. For the hotspot phantom, the penetration levels with respect to total counts for a 1 mm pinhole aperture were 78%, 28% and 23% for 131 I, 123 I and 99m Tc, respectively. For a 2 mm aperture, these values were 65% for 131 I, 16% for 123 I and 12% for 99m Tc. For all pinholes, 201 Tl penetration was less than 4%. The evaluated scatter (from object and collimator) with a hotspot phantom for the 1 mm pinhole was 24%, 16%, 18% and 13% for 201 Tl, 99m Tc, 123 I and 131 I, respectively. Summation of the object and collimator scatter for the uniform phantom was approximately 20% higher than that for the hotspot phantom. Significant counts due to penetration and object and collimator scatter in the reconstructed image were observed inside the core of the donut phantom. The collimator scatter can be neglected for all isotopes used in this study except for 131 I. Object scatter correction for all radionuclides used in this study is necessary and correction for the penetration contribution is necessary for all radionuclides but 201 Tl

  10. A Monte Carlo Study of dose enhancement according to the enhancement agents

    Energy Technology Data Exchange (ETDEWEB)

    Kim, Jung Hoon; Kim, Chang Soo [Dept. of Radiological Science, College of Health Sciences, Catholic University of Pusan, Busan (Korea, Republic of); Hwang, Chul Hwan [Dept. of Radiation Oncology, Pusan National University Hospital, Busan (Korea, Republic of)

    2017-03-15

    Dose enhancement effects at megavoltage (MV) X and γ-ray energies, and the effects of different energy levels on incident energy, dose enhancement agents, and concentrations were analyzed using Monte Carlo simulations. Gold, gadolinium, Iodine, and iron oxide (Fe2O3) were compared as dose enhancement agents. For incident energy, 4, 6, 10 and 15 MV X-ray spectra produced by a linear accelerator and a Co60 γ-ray were used. The dose enhancement factor (DEF) was calculated using an ICRU Slab phantom for concentrations of 7, 18, and 30 mg/g. The DEF was higher at higher concentrations of dose enhancement agents and at lower incident energies. The calculated DEF ranged from 1.035 to 1.079, and dose enhancement effects were highest for iron oxide, followed by iodine, gadolinium, and gold. Thus, this study contributes to improving the therapeutic ratio by delivering larger doses of radiation to tumor volume, and provides data to support further in vivo and in vitro studies.

  11. Monte Carlo evaluation of scattering correction methods in 131I studies using pinhole collimator

    International Nuclear Information System (INIS)

    López Díaz, Adlin; San Pedro, Aley Palau; Martín Escuela, Juan Miguel; Rodríguez Pérez, Sunay; Díaz García, Angelina

    2017-01-01

    Scattering is quite important for image activity quantification. In order to study the scattering factors and the efficacy of 3 multiple window energy scatter correction methods during 131 I thyroid studies with a pinhole collimator (5 mm hole) a Monte Carlo simulation (MC) was developed. The GAMOS MC code was used to model the gamma camera and the thyroid source geometry. First, to validate the MC gamma camera pinhole-source model, sensibility in air and water of the simulated and measured thyroid phantom geometries were compared. Next, simulations to investigate scattering and the result of triple energy (TEW), Double energy (DW) and Reduced double (RDW) energy windows correction methods were performed for different thyroid sizes and depth thicknesses. The relative discrepancies to MC real event were evaluated. Results: The accuracy of the GAMOS MC model was verified and validated. The image’s scattering contribution was significant, between 27-40 %. The discrepancies between 3 multiple window energy correction method results were significant (between 9-86 %). The Reduce Double Window methods (15%) provide discrepancies of 9-16 %. Conclusions: For the simulated thyroid geometry with pinhole, the RDW (15 %) was the most effective. (author)

  12. Quantum Monte Carlo study of the superconductor-insulator transition in the dual vortex representation

    Science.gov (United States)

    Khan, Hasan; Gazit, Snir; Randeria, Mohit; Trivedi, Nandini

    The superconductor-insulator transition (SIT) in two dimensions is a paradigm for quantum criticality that has been observed experimentally in Josephson junction arrays, superconducting thin films, and cold atoms trapped in an optical lattice. The conventional picture of the transition is in terms of the condensation of bosonic degrees of freedom (Cooper pairs in superconductors). Interestingly, the transition has a dual description, where the insulating phase is a Bose condensate of vortices. We study the SIT numerically by means of a large-scale quantum Monte Carlo (QMC) simulation in the vortex representation. This provides direct access to both the boson and vortex degrees of freedom and allows us to numerically test the duality and quantify deviations from self-duality. Our main focus is on critical properties such as the vortex and the boson phase stiffness. We compare our results to previous studies in the bosonic representation. We acknowledge support from Grant DOE-BES DE-FG02-07ER46423 (HK, NT).

  13. A Monte Carlo study of the acceptance to scattered events in a depth encoding PET camera

    International Nuclear Information System (INIS)

    Moisan, C.; Tupper, P.; Rogers, J.G.; DeJong, J.K.

    1995-10-01

    We present a Monte Carlo study of acceptance to scattered events in a Depth Encoding Large Aperture Camera (DELAC), a hypothetical PET scanner with the capacity to encode the depth-of-interaction (DOI) of incident γ-rays. The simulation is initially validated against the measured energy resolution and scatter fraction of the ECAT-953B scanner. It is then used to assess the response to scattered events in a PET camera made of position encoding blocks of the EXACT HR PLUS type, modified to have DOI resolution through a variation in the photopeak pulse height. The detection efficiency for 511 keV γ-rays, as well as for those that scattered in the object or left only part of their energy in the block, is studied for several combinations of DOI sensitivities and block thicknesses. The scatter fraction predicted by the simulation for DELACs of various ring radii is compared to that of the ECAT-953B as a function of the energy threshold. The results indicate that the poorer discrimination of object scatters with depth sensitive blocks does not lead to a dramatic increase of the scatter fraction. (author). 10 refs., 1 tab., 5 figs

  14. A study of the dosimetry of small field photon beams used in intensity modulated radiation therapy in inhomogeneous media: Monte Carlo simulations, and algorithm comparisons and corrections

    International Nuclear Information System (INIS)

    Jones, Andrew Osler

    2004-01-01

    There is an increasing interest in the use of inhomogeneity corrections for lung, air, and bone in radiotherapy treatment planning. Traditionally, corrections based on physical density have been used. Modern algorithms use the electron density derived from CT images. Small fields are used in both conformal radiotherapy and IMRT, however, their beam characteristics in inhomogeneous media have not been extensively studied. This work compares traditional and modern treatment planning algorithms to Monte Carlo simulations in and near low-density inhomogeneities. Field sizes ranging from 0.5 cm to 5 cm in diameter are projected onto a phantom containing inhomogeneities and depth dose curves are compared. Comparisons of the Dose Perturbation Factors (DPF) are presented as functions of density and field size. Dose Correction Factors (DCF), which scale the algorithms to the Monte Carlo data, are compared for each algorithm. Physical scaling algorithms such as Batho and Equivalent Pathlength (EPL) predict an increase in dose for small fields passing through lung tissue, where Monte Carlo simulations show a sharp dose drop. The physical model-based collapsed cone convolution (CCC) algorithm correctly predicts the dose drop, but does not accurately predict the magnitude. Because the model-based algorithms do not correctly account for the change in backscatter, the dose drop predicted by CCC occurs farther downstream compared to that predicted by the Monte Carlo simulations. Beyond the tissue inhomogeneity all of the algorithms studied predict dose distributions in close agreement with Monte Carlo simulations. Dose-volume relationships are important in understanding the effects of radiation to the lung. The dose within the lung is affected by a complex function of beam energy, lung tissue density, and field size. Dose algorithms vary in their abilities to correctly predict the dose to the lung tissue. A thorough analysis of the effects of density, and field size on dose to the

  15. Monte Carlo simulation based study of a proposed multileaf collimator for a telecobalt machine

    International Nuclear Information System (INIS)

    Sahani, G.; Dash Sharma, P. K.; Hussain, S. A.; Dutt Sharma, Sunil; Sharma, D. N.

    2013-01-01

    Purpose: The objective of the present work was to propose a design of a secondary multileaf collimator (MLC) for a telecobalt machine and optimize its design features through Monte Carlo simulation. Methods: The proposed MLC design consists of 72 leaves (36 leaf pairs) with additional jaws perpendicular to leaf motion having the capability of shaping a maximum square field size of 35 × 35 cm 2 . The projected widths at isocenter of each of the central 34 leaf pairs and 2 peripheral leaf pairs are 10 and 5 mm, respectively. The ends of the leaves and the x-jaws were optimized to obtain acceptable values of dosimetric and leakage parameters. Monte Carlo N-Particle code was used for generating beam profiles and depth dose curves and estimating the leakage radiation through the MLC. A water phantom of dimension 50 × 50 × 40 cm 3 with an array of voxels (4 × 0.3 × 0.6 cm 3 = 0.72 cm 3 ) was used for the study of dosimetric and leakage characteristics of the MLC. Output files generated for beam profiles were exported to the PTW radiation field analyzer software through locally developed software for analysis of beam profiles in order to evaluate radiation field width, beam flatness, symmetry, and beam penumbra. Results: The optimized version of the MLC can define radiation fields of up to 35 × 35 cm 2 within the prescribed tolerance values of 2 mm. The flatness and symmetry were found to be well within the acceptable tolerance value of 3%. The penumbra for a 10 × 10 cm 2 field size is 10.7 mm which is less than the generally acceptable value of 12 mm for a telecobalt machine. The maximum and average radiation leakage through the MLC were found to be 0.74% and 0.41% which are well below the International Electrotechnical Commission recommended tolerance values of 2% and 0.75%, respectively. The maximum leakage through the leaf ends in closed condition was observed to be 8.6% which is less than the values reported for other MLCs designed for medical linear

  16. A Research and Study Course for learning the concept of discrete randomvariable using Monte Carlo methods

    Directory of Open Access Journals (Sweden)

    Vicente D. Estruch

    2017-08-01

    Full Text Available The concept of random variable is a mathematical construct that presents some theoretical complexity. However, learning  this  concept  can  be  facilitated  if  it  is  presented  as  the  end  of  a  sequential  process  of  modeling  of  a  real event. More specifically, to learn the concept of discrete random variable, the Monte Carlo simulation can provide an extremely useful tool because in the process of modeling / simulation one can approach the theoretical concept of random variable, while the random variable is observed \\in action". This paper presents a Research and Study Course  (RSC  based  on  series  of  activities  related  to  random  variables  such  as  training  and  introduction  of  simulation  elements,  then  the  construction  of  the  model  is  presented,  which  is  the  substantial  part  of  the  activity, generating a random variable and its probability function. Starting from a simple situation related to reproduction and  survival  of  the  litter  of  a  rodent,  with  random  components,  step  by  step,  the  model  that  represents  the  real raised situation is built obtaining an \\original" random variable. In the intermediate stages of the construction of the model have a fundamental role the uniform discrete and binomial distributions. The trajectory of these stages allows reinforcing the concept of random variable while exploring the possibilities offered by Monte Carlo methods to  simulate  real  cases  and  the  simplicity  of  implementing  these  methods  by  means  of  the  Matlab© programming language.

  17. Origin of two time-scale regimes in potentiometric titration of metal oxides. A replica kinetic Monte Carlo study

    International Nuclear Information System (INIS)

    Zarzycki, Piotr P.; Rosso, Kevin M.

    2009-01-01

    Replica Kinetic Monte Carlo simulations were used to study the characteristic time scales of potentiometric titration of the metal oxides and (oxy)hydroxides. The effect of surface heterogeneity and surface transformation on the titration kinetics were also examined. Two characteristic relaxation times are often observed experimentally, with the trailing slower part attributed to surface non-uniformity, porosity, polymerization, amorphization, and other dynamic surface processes induced by unbalanced surface charge. However, our simulations show that these two characteristic relaxation times are intrinsic to the proton binding reaction for energetically homogeneous surfaces, and therefore surface heterogeneity or transformation do not necessarily need to be invoked. However, all such second-order surface processes are found to intensify the separation and distinction of the two kinetic regimes. The effect of surface energetic-topographic non-uniformity, as well dynamic surface transformation, interface roughening/smoothing were described in a statistical fashion. Furthermore, our simulations show that a shift in the point-of-zero charge is expected from increased titration speed and the pH-dependence of the titration measurement error is in excellent agreement with experimental studies.

  18. Origin of two time-scale regimes in potentiometric titration of metal oxides. A replica kinetic Monte Carlo study.

    Science.gov (United States)

    Zarzycki, Piotr; Rosso, Kevin M

    2009-06-16

    Replica kinetic Monte Carlo simulations were used to study the characteristic time scales of potentiometric titration of the metal oxides and (oxy)hydroxides. The effect of surface heterogeneity and surface transformation on the titration kinetics were also examined. Two characteristic relaxation times are often observed experimentally, with the trailing slower part attributed to surface nonuniformity, porosity, polymerization, amorphization, and other dynamic surface processes induced by unbalanced surface charge. However, our simulations show that these two characteristic relaxation times are intrinsic to the proton-binding reaction for energetically homogeneous surfaces, and therefore surface heterogeneity or transformation does not necessarily need to be invoked. However, all such second-order surface processes are found to intensify the separation and distinction of the two kinetic regimes. The effect of surface energetic-topographic nonuniformity, as well dynamic surface transformation, interface roughening/smoothing were described in a statistical fashion. Furthermore, our simulations show that a shift in the point-of-zero charge is expected from increased titration speed, and the pH-dependence of the titration measurement error is in excellent agreement with experimental studies.

  19. Restricted primitive model for electrical double layers: modified HNC theory of density profiles and Monte Carlo study of differential capacitance

    International Nuclear Information System (INIS)

    Ballone, P.; Pastore, G.; Tosi, M.P.

    1986-02-01

    Interfacial properties of an ionic fluid next to a uniformly charged planar wall are studied in the restricted primitive model by both theoretical and Monte Carlo methods. The system is a 1:1 fluid of equisized charged hard spheres in a state appropriate to 1M aqueous electrolyte solutions. The interfacial density profiles of counterions and coions are evaluated by extending the hypernetted chain approximation (HNC) to include the leading bridge diagrams for the wall-ion correlations. The theoretical results compare well with those of grand canonical Monte Carlo computations of Torrie and Valleau over the whole range of surface charge density considered by these authors, thus resolving the earlier disagreement between statistical mechanical theories and simulation data at large charge densities. In view of the importance of the model as a testing ground for theories of the diffuse layer, the Monte Carlo calculations are tested by considering alternative choices for the basic simulation cell and are extended so as to allow an evaluation of the differential capacitance of the model interface by two independent methods. These involve numerical differentiation of the mean potential drop as a function of the surface charge density or alternatively an appropriate use of a fluctuation theory formula for the capacitance. The results of these two Monte Carlo approaches consistently indicate an initially smooth increase of the diffuse layer capacitance followed by structure at large charge densities, this behaviour being connected with layering of counterions as already revealed in the density profiles reported by Torrie and Valleau. (author)

  20. Studies of criticality Monte Carlo method convergence: use of a deterministic calculation and automated detection of the transient

    International Nuclear Information System (INIS)

    Jinaphanh, A.

    2012-01-01

    Monte Carlo criticality calculation allows to estimate the effective multiplication factor as well as local quantities such as local reaction rates. Some configurations presenting weak neutronic coupling (high burn up profile, complete reactor core,...) may induce biased estimations for k eff or reaction rates. In order to improve robustness of the iterative Monte Carlo methods, a coupling with a deterministic code was studied. An adjoint flux is obtained by a deterministic calculation and then used in the Monte Carlo. The initial guess is then automated, the sampling of fission sites is modified and the random walk of neutrons is modified using splitting and russian roulette strategies. An automated convergence detection method has been developed. It locates and suppresses the transient due to the initialization in an output series, applied here to k eff and Shannon entropy. It relies on modeling stationary series by an order 1 auto regressive process and applying statistical tests based on a Student Bridge statistics. This method can easily be extended to every output of an iterative Monte Carlo. Methods developed in this thesis are tested on different test cases. (author)

  1. Study on quantification method based on Monte Carlo sampling for multiunit probabilistic safety assessment models

    Energy Technology Data Exchange (ETDEWEB)

    Oh, Kye Min [KHNP Central Research Institute, Daejeon (Korea, Republic of); Han, Sang Hoon; Park, Jin Hee; Lim, Ho Gon; Yang, Joon Yang [Korea Atomic Energy Research Institute, Daejeon (Korea, Republic of); Heo, Gyun Young [Kyung Hee University, Yongin (Korea, Republic of)

    2017-06-15

    In Korea, many nuclear power plants operate at a single site based on geographical characteristics, but the population density near the sites is higher than that in other countries. Thus, multiunit accidents are a more important consideration than in other countries and should be addressed appropriately. Currently, there are many issues related to a multiunit probabilistic safety assessment (PSA). One of them is the quantification of a multiunit PSA model. A traditional PSA uses a Boolean manipulation of the fault tree in terms of the minimal cut set. However, such methods have some limitations when rare event approximations cannot be used effectively or a very small truncation limit should be applied to identify accident sequence combinations for a multiunit site. In particular, it is well known that seismic risk in terms of core damage frequency can be overestimated because there are many events that have a high failure probability. In this study, we propose a quantification method based on a Monte Carlo approach for a multiunit PSA model. This method can consider all possible accident sequence combinations in a multiunit site and calculate a more exact value for events that have a high failure probability. An example model for six identical units at a site was also developed and quantified to confirm the applicability of the proposed method.

  2. Self-Consistent Monte Carlo Study of the Coulomb Interaction under Nano-Scale Device Structures

    Science.gov (United States)

    Sano, Nobuyuki

    2011-03-01

    It has been pointed that the Coulomb interaction between the electrons is expected to be of crucial importance to predict reliable device characteristics. In particular, the device performance is greatly degraded due to the plasmon excitation represented by dynamical potential fluctuations in high-doped source and drain regions by the channel electrons. We employ the self-consistent 3D Monte Carlo (MC) simulations, which could reproduce both the correct mobility under various electron concentrations and the collective plasma waves, to study the physical impact of dynamical potential fluctuations on device performance under the Double-gate MOSFETs. The average force experienced by an electron due to the Coulomb interaction inside the device is evaluated by performing the self-consistent MC simulations and the fixed-potential MC simulations without the Coulomb interaction. Also, the band-tailing associated with the local potential fluctuations in high-doped source region is quantitatively evaluated and it is found that the band-tailing becomes strongly dependent of position in real space even inside the uniform source region. This work was partially supported by Grants-in-Aid for Scientific Research B (No. 2160160) from the Ministry of Education, Culture, Sports, Science and Technology in Japan.

  3. Size-exclusion partitioning of neutral solutes in crosslinked polymer networks: A Monte Carlo simulation study

    Energy Technology Data Exchange (ETDEWEB)

    Quesada-Pérez, Manuel; Maroto-Centeno, José Alberto [Departamento de Física, Escuela Politécnica Superior de Linares, Universidad de Jaén, 23700 Linares, Jaén (Spain); Adroher-Benítez, Irene [Grupo de Física de Fluidos y Biocoloides, Departamento de Física Aplicada, Facultad de Ciencias, Universidad de Granada, 18071 Granada (Spain)

    2014-05-28

    In this work, the size-exclusion partitioning of neutral solutes in crosslinked polymer networks has been studied through Monte Carlo simulations. Two models that provide user-friendly expressions to predict the partition coefficient have been tested over a wide range of volume fractions: Ogston's model (especially devised for fibrous media) and the pore model. The effects of crosslinking and bond stiffness have also been analyzed. Our results suggest that the fiber model can acceptably account for size-exclusion effects in crosslinked gels. Its predictions are good for large solutes if the fiber diameter is assumed to be the effective monomer diameter. For solutes sizes comparable to the monomer dimensions, a smaller fiber diameter must be used. Regarding the pore model, the partition coefficient is poorly predicted when the pore diameter is estimated as the distance between adjacent crosslinker molecules. On the other hand, our results prove that the pore sizes obtained from the pore model by fitting partitioning data of swollen gels are overestimated.

  4. Reliability study of a prestressed concrete beam by Monte Carlo techniques

    International Nuclear Information System (INIS)

    Floris, C.; Migliacci, A.

    1987-01-01

    The safety of a prestressed beam is studied at the third probabilistic level and so calculating the probability of failure (P f ) under known loads. Since the beam is simply supported and subject only to loads perpendicular to its axis, only bending and shear loads are present. Since the ratio between the span and the clear height is over 20 with thus a very considerable shear span, it can be assumed that failure occurs entirely due to the bending moment, with shear having no effect. In order to calculate P f the probability density function (p.d.f.) have to be known both for the stress moment and the resisting moment. Attention here is focused on the construction of the latter. It is shown that it is practically impossible to find the required function analytically. On the other hand, numerical simulation with the help of a computer is particularly convenient. The so-called Monte Carlo techniques were chosen: they are based on the extraction of random numbers and are thus very suitable for simulating random events and quantities. (orig./HP)

  5. Monte Carlo study of dynamic phase transition in Ising metamagnet driven by oscillating magnetic field

    International Nuclear Information System (INIS)

    Acharyya, Muktish

    2011-01-01

    The dynamical responses of Ising metamagnet (layered antiferromagnet) in the presence of a sinusoidally oscillating magnetic field are studied by Monte Carlo simulation. The time average staggered magnetisation plays the role of dynamic order parameter. A dynamical phase transition was observed and a phase diagram was plotted in the plane formed by field amplitude and temperature. The dynamical phase boundary is observed to shrink inward as the relative antiferromagnetic strength decreases. The results are compared with that obtained from pure ferromagnetic system. The shape of dynamic phase boundary observed to be qualitatively similar to that obtained from previous meanfield calculations. - Highlights: → The time average staggered magnetisation plays the role of dynamic order parameter. → A dynamical phase transition was observed and a phase diagram was plotted in the plane formed by field amplitude and temperature. → The dynamical phase boundary is observed to shrink inward as the relative antiferromagnetic strength decreases. → The results are compared with that obtained from pure ferromagnetic system. → The shape of dynamic phase boundary observed to be qualitatively similar to that obtained from previous meanfield calculation.

  6. RLS adaptive filtering for physiological interference reduction in NIRS brain activity measurement: a Monte Carlo study

    International Nuclear Information System (INIS)

    Zhang, Y; Sun, J W; Rolfe, P

    2012-01-01

    The non-invasive measurement of cerebral functional haemodynamics using near-infrared spectroscopy (NIRS) instruments is often affected by physiological interference. The suppression of this interference is crucial for reliable recovery of brain activity measurements because it can significantly affect the signal quality. In this study, we present a recursive least-squares (RLS) algorithm for adaptive filtering to reduce the magnitude of the physiological interference component. To evaluate it, we implemented Monte Carlo simulations based on a five-layer slab model of a human adult head with a multidistance source–detector arrangement, of a short pair and a long pair, for NIRS measurement. We derived measurements by adopting different interoptode distances, which is relevant to the process of optimizing the NIRS probe configuration. Both RLS and least mean squares (LMS) algorithms were used to attempt the removal of physiological interference. The results suggest that the RLS algorithm is more capable of minimizing the effect of physiological interference due to its advantages of faster convergence and smaller mean squared error (MSE). The influence of superficial layer thickness on the performance of the RLS algorithm was also investigated. We found that the near-detector position is an important variable in minimizing the MSE and a short source–detector separation less than 9 mm is robust to superficial layer thickness variation. (paper)

  7. Hysteresis loop behaviors of ferroelectric thin films:A Monte Carlo simulation study

    Institute of Scientific and Technical Information of China (English)

    C. M. Bedoya-Hincapi´e; H. H. Ortiz-´Alvarez; E. Restrepo-Parra; J. J. Olaya-Fl´orez; J. E. Alfonso

    2015-01-01

    The ferroelectric response of bismuth titanate Bi4Ti3O12 (BIT) thin film is studied through a Monte Carlo simulation of hysteresis loops. The ferroelectric system is described by using a Diffour Hamiltonian with three terms: the electric field applied in the z direction, the nearest dipole–dipole interaction in the transversal (x–y) direction, and the nearest dipole–dipole interaction in the direction perpendicular to the thin film (the z axis). In the sample construction, we take into consideration the dipole orientations of the monoclinic and orthorhombic structures that can appear in BIT at low temperature in the ferroelectric state. The effects of temperature, stress, and the concentration of pinned dipole defects are assessed by using the hysteresis loops. The results indicate the changes in the hysteresis area with temperature and stress, and the asymmetric hysteresis loops exhibit evidence of the imprint failure mechanism with the emergence of pinned dipolar defects. The simulated shift in the hysteresis loops conforms to the experimental ferroelectric response.

  8. Atomistic Kinetic Monte Carlo studies of microchemical evolutions driven by diffusion processes under irradiation

    Science.gov (United States)

    Soisson, F.; Becquart, C. S.; Castin, N.; Domain, C.; Malerba, L.; Vincent, E.

    2010-11-01

    Atomistic Kinetic Monte Carlo (AKMC) simulations are a powerful tool to study the microstructural and microchemical evolution of alloys controlled by diffusion processes, under irradiation and during thermal ageing. In the framework of the FP6 Perfect program, two main approaches have been applied to binary and multicomponent iron based alloys. The first one is based on a diffusion model which takes into account vacancy and self-interstitial jumps, using simple rigid lattice approximation and broken-bond models to compute the point-defect jump frequencies. The corresponding parameters are fitted on ab initio calculations of a few typical configurations and migration barriers. The second method uses empirical potentials to compute a much larger number of migration barriers, including atomic relaxations, and Artificial Intelligence regression methods to predict the other ones. It is somewhat less rapid than the first one, but significantly more than simulations using "on-the-fly" calculations of all the barriers. We review here the recent advances and perspectives concerning these techniques.

  9. Atomistic Kinetic Monte Carlo studies of microchemical evolutions driven by diffusion processes under irradiation

    International Nuclear Information System (INIS)

    Soisson, F.; Becquart, C.S.; Castin, N.; Domain, C.; Malerba, L.; Vincent, E.

    2010-01-01

    Atomistic Kinetic Monte Carlo (AKMC) simulations are a powerful tool to study the microstructural and microchemical evolution of alloys controlled by diffusion processes, under irradiation and during thermal ageing. In the framework of the FP6 Perfect program, two main approaches have been applied to binary and multicomponent iron based alloys. The first one is based on a diffusion model which takes into account vacancy and self-interstitial jumps, using simple rigid lattice approximation and broken-bond models to compute the point-defect jump frequencies. The corresponding parameters are fitted on ab initio calculations of a few typical configurations and migration barriers. The second method uses empirical potentials to compute a much larger number of migration barriers, including atomic relaxations, and Artificial Intelligence regression methods to predict the other ones. It is somewhat less rapid than the first one, but significantly more than simulations using 'on-the-fly' calculations of all the barriers. We review here the recent advances and perspectives concerning these techniques.

  10. Monte Carlo Study of the Diffusion of CO Molecules inside Anthraquinone Hexagons on Cu(111)

    Science.gov (United States)

    Kim, Kwangmoo; Einstein, T. L.; Wyrick, Jon; Bartels, Ludwig

    2010-03-01

    Using Monte Carlo calculations of the two-di-men-sion-al (2D) lattice gas model, we study the diffusion of CO molecules inside anthraquinone (AQ) hexagons on a Cu(111) plane. We use experimentally-derived CO-CO interactionsfootnotetextK.L. Wong, , L. Bartels, J. Chem.Phys.123, 201102 (2005) and the analytic expression for the long-range surface-state- mediated interactionsfootnotetextK. Berland, TLE, and P. Hyldgaard, Phys.Rev. B 80, 155431 (2009) to describe the CO-AQ interactions. We assume that the CO-CO interactions are not affected by the presence of AQ's and that the CO-AQ interactions can be controlled by varying the intra-surface-state (ISS) reflectance r and the ISS phase shift δ of the indirect-electronic adsorbate-pair interactions. Comparing our results with experimental observations, we find that not only pair but also surface-state-mediated trio interactionsfootnotetextP. Hyldgaard and T.L. Einstein, EPL 59, 265 (2002) are needed to understand the data.

  11. Size-exclusion partitioning of neutral solutes in crosslinked polymer networks: A Monte Carlo simulation study

    International Nuclear Information System (INIS)

    Quesada-Pérez, Manuel; Maroto-Centeno, José Alberto; Adroher-Benítez, Irene

    2014-01-01

    In this work, the size-exclusion partitioning of neutral solutes in crosslinked polymer networks has been studied through Monte Carlo simulations. Two models that provide user-friendly expressions to predict the partition coefficient have been tested over a wide range of volume fractions: Ogston's model (especially devised for fibrous media) and the pore model. The effects of crosslinking and bond stiffness have also been analyzed. Our results suggest that the fiber model can acceptably account for size-exclusion effects in crosslinked gels. Its predictions are good for large solutes if the fiber diameter is assumed to be the effective monomer diameter. For solutes sizes comparable to the monomer dimensions, a smaller fiber diameter must be used. Regarding the pore model, the partition coefficient is poorly predicted when the pore diameter is estimated as the distance between adjacent crosslinker molecules. On the other hand, our results prove that the pore sizes obtained from the pore model by fitting partitioning data of swollen gels are overestimated

  12. Deuterium fractionation on interstellar grains studied with modified rate equations and a Monte Carlo approach

    Science.gov (United States)

    Caselli, Paola; Stantcheva, Tatiana; Shalabiea, Osama; Shematovich, Valery I.; Herbst, Eric

    2002-10-01

    The formation of singly and doubly deuterated isotopomers of formaldehyde and of singly, doubly, and multiply deuterated isotopomers of methanol on interstellar grain surfaces has been studied with a semi-empirical modified rate approach and a Monte Carlo method in the temperature range 10- 20 K. Agreement between the results of the two methods is satisfactory for all major and many minor species throughout this range. If gas-phase fractionation can produce a high abundance of atomic deuterium, which then accretes onto grain surfaces, diffusive surface chemistry can produce large abundances of deuterated species, especially at low temperatures and high gas densities. Warming temperatures will then permit these surface species to evaporate into the gas, where they will remain abundant for a considerable period. We calculate that the doubly deuterated molecules CHD 2OH and CH 2DOD are particularly abundant and should be searched for in the gas phase of protostellar sources. For example, at 10 K and high density, these species can achieve up to 10-20% of the abundance of methanol.

  13. Suitability study of MCNP Monte Carlo program for use in medical physics

    International Nuclear Information System (INIS)

    Jeraj, R.

    1998-01-01

    MCNP is widely used Monte Carlo program in reactor and nuclear physics. However, an option of simulating electrons was added into the code a few years ago. With this extension MCNP became a code, potentially applicable for applications in medical physics. In 1997, a new version of the code, named MCNP4B was released, which contains several improvements in electron transport modeling. To test suitability of the code, several important issues were considered and examined. Default sampling in MCNP electron transport was found to be inappropriate, because it gives wrong depth dose curves for electron energies of interest in radiotherapy (Me V range). The problem can be solved if ITS-style energy sampling is used instead. One of the most difficult problems in electron transport is simulation of electron backscattering, which MCNP predicts well for all, low and high Z materials. One of the potential drawbacks, if somebody wanted to use MCNP for dosimetry on real patient geometries is that MCNP lattice calculation (e.g. when calculating dose distributions) becomes very slow for large number of scoring voxels. However, if just one scoring voxel is used, the number of geometry voxels only slightly affects the speed. In the study it was found that MCNP could be reliability used for many applications in medical physics. However, the established limitations should be taken into account when MCNP is used for a particular application.(author)

  14. Hysteresis loop behaviors of ferroelectric thin films: A Monte Carlo simulation study

    Science.gov (United States)

    M. Bedoya-Hincapié, C.; H. Ortiz-Álvarez, H.; Restrepo-Parra, E.; J. Olaya-Flórez, J.; E. Alfonso, J.

    2015-11-01

    The ferroelectric response of bismuth titanate Bi4Ti3O12 (BIT) thin film is studied through a Monte Carlo simulation of hysteresis loops. The ferroelectric system is described by using a Diffour Hamiltonian with three terms: the electric field applied in the z direction, the nearest dipole-dipole interaction in the transversal (x-y) direction, and the nearest dipole-dipole interaction in the direction perpendicular to the thin film (the z axis). In the sample construction, we take into consideration the dipole orientations of the monoclinic and orthorhombic structures that can appear in BIT at low temperature in the ferroelectric state. The effects of temperature, stress, and the concentration of pinned dipole defects are assessed by using the hysteresis loops. The results indicate the changes in the hysteresis area with temperature and stress, and the asymmetric hysteresis loops exhibit evidence of the imprint failure mechanism with the emergence of pinned dipolar defects. The simulated shift in the hysteresis loops conforms to the experimental ferroelectric response. Project sponsored by the research departments of the Universidad Nacional de Colombia DIMA and DIB under Project 201010018227-“Crecimiento y caracterización eléctrica y estructural de películas delgadas de BixTiyOz producidas mediante Magnetrón Sputtering” and Project 12920-“Desarrollo teóricoexperimental de nanoestructuras basadas en Bismuto y materiales similares” and “Bisnano Project.”

  15. A Monte Carlo study of Weibull reliability analysis for space shuttle main engine components

    Science.gov (United States)

    Abernethy, K.

    1986-01-01

    The incorporation of a number of additional capabilities into an existing Weibull analysis computer program and the results of Monte Carlo computer simulation study to evaluate the usefulness of the Weibull methods using samples with a very small number of failures and extensive censoring are discussed. Since the censoring mechanism inherent in the Space Shuttle Main Engine (SSME) data is hard to analyze, it was decided to use a random censoring model, generating censoring times from a uniform probability distribution. Some of the statistical techniques and computer programs that are used in the SSME Weibull analysis are described. The methods documented in were supplemented by adding computer calculations of approximate (using iteractive methods) confidence intervals for several parameters of interest. These calculations are based on a likelihood ratio statistic which is asymptotically a chisquared statistic with one degree of freedom. The assumptions built into the computer simulations are described. The simulation program and the techniques used in it are described there also. Simulation results are tabulated for various combinations of Weibull shape parameters and the numbers of failures in the samples.

  16. Knot probability of polygons subjected to a force: a Monte Carlo study

    International Nuclear Information System (INIS)

    Rensburg, E J Janse van; Orlandini, E; Tesi, M C; Whittington, S G

    2008-01-01

    We use Monte Carlo methods to study the knot probability of lattice polygons on the cubic lattice in the presence of an external force f. The force is coupled to the span of the polygons along a lattice direction, say the z-direction. If the force is negative polygons are squeezed (the compressive regime), while positive forces tend to stretch the polygons along the z-direction (the tensile regime). For sufficiently large positive forces we verify that the Pincus scaling law in the force-extension curve holds. At a fixed number of edges n the knot probability is a decreasing function of the force. For a fixed force the knot probability approaches unity as 1 - exp(-α 0 (f)n + o(n)), where α 0 (f) is positive and a decreasing function of f. We also examine the average of the absolute value of the writhe and we verify the square root growth law (known for f = 0) for all values of f

  17. Monte Carlo study on the properties of gluon and quark jets

    CERN Document Server

    Kun Shi Zhang; Mei Ling Yu; Lian Shou Liu

    2002-01-01

    The 3-jet events produced in e/sup +/e/sup -/ collisions at 91.2 GeV have been studied using Monte Carlo method. After applying two angular cuts the three angles between the jets are used to identify the individual jet in 3-jet events. The energy distributions of the three jets, the mean particle multiplicities, mean transverse momenta of the three jets in equal energy bins and their distributions have been analyzed. Comparing with the corresponding results from the quark jets in 2-jet events, a simple method to select gluon and quark jets from 3-jet events is obtained. The properties of the gluon and quark jets being selected using the introduced method are in qualitative agreement with the expectations of perturbative QCD. The ratio of the mean multiplicity between quark and gluon jets, /sub gluon///sub quark/, has been calculated. The results, again, agree with the experimental results from SLD, OPAL, ALEPH, and DELPHI Collaborations, indicating that the method proposed to select gluon and quark jets from ...

  18. Monte Carlo study on the properties of gluon and quark jets

    CERN Document Server

    Zhang Kun Shi; Yu Mei Ling; LianShouLiu

    2002-01-01

    The 3-jet events produced in e sup + e sup - collisions at 91.2 GeV have been studied using Monte Carlo method. After applying two angular cuts the three angles between the jets are used to identify the individual jet in 3-jet events. The energy distributions of the three jets, the mean particle multiplicities, mean transverse momenta of the three jets in equal energy bins and their distributions have been analyzed. Comparing with the corresponding results from the quark jets in 2-jet events, a simple method to select gluon and quark jets from 3-jet events is obtained. The properties of the gluon and quark jets being selected using the introduced method are in qualitative agreement with the expectations of perturbative QCD. The ratio of the mean multiplicity between quark and gluon jets, sub g sub l sub u sub o sub n / sub q sub u sub q sub r sub k , has been calculated. The results, again, agree with the experimental results from SLD, OPAL, ALEPH and DELPHI Collaborations, indicating that the method propose...

  19. Monte-Carlo study of ICRF-sustained mode operation in tandem mirrors

    Energy Technology Data Exchange (ETDEWEB)

    Todd, A.M.M. (Grumman Aerospace Corp., Princeton, NJ (USA))

    1984-09-01

    A study, using a Monte-Carlo simulation code, of ICRF-sustained mode operation in tandem mirrors by way of ICRF end-cell fuelling and heating is described. Although the basic parameter space considered corresponds to the Phaedrus experiment, the central-cell density and temperatures are extended towards the reactor regime. It is found that significant end cell ion potential barriers can be generated with ICRF, but that, owing to choking of the central-cell ion source stream by the plugging potential, saturation occurs and power requirements rapidly increase, so that the potential rise is limited to about twice the central-cell ion temperature. Although performance is improved as the ion cyclotron resonance approaches the end-cell mid-plane, no significant difference is found between inboard, outboard or double resonance location. As the central-cell density and temperatures are increased, the RF power requirement is found to increase dramatically. Optimum performance for end cell fuelling results when the central-cell electron temperature is higher than the ion temperature, but the magnitude of this ratio is limited by an increase in threshold power level with electron temperature.

  20. Comparison of parameters affecting GNP-loaded choroidal melanoma dosimetry; Monte Carlo study

    Science.gov (United States)

    Sharabiani, Marjan; Asadi, Somayeh; Barghi, Amir Rahnamai; Vaezzadeh, Mehdi

    2018-04-01

    The current study reports the results of tumor dosimetry in the presence of gold nanoparticles (GNPs) with different sizes and concentrations. Due to limited number of works carried out on the brachytherapy of choroidal melanoma in combination with GNPs, this study was performed to determine the optimum size and concentration for GNPs which contributes the highest dose deposition in tumor region, using two phantom test cases namely water phantom and a full Monte Carlo model of human eye. Both water and human eye phantoms were simulated with MCNP5 code. Tumor dosimetry was performed for a typical point photon source with an energy of 0.38 MeV as a high energy source and 103Pd brachytherapy source with an average energy of 0.021 MeV as a low energy source in water phantom and eye phantom respectively. Such a dosimetry was done for different sizes and concentrations of GNPs. For all of the diameters, increase in concentration of GNPs resulted in an increase in dose deposited in the region of interest. In a certain concentration, GNPs with larger diameters contributed more dose to the tumor region, which was more pronounced using eye phantom. 100 nm was reported as the optimum size in order to achieve the highest energy deposition within the target. This work investigated the optimum parameters affecting macroscopic dose enhancement in GNP-aided brachytherapy of choroidal melanoma. The current work also had implications on using low energy photon sources in the presence of GNPs to acquire the highest dose enhancement. This study is conducted through four different sizes and concentrations of GNPs. Considering the sensitivity of human eye tissue, in order to report the precise optimum parameters affecting radiosensitivity, a comprehensive study on a wide range of sizes and concentrations are required.

  1. Patient dose in image guided radiotherapy: Monte Carlo study of the CBCT dose contribution

    OpenAIRE

    Leotta, Salvatore; Amato, Ernesto; Settineri, Nicola; Basile, Emilia; Italiano, Antonio; Auditore, Lucrezia; Santacaterina, Anna; Pergolizzi, Stefano

    2018-01-01

    Image Guided RadioTherapy (IGRT) is a technique whose diffusion is growing thanks to the well-recognized gain in accuracy of dose delivery. However, multiple Cone Beam Computed Tomography (CBCT) scans add dose to patients, and its contribution has to be assessed and minimized. Aim of our work was to evaluate, through Monte Carlo simulations, organ doses in IGRT due to CBCT and therapeutic MV irradiation in head-neck, thorax and pelvis districts. We developed a Monte Carlo simulation in GAMOS ...

  2. Magnetic properties of dendrimer structures with different coordination numbers: A Monte Carlo study

    International Nuclear Information System (INIS)

    Masrour, R.; Jabar, A.

    2016-01-01

    We investigate the magnetic properties of Cayley trees of large molecules with dendrimer structure using Monte Carlo simulations. The thermal magnetization and magnetic susceptibility of a dendrimer structure are given with different coordination numbers, Z=3, 4, 5 and different generations g=3 and 2. The variation of magnetizations with the exchange interactions and crystal fields have been given of this system. The magnetic hysteresis cycles have been established. - Highlights: • The dendrimer structure is investigated using Monte Carlo simulations. • The transition temperatures are obtained for different coordination numbers and generations. • The magnetic hysteresis cycle has been established. • The dendrimer structure exhibit the superparamagnetic behavior.

  3. Magnetic properties of dendrimer structures with different coordination numbers: A Monte Carlo study

    Energy Technology Data Exchange (ETDEWEB)

    Masrour, R., E-mail: rachidmasrour@hotmail.com; Jabar, A.

    2016-11-01

    We investigate the magnetic properties of Cayley trees of large molecules with dendrimer structure using Monte Carlo simulations. The thermal magnetization and magnetic susceptibility of a dendrimer structure are given with different coordination numbers, Z=3, 4, 5 and different generations g=3 and 2. The variation of magnetizations with the exchange interactions and crystal fields have been given of this system. The magnetic hysteresis cycles have been established. - Highlights: • The dendrimer structure is investigated using Monte Carlo simulations. • The transition temperatures are obtained for different coordination numbers and generations. • The magnetic hysteresis cycle has been established. • The dendrimer structure exhibit the superparamagnetic behavior.

  4. Grand canonical Monte Carlo simulation study of capillary condensation between nanoparticles.

    Science.gov (United States)

    Kim, Seonmin; Ehrman, Sheryl H

    2007-10-07

    Capillary condensation at the nanoscale differs from condensation in the bulk phase, because it is a strong function of surface geometry and gas-surface interactions. Here, the effects of geometry on the thermodynamics of capillary condensation at the neck region between nanoparticles are investigated via a grand canonical Monte Carlo simulation using a two-dimensional lattice gas model. The microscopic details of the meniscus formation on various surface geometries are examined and compared with results of classical macromolecular theory, the Kelvin equation. We assume that the system is composed of a lattice gas and the surfaces of two particles are approximated by various shapes. The system is modeled on the basis of the molecular properties of the particle surface and lattice gas in our system corresponding to titania nanoparticles and tetraethoxy orthosilicate molecules, respectively. This system was chosen in order to reasonably emulate our previous experimental results for capillary condensation on nanoparticle surfaces. Qualitatively, our simulation results show that the specific geometry in the capillary zone, the surface-surface distance, and the saturation ratio are important for determining the onset and broadening of the liquid meniscus. The meniscus height increases continuously as the saturation ratio increases and the meniscus broadens faster above the saturation ratio of 0.90. The change of the radius of curvature of the particle surface affects the dimensions of the capillary zone, which drives more condensation in narrow zones and less condensation in wide zones. The increase of surface-surface distance results in the decrease of the meniscus height or even the disappearance of the meniscus entirely at lower saturation ratios. These effects are significant at the nanoscale and must be carefully considered in order to develop predictive relationships for meniscus height as a function of saturation conditions.

  5. A study on Monte Carlo analysis of Pebble-type VHTR core for hydrogen production

    International Nuclear Information System (INIS)

    Kim, Hong Chul

    2005-02-01

    In order to pursue exact the core analysis for VHTR core which will be developed in future, a study on Monte Carol method was carried out. In Korea, pebble and prism type core are under investigation for VHTR core analysis. In this study, pebble-type core was investigated because it was known that it should not only maintain the nuclear fuel integrity but also have the advantage in economical efficiency and safety. The pebble-bed cores of HTR-PROTEUS critical facility in Swiss were selected for the benchmark model. After the detailed MCNP modeling of the whole facility, calculations of nuclear characteristics were performed. The two core configurations, Core 4.3 and Core 5 (reference state no. 3), among the 10 configurations of the HTR-PROTEUS cores were chosen to be analyzed in order to treat different fuel loading pattern and modeled. The former is a random packing core and the latter deterministic packing core. Based on the experimental data and the benchmark result of other research groups for the two different cores, some nuclear characteristics were calculated. Firstly, keff was calculated for these cores. The effect for TRIO homogeneity model was investigated. Control rod and shutdown rod worths also were calculated and the sensitivity analysis on cross-section library and reflector thickness was pursued. Lastly, neutron flux profiles were investigated in reflector regions. It is noted that Monte Carlo analysis of pebble-type VHTR core was firstly carried out in Korea. Also, this study should not only provide the basic data for pebble-type VHTR core analysis for hydrogen production but also be utilized as the verified data to validate a computer code for VHTR core analysis which will be developed in future

  6. Study of variants for Monte Carlo generators of τ→3πν decays

    Energy Technology Data Exchange (ETDEWEB)

    Wąs, Zbigniew; Zaremba, Jakub, E-mail: jakub.zaremba@ifj.edu.pl [Institute of Nuclear Physics, PAN, ul. Radzikowskiego 152, Kraków (Poland)

    2015-11-28

    Low energy QCD (below 2 GeV) is a region of resonance dynamics, sometimes lacking a satisfactory description as compared to the precision of available experimental data. Hadronic τ decays offer a probe for such an energy regime. In general, the predictions for decays are model dependent, with parameters fitted to experimental results. The parameterizations differ by the amount of assumptions and theoretical requirements taken into account. Both model distributions and acquired data samples used for the fits are the results of a complex effort. In this paper, we investigate the main parameterizations of τ decay matrix elements for the one- and three-prong channels of three-pion τ decays. The differences in analytical forms of the currents and resulting distributions used for comparison with the experimental data are studied. We use invariant mass spectra of all possible pion pairs and the whole three-pion system. Also three-dimensional histograms spanned over all distinct squared invariant masses are used to represent the results of models and experimental data. We present distributions from TAUOLA Monte Carlo generation and a semi-analytical calculation. These are necessary steps in the development for fitting in an as model-independent way as possible, and to explore multi-million event experimental data samples. This includes the response of distributions to model variants, and/or numerical values of the parameters. The interference effects of the currents’ parts are also studied. For technical purposes, weighted events are introduced. Even though we focus on 3πν{sub τ} modes, technical aspects of our study are relevant for all τ decay modes into three hadrons.

  7. Study of variants for Monte Carlo generators of τ → 3πν decays

    Energy Technology Data Exchange (ETDEWEB)

    Was, Zbigniew; Zaremba, Jakub [PAN, Institute of Nuclear Physics, Krakow (Poland)

    2015-11-15

    Low energy QCD (below 2 GeV) is a region of resonance dynamics, sometimes lacking a satisfactory description as compared to the precision of available experimental data. Hadronic τ decays offer a probe for such an energy regime. In general, the predictions for decays are model dependent, with parameters fitted to experimental results. The parameterizations differ by the amount of assumptions and theoretical requirements taken into account. Both model distributions and acquired data samples used for the fits are the results of a complex effort. In this paper, we investigate the main parameterizations of τ decays. The differences in analytical forms of the currents and resulting distributions used for comparison with the experimental data are studied. We use invariant mass spectra of all possible pion pairs and the whole three-pion system. Also three-dimensional histograms spanned over all distinct squared invariant masses are used to represent the results of models and experimental data. We present distributions from TAUOLA Monte Carlo generation and a semi-analytical calculation. These are necessary steps in the development for fitting in an as model-independent way as possible, and to explore multi-million event experimental data samples. This includes the response of distributions to model variants, and/or numerical values of the parameters. The interference effects of the currents' parts are also studied. For technical purposes, weighted events are introduced. Even though we focus on 3πν{sub τ} modes, technical aspects of our study are relevant for all τ decay modes into three hadrons. (orig.)

  8. Dose enhancement in radiotherapy of small lung tumors using inline magnetic fields: A Monte Carlo based planning study

    Energy Technology Data Exchange (ETDEWEB)

    Oborn, B. M., E-mail: brad.oborn@gmail.com [Illawarra Cancer Care Centre (ICCC), Wollongong, NSW 2500, Australia and Centre for Medical Radiation Physics (CMRP), University of Wollongong, Wollongong, NSW 2500 (Australia); Ge, Y. [Sydney Medical School, University of Sydney, NSW 2006 (Australia); Hardcastle, N. [Northern Sydney Cancer Centre, Royal North Shore Hospital, Sydney, NSW 2065 (Australia); Metcalfe, P. E. [Centre for Medical Radiation Physics (CMRP), University of Wollongong, Wollongong NSW 2500, Australia and Ingham Institute for Applied Medical Research, Liverpool, NSW 2170 (Australia); Keall, P. J. [Sydney Medical School, University of Sydney, NSW 2006, Australia and Ingham Institute for Applied Medical Research, Liverpool, NSW 2170 (Australia)

    2016-01-15

    Purpose: To report on significant dose enhancement effects caused by magnetic fields aligned parallel to 6 MV photon beam radiotherapy of small lung tumors. Findings are applicable to future inline MRI-guided radiotherapy systems. Methods: A total of eight clinical lung tumor cases were recalculated using Monte Carlo methods, and external magnetic fields of 0.5, 1.0, and 3 T were included to observe the impact on dose to the planning target volume (PTV) and gross tumor volume (GTV). Three plans were 6 MV 3D-CRT plans while 6 were 6 MV IMRT. The GTV’s ranged from 0.8 to 16 cm{sup 3}, while the PTV’s ranged from 1 to 59 cm{sup 3}. In addition, the dose changes in a 30 cm diameter cylindrical water phantom were investigated for small beams. The central 20 cm of this phantom contained either water or lung density insert. Results: For single beams, an inline magnetic field of 1 T has a small impact in lung dose distributions by reducing the lateral scatter of secondary electrons, resulting in a small dose increase along the beam. Superposition of multiple small beams leads to significant dose enhancements. Clinically, this process occurs in the lung tissue typically surrounding the GTV, resulting in increases to the D{sub 98%} (PTV). Two isolated tumors with very small PTVs (3 and 6 cm{sup 3}) showed increases in D{sub 98%} of 23% and 22%. Larger PTVs of 13, 26, and 59 cm{sup 3} had increases of 9%, 6%, and 4%, describing a natural fall-off in enhancement with increasing PTV size. However, three PTVs bounded to the lung wall showed no significant increase, due to lack of dose enhancement in the denser PTV volume. In general, at 0.5 T, the GTV mean dose enhancement is around 60% lower than that at 1 T, while at 3 T, it is 5%–60% higher than 1 T. Conclusions: Monte Carlo methods have described significant and predictable dose enhancement effects in small lung tumor plans for 6 MV radiotherapy when an external inline magnetic field is included. Results of this study

  9. Monte Carlo simulation studies on scintillation detectors and image reconstruction of brain-phantom tumors in TOFPET

    Directory of Open Access Journals (Sweden)

    Mondal Nagendra

    2009-01-01

    Full Text Available This study presents Monte Carlo Simulation (MCS results of detection efficiencies, spatial resolutions and resolving powers of a time-of-flight (TOF PET detector systems. Cerium activated Lutetium Oxyorthosilicate (Lu 2 SiO 5 : Ce in short LSO, Barium Fluoride (BaF 2 and BriLanCe 380 (Cerium doped Lanthanum tri-Bromide, in short LaBr 3 scintillation crystals are studied in view of their good time and energy resolutions and shorter decay times. The results of MCS based on GEANT show that spatial resolution, detection efficiency and resolving power of LSO are better than those of BaF 2 and LaBr 3 , although it possesses inferior time and energy resolutions. Instead of the conventional position reconstruction method, newly established image reconstruction (talked about in the previous work method is applied to produce high-tech images. Validation is a momentous step to ensure that this imaging method fulfills all purposes of motivation discussed by reconstructing images of two tumors in a brain phantom.

  10. Transmission of 14 MeV neutrons through concrete, soil, sugar, wood and coal samples - a Monte Carlo Study

    International Nuclear Information System (INIS)

    Abdelmonem, M.S.; Naqvi, A.A.

    2006-01-01

    Full text: Fast neutrons transmission measurements are ideal for the elemental analysis of bulk samples. In particular, they can be used to determine the hydrogen concentration in bulk samples. In the present study, Monte Carlo simulations have been carried to calculate the intensity of 14 MeV neutrons transmitted through concrete, soil, sugar, wood and coal samples. The simulated set-up consists of a cylindrical sample, placed at a distance of 9 cm from the neutron source. Fast neutrons transmitted through the sample are collimated through a double truncated neutron collimator to a fast neutron detector. The collimator contains a mixture of paraffin and lithium carbonate. In this study, transmitted intensity of fast neutron through each sample was calculated as a function of moisture contents of the sample for 14 MeV neutrons. The moisture contents of the samples were varied over 0-7 wt. %. The calculated intensity of 14 MeV neutrons transmitted through the samples, shows effects related to fast neutron thermalization in hydrogen of moisture and energy dependence of neutron transmission through the sample materials. This is clearly shown by different gradients of neutron yield vs moisture content curves of these samples. The gradient of the neutron yield curves for the 14 MeV neutrons has a lower value than those reported for a 241 Am-Be neutron source

  11. Contrast-to-noise ratio in magnification mammography: a Monte Carlo study

    International Nuclear Information System (INIS)

    Koutalonis, M; Delis, H; Spyrou, G; Costaridou, L; Tzanakos, G; Panayiotakis, G

    2007-01-01

    Magnification views are a common way to perform a secondary examination when suspicious abnormalities are found in a screening mammogram. The visibility of microcalcifications and breast lesions is restricted by the compromise between the image quality and the absorbed dose. In this study, image quality characteristics in magnification mammography were evaluated based on Monte Carlo techniques. A breast phantom was utilized, simulating a homogeneous mixture of adipose and glandular tissue in various percentages of glandularity, containing inhomogeneities of various sizes and compositions. The effect of the magnification degree, breast glandularity, tube voltage and anode/filter material combination on image quality characteristics was investigated in terms of a contrast-to-noise ratio (CNR). A performance index PI ν was introduced in order to study the overall performance of various anode/filter combinations under different exposure parameters. Results demonstrate that CNR is improved with the degree of magnification and degraded as the breast glandularity is increased. Degree of magnification 1.3 offers the best overall performance for most of the anode/filter combinations utilized. Under magnification conditions, the role of dose is demoted against the image quality, as magnification views are secondary, diagnostic examinations and not screening procedures oriented to non-symptomatic women. For decreased image quality weighting, some anode/filter combinations different from Mo/0.030mmMo can be utilized as they offer a similar performance index. However, if the desired weighting for the image quality is high, the Mo/0.030mmMo combination has the best overall performance

  12. A Monte Carlo study of macroscopic and microscopic dose descriptors for kilovoltage cellular dosimetry

    Science.gov (United States)

    Oliver, P. A. K.; Thomson, Rowan M.

    2017-02-01

    This work investigates how doses to cellular targets depend on cell morphology, as well as relations between cellular doses and doses to bulk tissues and water. Multicellular models of five healthy and cancerous soft tissues are developed based on typical values of cell compartment sizes, elemental compositions and number densities found in the literature. Cells are modelled as two concentric spheres with nucleus and cytoplasm compartments. Monte Carlo simulations are used to calculate the absorbed dose to the nucleus and cytoplasm for incident photon energies of 20-370 keV, relevant for brachytherapy, diagnostic radiology, and out-of-field radiation in higher-energy external beam radiotherapy. Simulations involving cell clusters, single cells and single nuclear cavities are carried out for cell radii between 5 and 10~μ m, and nuclear radii between 2 and 9~μ m. Seven nucleus and cytoplasm elemental compositions representative of animal cells are considered. The presence of a cytoplasm, extracellular matrix and surrounding cells can affect the nuclear dose by up to 13 % . Differences in cell and nucleus size can affect dose to the nucleus (cytoplasm) of the central cell in a cluster of 13 cells by up to 13 % (8 % ). Furthermore, the results of this study demonstrate that neither water nor bulk tissue are reliable substitutes for subcellular targets for incident photon energies  <50 keV: nuclear (cytoplasm) doses differ from dose-to-medium by up to 32 % (18 % ), and from dose-to-water by up to 21 % (8 % ). The largest differences between dose descriptors are seen for the lowest incident photon energies; differences are less than 3 % for energies ≥slant 90 keV. The sensitivity of results with regard to the parameters of the microscopic tissue structure model and cell model geometry, and the importance of the nucleus and cytoplasm as targets for radiation-induced cell death emphasize the importance of accurate models for cellular dosimetry studies.

  13. Solvent effects on excited-state structures: A quantum Monte Carlo and density functional study

    NARCIS (Netherlands)

    Guareschi, R.; Floris, F.M.; Amovilli, C.; Filippi, Claudia

    2014-01-01

    We present the first application of quantum Monte Carlo (QMC) in its variational flavor combined with the polarizable continuum model (PCM) to perform excited-state geometry optimization in solution. Our implementation of the PCM model is based on a reaction field that includes both volume and

  14. Kinetic Monte Carlo study of sensitiviy of OLED efficiency and lifetime to materials parameters

    NARCIS (Netherlands)

    Coehoorn, R.; Eersel, van H.; Bobbert, P.A.; Janssen, R.A.J.

    2015-01-01

    The performance of organic light-emitting diodes (OLEDs) is determined by a complex interplay of the optoelectronic processes in the active layer stack. In order to enable simulation-assisted layer stack development, a three-dimensional kinetic Monte Carlo OLED simulation method which includes the

  15. Adsorption of branched and dendritic polymers onto flat surfaces: A Monte Carlo study

    Science.gov (United States)

    Sommer, J.-U.; Kłos, J. S.; Mironova, O. N.

    2013-12-01

    Using Monte Carlo simulations based on the bond fluctuation model we study the adsorption of starburst dendrimers with flexible spacers onto a flat surface. The calculations are performed for various generation number G and spacer length S in a wide range of the reduced temperature τ as the measure of the interaction strength between the monomers and the surface. Our simulations indicate a two-step adsorption scenario. Below the critical point of adsorption, τc, a weakly adsorbed state of the dendrimer is found. Here, the dendrimer retains its shape but sticks to the surface by adsorbed spacers. By lowering the temperature below a spacer-length dependent value, τ*(S) model of a dendrimer in two dimensions. We also performed simulations of star-polymers which display a simple crossover-behavior in full analogy to linear chains. By analyzing the order parameter of the adsorption transition, we determine the critical point of adsorption of the dendrimers which is located close to the critical point of adsorption for star-polymers. While the order parameter for the adsorbed spacers displays a critical crossover scaling, the overall order parameter, which combines both critical and discontinuous transition effects, does not display simple scaling. The step-like transition from the weak into the strong adsorbed regime is confirmed by analyzing the shape-anisotropy of the dendrimers. We present a mean-field model based on the concept of spacer adsorption which predicts a discontinuous transition of dendrimers due to an excluded volume barrier. The latter results from an increased density of the dendrimer in the flatly adsorbed state which has to be overcome before this state is thermodynamically stable.

  16. Adsorption of branched and dendritic polymers onto flat surfaces: A Monte Carlo study

    International Nuclear Information System (INIS)

    Sommer, J.-U.; Kłos, J. S.; Mironova, O. N.

    2013-01-01

    Using Monte Carlo simulations based on the bond fluctuation model we study the adsorption of starburst dendrimers with flexible spacers onto a flat surface. The calculations are performed for various generation number G and spacer length S in a wide range of the reduced temperature τ as the measure of the interaction strength between the monomers and the surface. Our simulations indicate a two-step adsorption scenario. Below the critical point of adsorption, τ c , a weakly adsorbed state of the dendrimer is found. Here, the dendrimer retains its shape but sticks to the surface by adsorbed spacers. By lowering the temperature below a spacer-length dependent value, τ*(S) c , a step-like transition into a strongly adsorbed state takes place. In the flatly adsorbed state the shape of the dendrimer is well described by a mean field model of a dendrimer in two dimensions. We also performed simulations of star-polymers which display a simple crossover-behavior in full analogy to linear chains. By analyzing the order parameter of the adsorption transition, we determine the critical point of adsorption of the dendrimers which is located close to the critical point of adsorption for star-polymers. While the order parameter for the adsorbed spacers displays a critical crossover scaling, the overall order parameter, which combines both critical and discontinuous transition effects, does not display simple scaling. The step-like transition from the weak into the strong adsorbed regime is confirmed by analyzing the shape-anisotropy of the dendrimers. We present a mean-field model based on the concept of spacer adsorption which predicts a discontinuous transition of dendrimers due to an excluded volume barrier. The latter results from an increased density of the dendrimer in the flatly adsorbed state which has to be overcome before this state is thermodynamically stable

  17. Adsorption of branched and dendritic polymers onto flat surfaces: A Monte Carlo study

    Energy Technology Data Exchange (ETDEWEB)

    Sommer, J.-U. [Leibniz Institute of Polymer Research Dresden e. V., 01069 Dresden (Germany); Institute for Theoretical Physics, Technische Universität Dresden, 01069 Dresden (Germany); Kłos, J. S. [Leibniz Institute of Polymer Research Dresden e. V., 01069 Dresden (Germany); Faculty of Physics, A. Mickiewicz University, Umultowska 85, 61-614 Poznań (Poland); Mironova, O. N. [Leibniz Institute of Polymer Research Dresden e. V., 01069 Dresden (Germany)

    2013-12-28

    Using Monte Carlo simulations based on the bond fluctuation model we study the adsorption of starburst dendrimers with flexible spacers onto a flat surface. The calculations are performed for various generation number G and spacer length S in a wide range of the reduced temperature τ as the measure of the interaction strength between the monomers and the surface. Our simulations indicate a two-step adsorption scenario. Below the critical point of adsorption, τ{sub c}, a weakly adsorbed state of the dendrimer is found. Here, the dendrimer retains its shape but sticks to the surface by adsorbed spacers. By lowering the temperature below a spacer-length dependent value, τ*(S) < τ{sub c}, a step-like transition into a strongly adsorbed state takes place. In the flatly adsorbed state the shape of the dendrimer is well described by a mean field model of a dendrimer in two dimensions. We also performed simulations of star-polymers which display a simple crossover-behavior in full analogy to linear chains. By analyzing the order parameter of the adsorption transition, we determine the critical point of adsorption of the dendrimers which is located close to the critical point of adsorption for star-polymers. While the order parameter for the adsorbed spacers displays a critical crossover scaling, the overall order parameter, which combines both critical and discontinuous transition effects, does not display simple scaling. The step-like transition from the weak into the strong adsorbed regime is confirmed by analyzing the shape-anisotropy of the dendrimers. We present a mean-field model based on the concept of spacer adsorption which predicts a discontinuous transition of dendrimers due to an excluded volume barrier. The latter results from an increased density of the dendrimer in the flatly adsorbed state which has to be overcome before this state is thermodynamically stable.

  18. Study of the parameters affecting operator doses in interventional radiology using Monte Carlo simulations

    International Nuclear Information System (INIS)

    Koukorava, C.; Carinou, E.; Ferrari, P.; Krim, S.; Struelens, L.

    2011-01-01

    Measurements performed within the ORAMED project helped to evaluate the dose levels to the operators’ hands, wrists, legs and eye lenses, during several types of interventional radiology (IR) and cardiology (IC) procedures, and also to determine the parameters that affect the doses. However, the study of the effect of each parameter separately, was possible only through Monte Carlo (MC) simulations, as in clinical practice many of those parameters change simultaneously. The influence of the protective equipment, the beam projections, the beam quality, the field size and the position of the operator according to the position of access of the catheter was investigated, using anthropomorphic phantoms in setups that represent realistic IR/IC procedures. The proper use of protective shields was found to be the most important way of reducing extremity and eye lens exposure during such examinations. Ceiling suspended shields can reduce the doses to the eye lenses up to 97%, but they can also reduce hand doses about 70% when placed correctly. The highest exposure to the operator is observed for left anterior oblique (LAO) and cranial projections. Additionally, for overcouch irradiations the eyes and the hands are about 6 times more exposed compared to the cases where the tube is below the operating table. For the lateral LAO projection, placing the ceiling suspended shield at the left side of the operator is twice more effective for the protection of the eyes compared to the cases where it is placed above the patient. Finally, beam collimation was found to play an important role in the reduction of the hands and wrists doses, especially when the operator is close to the irradiation field.

  19. Gun Shows and Gun Violence: Fatally Flawed Study Yields Misleading Results

    Science.gov (United States)

    Hemenway, David; Webster, Daniel; Pierce, Glenn; Braga, Anthony A.

    2010-01-01

    A widely publicized but unpublished study of the relationship between gun shows and gun violence is being cited in debates about the regulation of gun shows and gun commerce. We believe the study is fatally flawed. A working paper entitled “The Effect of Gun Shows on Gun-Related Deaths: Evidence from California and Texas” outlined this study, which found no association between gun shows and gun-related deaths. We believe the study reflects a limited understanding of gun shows and gun markets and is not statistically powered to detect even an implausibly large effect of gun shows on gun violence. In addition, the research contains serious ascertainment and classification errors, produces results that are sensitive to minor specification changes in key variables and in some cases have no face validity, and is contradicted by 1 of its own authors’ prior research. The study should not be used as evidence in formulating gun policy. PMID:20724672

  20. Study of the heterogeneities effect in the dose distributions of Leksell Gamma Knife (R), through Monte Carlo simulation

    International Nuclear Information System (INIS)

    Rojas C, E.L.; Al-Dweri, F.M.O.; Lallena R, A.M.

    2005-01-01

    In this work they are studied, by means of Monte Carlo simulation, the effects that take place in the dose profiles that are obtained with the Leksell Gamma Knife (R), when they are kept in account heterogeneities. The considered heterogeneities simulate the skull and the spaces of air that are in the head, like they can be the nasal breasts or the auditory conduits. The calculations were made using the Monte Carlo Penelope simulation code (v. 2003). The geometry of each one of the 201 sources that this instrument is composed, as well as of the corresponding channels of collimation of the Gamma Knife (R), it was described by means of a simplified model of geometry that has been recently studied. The obtained results when they are kept in mind the heterogeneities they present non worthless differences regarding those obtained when those are not considered. These differences are maximum in the proximities of the interfaces among different materials. (Author)

  1. Monte Carlo simulation for scanning technique with scattering foil free electron beam: A proof of concept study.

    Directory of Open Access Journals (Sweden)

    Wonmo Sung

    Full Text Available This study investigated the potential of a newly proposed scattering foil free (SFF electron beam scanning technique for the treatment of skin cancer on the irregular patient surfaces using Monte Carlo (MC simulation. After benchmarking of the MC simulations, we removed the scattering foil to generate SFF electron beams. Cylindrical and spherical phantoms with 1 cm boluses were generated and the target volume was defined from the surface to 5 mm depth. The SFF scanning technique with 6 MeV electrons was simulated using those phantoms. For comparison, volumetric modulated arc therapy (VMAT plans were also generated with two full arcs and 6 MV photon beams. When the scanning resolution resulted in a larger separation between beams than the field size, the plan qualities were worsened. In the cylindrical phantom with a radius of 10 cm, the conformity indices, homogeneity indices and body mean doses of the SFF plans (scanning resolution = 1° vs. VMAT plans were 1.04 vs. 1.54, 1.10 vs. 1.12 and 5 Gy vs. 14 Gy, respectively. Those of the spherical phantom were 1.04 vs. 1.83, 1.08 vs. 1.09 and 7 Gy vs. 26 Gy, respectively. The proposed SFF plans showed superior dose distributions compared to the VMAT plans.

  2. Monte Carlo simulation for scanning technique with scattering foil free electron beam: A proof of concept study.

    Science.gov (United States)

    Sung, Wonmo; Park, Jong In; Kim, Jung-In; Carlson, Joel; Ye, Sung-Joon; Park, Jong Min

    2017-01-01

    This study investigated the potential of a newly proposed scattering foil free (SFF) electron beam scanning technique for the treatment of skin cancer on the irregular patient surfaces using Monte Carlo (MC) simulation. After benchmarking of the MC simulations, we removed the scattering foil to generate SFF electron beams. Cylindrical and spherical phantoms with 1 cm boluses were generated and the target volume was defined from the surface to 5 mm depth. The SFF scanning technique with 6 MeV electrons was simulated using those phantoms. For comparison, volumetric modulated arc therapy (VMAT) plans were also generated with two full arcs and 6 MV photon beams. When the scanning resolution resulted in a larger separation between beams than the field size, the plan qualities were worsened. In the cylindrical phantom with a radius of 10 cm, the conformity indices, homogeneity indices and body mean doses of the SFF plans (scanning resolution = 1°) vs. VMAT plans were 1.04 vs. 1.54, 1.10 vs. 1.12 and 5 Gy vs. 14 Gy, respectively. Those of the spherical phantom were 1.04 vs. 1.83, 1.08 vs. 1.09 and 7 Gy vs. 26 Gy, respectively. The proposed SFF plans showed superior dose distributions compared to the VMAT plans.

  3. Radiation characteristics of water droplets in a fire-inspired environment: A Monte Carlo ray tracing study

    Science.gov (United States)

    Wu, Bifen; Zhao, Xinyu

    2018-06-01

    The effects of radiation of water mists in a fire-inspired environment are numerically investigated for different complexities of radiative media in a three-dimensional cubic enclosure. A Monte Carlo ray tracing (MCRT) method is employed to solve the radiative transfer equation (RTE). The anisotropic scattering behaviors of water mists are modeled by a combination of the Mie theory and the Henyey-Greestein relation. A tabulation method considering the size and wavelength dependencies is established for water droplets, to reduce the computational cost associated with the evaluation of the nongray spectral properties of water mists. Validation and verification of the coupled MCRT solver are performed using a one-dimensional slab with gray gas in comparison with the analytical solutions. Parametric studies are then performed using a three-dimensional cubic box to examine radiation of two monodispersed and one polydispersed water mist systems. The tabulation method can reduce the computational cost by a factor of one hundred. Results obtained without any scattering model better conform with results obtained from the anisotropic model than the isotropic scattering model, when a highly directional emissive source is applied. For isotropic emissive sources, isotropic and anisotropic scattering models predict comparable results. The addition of different volume fractions of soot shows that soot may have a negative impact on the effectiveness of water mists in absorbing radiation when its volume fraction exceeds certain threshold.

  4. A study on optimization of photoneutron shielding in a medical accelerator room by using Monte Carlo simulation

    International Nuclear Information System (INIS)

    Kim, Yong Nam; Jeong, Kyoungkeun; Kim, Joo Young; Lee, Chang Geol; Seong, Jinsil; Choi, Sang Hyun; Kim, Chan Hyeong

    2008-01-01

    Medical linear accelerators operating above 10 MV require door shielding for neutrons in addition to photons. A criterion for choice of optimal configuration of lamination of BPE (Borated Polyethylene) and lead is not clear. Moreover, optimal configuration cannot be determined by the conventional method using an analytical formula and simple measurement. This study performs Monte Carlo simulation of radiation field in a commercial LINAC room with 15 MV X-ray sources. Considering two configuration of lamination such as 'lead-BPE' and 'lead-BPE-lead', dose equivalents are calculated by using the MCNPX code and comparative analyses are performed with each other. The obtained results show that there is no significant difference in neuron shielding between both configurations, whereas lead-BPE-lead is more effective for photon shielding. It is also noted that the absolute values of neutron doses are much greater than that of photon doses outside as well as inside the door, by three orders of magnitude. As a conclusion, the laminating of lead-BPE is suggested as the optimal configuration from the viewpoint of simplicity in fabrication and handling, even though it has no significant difference from lead-BPE-lead in terms of total dose equivalent. (author)

  5. A Monte Carlo study on {sup 223}Ra imaging for unsealed radionuclide therapy

    Energy Technology Data Exchange (ETDEWEB)

    Takahashi, Akihiko, E-mail: takahsr@hs.med.kyushu-u.ac.jp; Miwa, Kenta; Sasaki, Masayuki [Faculty of Medical Sciences, Department of Health Sciences, Kyushu University, 3-1-1, Maidashi, Higashi-ku, Fukuoka 812-8582 (Japan); Baba, Shingo [Department of Clinical Radiology, Kyushu University Hospital, 3-1-1, Maidashi, Higashi-ku, Fukuoka 812-8582 (Japan)

    2016-06-15

    Purpose: Radium-223 ({sup 223}Ra), an α-emitting radionuclide, is used in unsealed radionuclide therapy for metastatic bone tumors. The demand for qualitative {sup 223}Ra imaging is growing to optimize dosimetry. The authors simulated {sup 223}Ra imaging using an in-house Monte Carlo simulation code and investigated the feasibility and utility of {sup 223}Ra imaging. Methods: The Monte Carlo code comprises two modules, HEXAGON and NAI. The HEXAGON code simulates the photon and electron interactions in the tissues and collimator, and the NAI code simulates the response of the NaI detector system. A 3D numeric phantom created using computed tomography images of a chest phantom was installed in the HEXAGON code. {sup 223}Ra accumulated in a part of the spine, and three x-rays and 19 γ rays between 80 and 450 keV were selected as the emitted photons. To evaluate the quality of the {sup 223}Ra imaging, the authors also simulated technetium-99m ({sup 99m}Tc) imaging under the same conditions and compared the results. Results: The sensitivities of the three photopeaks were 147 counts per unit of source activity (cps MBq{sup −1}; photopeak: 84 keV, full width of energy window: 20%), 166 cps MBq{sup −1} (154 keV, 15%), and 158 cps MBq{sup −1} (270 keV, 10%) for a low-energy general-purpose (LEGP) collimator, and those for the medium-energy general-purpose (MEGP) collimator were 33, 13, and 8.0 cps MBq{sup −1}, respectively. In the case of {sup 99m}Tc, the sensitivity was 55 cps MBq{sup −1} (141 keV, 20%) for LEGP and 52 cps MBq{sup −1} for MEGP. The fractions of unscattered photons of the total photons reflecting the image quality were 0.09 (84 keV), 0.03 (154 keV), and 0.02 (270 keV) for the LEGP collimator and 0.41, 0.25, and 0.50 for the MEGP collimator, respectively. Conversely, this fraction was approximately 0.65 for the simulated {sup 99m}Tc imaging. The sensitivity with the LEGP collimator appeared very high. However, almost all of the counts were

  6. Study on the dominant reaction path in nucleosynthesis during stellar evolution by means of the Monte Carlo method

    International Nuclear Information System (INIS)

    Yamamoto, K.; Hashizume, K.; Wada, T.; Ohta, M.; Suda, T.; Nishimura, T.; Fujimoto, M. Y.; Kato, K.; Aikawa, M.

    2006-01-01

    We propose a Monte Carlo method to study the reaction paths in nucleosynthesis during stellar evolution. Determination of reaction paths is important to obtain the physical picture of stellar evolution. The combination of network calculation and our method gives us a better understanding of physical picture. We apply our method to the case of the helium shell flash model in the extremely metal poor star

  7. Study of the validity of a combined potential model using the Hybrid Reverse Monte Carlo method in Fluoride glass system

    Directory of Open Access Journals (Sweden)

    M. Kotbi

    2013-03-01

    Full Text Available The choice of appropriate interaction models is among the major disadvantages of conventional methods such as Molecular Dynamics (MD and Monte Carlo (MC simulations. On the other hand, the so-called Reverse Monte Carlo (RMC method, based on experimental data, can be applied without any interatomic and/or intermolecular interactions. The RMC results are accompanied by artificial satellite peaks. To remedy this problem, we use an extension of the RMC algorithm, which introduces an energy penalty term into the acceptance criteria. This method is referred to as the Hybrid Reverse Monte Carlo (HRMC method. The idea of this paper is to test the validity of a combined potential model of coulomb and Lennard-Jones in a Fluoride glass system BaMnMF7 (M = Fe,V using HRMC method. The results show a good agreement between experimental and calculated characteristics, as well as a meaningful improvement in partial pair distribution functions (PDFs. We suggest that this model should be used in calculating the structural properties and in describing the average correlations between components of fluoride glass or a similar system. We also suggest that HRMC could be useful as a tool for testing the interaction potential models, as well as for conventional applications.

  8. N-(sulfoethyl) iminodiacetic acid-based lanthanide coordination polymers: Synthesis, magnetism and quantum Monte Carlo studies

    Energy Technology Data Exchange (ETDEWEB)

    Zhuang Guilin, E-mail: glzhuang@zjut.edu.cn [Institute of Industrial Catalysis, College of Chemical Engineering and Materials Science, Zhejiang University of Technology, Hangzhou 310032 (China); Chen Wulin [Institute of Industrial Catalysis, College of Chemical Engineering and Materials Science, Zhejiang University of Technology, Hangzhou 310032 (China); Zheng Jun [Center of Modern Experimental Technology, Anhui University, Hefei 230039 (China); Yu Huiyou [Institute of Industrial Catalysis, College of Chemical Engineering and Materials Science, Zhejiang University of Technology, Hangzhou 310032 (China); Wang Jianguo, E-mail: jgw@zjut.edu.cn [Institute of Industrial Catalysis, College of Chemical Engineering and Materials Science, Zhejiang University of Technology, Hangzhou 310032 (China)

    2012-08-15

    A series of lanthanide coordination polymers have been obtained through the hydrothermal reaction of N-(sulfoethyl) iminodiacetic acid (H{sub 3}SIDA) and Ln(NO{sub 3}){sub 3} (Ln=La, 1; Pr, 2; Nd, 3; Gd, 4). Crystal structure analysis exhibits that lanthanide ions affect the coordination number, bond length and dimension of compounds 1-4, which reveal that their structure diversity can be attributed to the effect of lanthanide contraction. Furthermore, the combination of magnetic measure with quantum Monte Carlo(QMC) studies exhibits that the coupling parameters between two adjacent Gd{sup 3+} ions for anti-anti and syn-anti carboxylate bridges are -1.0 Multiplication-Sign 10{sup -3} and -5.0 Multiplication-Sign 10{sup -3} cm{sup -1}, respectively, which reveals weak antiferromagnetic interaction in 4. - Graphical abstract: Four lanthanide coordination polymers with N-(sulfoethyl) iminodiacetic acid were obtained under hydrothermal condition and reveal the weak antiferromagnetic coupling between two Gd{sup 3+} ions by Quantum Monte Carlo studies. Highlights: Black-Right-Pointing-Pointer Four lanthanide coordination polymers of H{sub 3}SIDA ligand were obtained. Black-Right-Pointing-Pointer Lanthanide ions play an important role in their structural diversity. Black-Right-Pointing-Pointer Magnetic measure exhibits that compound 4 features antiferromagnetic property. Black-Right-Pointing-Pointer Quantum Monte Carlo studies reveal the coupling parameters of two Gd{sup 3+} ions.

  9. Monte Carlo Methods in Physics

    International Nuclear Information System (INIS)

    Santoso, B.

    1997-01-01

    Method of Monte Carlo integration is reviewed briefly and some of its applications in physics are explained. A numerical experiment on random generators used in the monte Carlo techniques is carried out to show the behavior of the randomness of various methods in generating them. To account for the weight function involved in the Monte Carlo, the metropolis method is used. From the results of the experiment, one can see that there is no regular patterns of the numbers generated, showing that the program generators are reasonably good, while the experimental results, shows a statistical distribution obeying statistical distribution law. Further some applications of the Monte Carlo methods in physics are given. The choice of physical problems are such that the models have available solutions either in exact or approximate values, in which comparisons can be mode, with the calculations using the Monte Carlo method. Comparison show that for the models to be considered, good agreement have been obtained

  10. A MONTE-CARLO METHOD FOR ESTIMATING THE CORRELATION EXPONENT

    NARCIS (Netherlands)

    MIKOSCH, T; WANG, QA

    We propose a Monte Carlo method for estimating the correlation exponent of a stationary ergodic sequence. The estimator can be considered as a bootstrap version of the classical Hill estimator. A simulation study shows that the method yields reasonable estimates.

  11. A Study on Efficiency Improvement of the Hybrid Monte Carlo/Deterministic Method for Global Transport Problems

    International Nuclear Information System (INIS)

    Kim, Jong Woo; Woo, Myeong Hyeon; Kim, Jae Hyun; Kim, Do Hyun; Shin, Chang Ho; Kim, Jong Kyung

    2017-01-01

    In this study hybrid Monte Carlo/Deterministic method is explained for radiation transport analysis in global system. FW-CADIS methodology construct the weight window parameter and it useful at most global MC calculation. However, Due to the assumption that a particle is scored at a tally, less particles are transported to the periphery of mesh tallies. For compensation this space-dependency, we modified the module in the ADVANTG code to add the proposed method. We solved the simple test problem for comparing with result from FW-CADIS methodology, it was confirmed that a uniform statistical error was secured as intended. In the future, it will be added more practical problems. It might be useful to perform radiation transport analysis using the Hybrid Monte Carlo/Deterministic method in global transport problems.

  12. Effects of substrate anisotropy and edge diffusion on submonolayer growth during molecular beam epitaxy: A Kinetic Monte Carlo study

    International Nuclear Information System (INIS)

    Devkota, J.; Shrestha, S.P.

    2007-12-01

    We have performed Kinetic Monte Carlo simulation work to study the effect of diffusion anisotropy, bonding anisotropy and edge diffusion on island formation at different temperatures during the sub-monolayer film growth in Molecular Beam Epitaxy. We use simple cubic solid on solid model and event based Bortz, Kalos and Labowitch (BKL) algorithm on the Kinetic Monte Carlo method to simulate the physical phenomena. We have found that the island morphology and growth exponent are found to be influenced by substrate anisotropy as well as edge diffusion, however they do not play a significant role in island elongation. The growth exponent and island size distribution are observed to be influenced by substrate anisotropy but are negligibly influenced by edge diffusion. We have found fractal islands when edge diffusion is excluded and compact islands when edge diffusion is included. (author)

  13. Considerations on the miniaturization of detectors for in vivo dosimetry in radiotherapy: A Monte Carlo study

    Energy Technology Data Exchange (ETDEWEB)

    Cunha, Micaela; Testa, Etienne [Université de Lyon, F-69622, Lyon (France); CNRS/IN2P3, Institut de Physique Nucléaire de Lyon (France); Beuve, Michael, E-mail: m.beuve@ipnl.in2p3.fr [Université de Lyon, F-69622, Lyon (France); CNRS/IN2P3, Institut de Physique Nucléaire de Lyon (France); Balosso, Jacques; Chaikh, Abdulhamid [Department of Radiation Oncology and Medical Physics, Grenoble Alpes University Hospital (CHUGA), Grenoble (France)

    2017-05-15

    The evolution of technology in radiotherapy nowadays allows us to deliver much higher doses to the target volumes, thanks to better absorbed dose distribution accuracy and conformation, while better sparing healthy tissues. In photon radiotherapy, higher precision usually entails employing small and moving beams. This emphasizes the role of in vivo dosimetry, which assesses internal absorbed dose rather than entrance dose. This, along with advances in materials science, results in a tendency towards the miniaturization of dosimeters. However, the stochastic nature of the radiation-matter interaction takes on greater importance at smaller scales, resulting in fluctuations in energy deposition whose effect may not be negligible. Miniaturization needs to take this into account. We estimated such fluctuations by Monte Carlo simulations considering energy deposition in cylindrical volumes of different sizes and for several absorbed dose values. We not only present and discuss the probability distributions of absorbed doses for a large range of target sizes (0.1–10 μm) and clinically relevant doses (0.1–10 Gy), but also derive an estimation of the risk of measuring an absorbed dose with a value outside a given interval of tolerance (3, 5 and 10%) around the expected dose. The distributions presented features consistent with the theory of microdosimetry. Those for dosimeter sizes smaller than 0.3 μm showed a very high dispersion in specific energy, while those for 10 μm dosimeters tended to become Gaussian and narrower with increasing absorbed dose. The probability of measuring an absorbed dose outside the defined interval of tolerance is close to 100% for the smallest size, regardless of the dose and the interval width considered. It decreases with increasing dose, dosimeter size and width of the interval of tolerance. The best results were obtained with 10 μm dosimeters, for which the probability of doses outside the tolerance range is always zero for absorbed

  14. A comparison study for dose calculation in radiation therapy: pencil beam Kernel based vs. Monte Carlo simulation vs. measurements

    Energy Technology Data Exchange (ETDEWEB)

    Cheong, Kwang-Ho; Suh, Tae-Suk; Lee, Hyoung-Koo; Choe, Bo-Young [The Catholic Univ. of Korea, Seoul (Korea, Republic of); Kim, Hoi-Nam; Yoon, Sei-Chul [Kangnam St. Mary' s Hospital, Seoul (Korea, Republic of)

    2002-07-01

    Accurate dose calculation in radiation treatment planning is most important for successful treatment. Since human body is composed of various materials and not an ideal shape, it is not easy to calculate the accurate effective dose in the patients. Many methods have been proposed to solve inhomogeneity and surface contour problems. Monte Carlo simulations are regarded as the most accurate method, but it is not appropriate for routine planning because it takes so much time. Pencil beam kernel based convolution/superposition methods were also proposed to correct those effects. Nowadays, many commercial treatment planning systems have adopted this algorithm as a dose calculation engine. The purpose of this study is to verify the accuracy of the dose calculated from pencil beam kernel based treatment planning system comparing to Monte Carlo simulations and measurements especially in inhomogeneous region. Home-made inhomogeneous phantom, Helax-TMS ver. 6.0 and Monte Carlo code BEAMnrc and DOSXYZnrc were used in this study. In homogeneous media, the accuracy was acceptable but in inhomogeneous media, the errors were more significant. However in general clinical situation, pencil beam kernel based convolution algorithm is thought to be a valuable tool to calculate the dose.

  15. Novel imaging and quality assurance techniques for ion beam therapy a Monte Carlo study

    CERN Document Server

    Rinaldi, I; Jäkel, O; Mairani, A; Parodi, K

    2010-01-01

    Ion beams exhibit a finite and well defined range in matter together with an “inverted” depth-dose profile, the so-called Bragg peak. These favourable physical properties may enable superior tumour-dose conformality for high precision radiation therapy. On the other hand, they introduce the issue of sensitivity to range uncertainties in ion beam therapy. Although these uncertainties are typically taken into account when planning the treatment, correct delivery of the intended ion beam range has to be assured to prevent undesired underdosage of the tumour or overdosage of critical structures outside the target volume. Therefore, it is necessary to define dedicated Quality Assurance procedures to enable in-vivo range verification before or during therapeutic irradiation. For these purposes, Monte Carlo transport codes are very useful tools to support the development of novel imaging modalities for ion beam therapy. In the present work, we present calculations performed with the FLUKA Monte Carlo code and pr...

  16. Monte Carlo studies of diamagnetism and charge density wave order in the cuprate pseudogap regime

    Science.gov (United States)

    Hayward Sierens, Lauren; Achkar, Andrew; Hawthorn, David; Melko, Roger; Sachdev, Subir

    2015-03-01

    The pseudogap regime of the hole-doped cuprate superconductors is often characterized experimentally in terms of a substantial diamagnetic response and, from another point of view, in terms of strong charge density wave (CDW) order. We introduce a dimensionless ratio, R, that incorporates both diamagnetic susceptibility and the correlation length of CDW order, and therefore reconciles these two fundamental characteristics of the pseudogap. We perform Monte Carlo simulations on a classical model that considers angular fluctuations of a six-dimensional order parameter, and compare our Monte Carlo results for R with existing data from torque magnetometry and x-ray scattering experiments on YBa2Cu3O6+x. We achieve qualitative agreement, and also propose future experiments to further investigate the behaviour of this dimensionless ratio.

  17. Ordered Phases in Cu2NiZn: A First-Principles Monte Carlo Study

    DEFF Research Database (Denmark)

    Simak, S.I.; Ruban, Andrei; Abrikosov, I.A.

    1998-01-01

    Monte Carlo simulations based on effective interactions obtained from first-principles calculations reveal the existence of three ordered phases in ternary Cu2NiZn: (i) "modified"-L1(0) (0-600 K), (ii) L1(2) (600-850 K), and (iii) L1(0) (850-1200 K). This is in contrast to the generally accepted...

  18. Path-integral Monte Carlo study of phonons in the bcc phase of Helium-3

    OpenAIRE

    Sorkin, V.; Polturak, E.; Adler, Joan

    2006-01-01

    Using Path Integral Monte Carlo and the Maximum Entropy method, we calculate the dynamic structure factor of solid He-3 in the bcc phase at a finite temperature of T = 1.6 K and a molar volume of 21.5 cm^3. From the single phonon dynamic structure factor, we obtain both the longitudinal and transverse phonon branches along the main crystalline directions, [001], [011] and [111]. Our results are compared with other theoretical predictions and available experimental data.

  19. The study of importance sampling in Monte-carlo calculation of blocking dips

    International Nuclear Information System (INIS)

    Pan Zhengying; Zhou Peng

    1988-01-01

    Angular blocking dips around the axis in Al single crystal of α-particles of about 2 Mev produced at a depth of 0.2 μm are calculated by a Monte-carlo simulation. The influence of the small solid angle emission of particles and the importance sampling in the solid angle emission have been investigated. By means of importance sampling, a more reasonable results with high accuracy are obtained

  20. Magnetic properties of dendrimer structures with different coordination numbers: A Monte Carlo study

    Science.gov (United States)

    Masrour, R.; Jabar, A.

    2016-11-01

    We investigate the magnetic properties of Cayley trees of large molecules with dendrimer structure using Monte Carlo simulations. The thermal magnetization and magnetic susceptibility of a dendrimer structure are given with different coordination numbers, Z=3, 4, 5 and different generations g=3 and 2. The variation of magnetizations with the exchange interactions and crystal fields have been given of this system. The magnetic hysteresis cycles have been established.

  1. Monte Carlo simulation for pixel detectors: a feasibility study for X radiation applications

    International Nuclear Information System (INIS)

    Marinho, F.; Akiba, K.

    2014-01-01

    In this paper we analyze the feasibility of a Monte Carlo simulation for the description of pixel semiconductor detectors as a tool for research and development of such devices and their applications for X-rays. We present as a result the technical aspects and main characteristics of a set of algorithms recently developed which allows one to estimate the energy spectrum and cluster classification. (author)

  2. Electron dose distributions caused by the contact-type metallic eye shield: Studies using Monte Carlo and pencil beam algorithms.

    Science.gov (United States)

    Kang, Sei-Kwon; Yoon, Jai-Woong; Hwang, Taejin; Park, Soah; Cheong, Kwang-Ho; Han, Tae Jin; Kim, Haeyoung; Lee, Me-Yeon; Kim, Kyoung Ju; Bae, Hoonsik

    2015-01-01

    A metallic contact eye shield has sometimes been used for eyelid treatment, but dose distribution has never been reported for a patient case. This study aimed to show the shield-incorporated CT-based dose distribution using the Pinnacle system and Monte Carlo (MC) calculation for 3 patient cases. For the artifact-free CT scan, an acrylic shield machined as the same size as that of the tungsten shield was used. For the MC calculation, BEAMnrc and DOSXYZnrc were used for the 6-MeV electron beam of the Varian 21EX, in which information for the tungsten, stainless steel, and aluminum material for the eye shield was used. The same plan was generated on the Pinnacle system and both were compared. The use of the acrylic shield produced clear CT images, enabling delineation of the regions of interest, and yielded CT-based dose calculation for the metallic shield. Both the MC and the Pinnacle systems showed a similar dose distribution downstream of the eye shield, reflecting the blocking effect of the metallic eye shield. The major difference between the MC and the Pinnacle results was the target eyelid dose upstream of the shield such that the Pinnacle system underestimated the dose by 19 to 28% and 11 to 18% for the maximum and the mean doses, respectively. The pattern of dose difference between the MC and the Pinnacle systems was similar to that in the previous phantom study. In conclusion, the metallic eye shield was successfully incorporated into the CT-based planning, and the accurate dose calculation requires MC simulation. Copyright © 2015 American Association of Medical Dosimetrists. Published by Elsevier Inc. All rights reserved.

  3. Electron dose distributions caused by the contact-type metallic eye shield: Studies using Monte Carlo and pencil beam algorithms

    Energy Technology Data Exchange (ETDEWEB)

    Kang, Sei-Kwon; Yoon, Jai-Woong; Hwang, Taejin; Park, Soah; Cheong, Kwang-Ho; Jin Han, Tae; Kim, Haeyoung; Lee, Me-Yeon; Ju Kim, Kyoung, E-mail: kjkim@hallym.or.kr; Bae, Hoonsik

    2015-10-01

    A metallic contact eye shield has sometimes been used for eyelid treatment, but dose distribution has never been reported for a patient case. This study aimed to show the shield-incorporated CT-based dose distribution using the Pinnacle system and Monte Carlo (MC) calculation for 3 patient cases. For the artifact-free CT scan, an acrylic shield machined as the same size as that of the tungsten shield was used. For the MC calculation, BEAMnrc and DOSXYZnrc were used for the 6-MeV electron beam of the Varian 21EX, in which information for the tungsten, stainless steel, and aluminum material for the eye shield was used. The same plan was generated on the Pinnacle system and both were compared. The use of the acrylic shield produced clear CT images, enabling delineation of the regions of interest, and yielded CT-based dose calculation for the metallic shield. Both the MC and the Pinnacle systems showed a similar dose distribution downstream of the eye shield, reflecting the blocking effect of the metallic eye shield. The major difference between the MC and the Pinnacle results was the target eyelid dose upstream of the shield such that the Pinnacle system underestimated the dose by 19 to 28% and 11 to 18% for the maximum and the mean doses, respectively. The pattern of dose difference between the MC and the Pinnacle systems was similar to that in the previous phantom study. In conclusion, the metallic eye shield was successfully incorporated into the CT-based planning, and the accurate dose calculation requires MC simulation.

  4. Systematic vacuum study of the ITER model cryopump by test particle Monte Carlo simulation

    Energy Technology Data Exchange (ETDEWEB)

    Luo, Xueli; Haas, Horst; Day, Christian [Institute for Technical Physics, Karlsruhe Institute of Technology, P.O. Box 3640, 76021 Karlsruhe (Germany)

    2011-07-01

    The primary pumping systems on the ITER torus are based on eight tailor-made cryogenic pumps because not any standard commercial vacuum pump can meet the ITER working criteria. This kind of cryopump can provide high pumping speed, especially for light gases, by the cryosorption on activated charcoal at 4.5 K. In this paper we will present the systematic Monte Carlo simulation results of the model pump in a reduced scale by ProVac3D, a new Test Particle Monte Carlo simulation program developed by KIT. The simulation model has included the most important mechanical structures such as sixteen cryogenic panels working at 4.5 K, the 80 K radiation shield envelope with baffles, the pump housing, inlet valve and the TIMO (Test facility for the ITER Model Pump) test facility. Three typical gas species, i.e., deuterium, protium and helium are simulated. The pumping characteristics have been obtained. The result is in good agreement with the experiment data up to the gas throughput of 1000 sccm, which marks the limit for free molecular flow. This means that ProVac3D is a useful tool in the design of the prototype cryopump of ITER. Meanwhile, the capture factors at different critical positions are calculated. They can be used as the important input parameters for a follow-up Direct Simulation Monte Carlo (DSMC) simulation for higher gas throughput.

  5. Vectorized Monte Carlo

    International Nuclear Information System (INIS)

    Brown, F.B.

    1981-01-01

    Examination of the global algorithms and local kernels of conventional general-purpose Monte Carlo codes shows that multigroup Monte Carlo methods have sufficient structure to permit efficient vectorization. A structured multigroup Monte Carlo algorithm for vector computers is developed in which many particle events are treated at once on a cell-by-cell basis. Vectorization of kernels for tracking and variance reduction is described, and a new method for discrete sampling is developed to facilitate the vectorization of collision analysis. To demonstrate the potential of the new method, a vectorized Monte Carlo code for multigroup radiation transport analysis was developed. This code incorporates many features of conventional general-purpose production codes, including general geometry, splitting and Russian roulette, survival biasing, variance estimation via batching, a number of cutoffs, and generalized tallies of collision, tracklength, and surface crossing estimators with response functions. Predictions of vectorized performance characteristics for the CYBER-205 were made using emulated coding and a dynamic model of vector instruction timing. Computation rates were examined for a variety of test problems to determine sensitivities to batch size and vector lengths. Significant speedups are predicted for even a few hundred particles per batch, and asymptotic speedups by about 40 over equivalent Amdahl 470V/8 scalar codes arepredicted for a few thousand particles per batch. The principal conclusion is that vectorization of a general-purpose multigroup Monte Carlo code is well worth the significant effort required for stylized coding and major algorithmic changes

  6. Multivariate Error Covariance Estimates by Monte-Carlo Simulation for Assimilation Studies in the Pacific Ocean

    Science.gov (United States)

    Borovikov, Anna; Rienecker, Michele M.; Keppenne, Christian; Johnson, Gregory C.

    2004-01-01

    One of the most difficult aspects of ocean state estimation is the prescription of the model forecast error covariances. The paucity of ocean observations limits our ability to estimate the covariance structures from model-observation differences. In most practical applications, simple covariances are usually prescribed. Rarely are cross-covariances between different model variables used. Here a comparison is made between a univariate Optimal Interpolation (UOI) scheme and a multivariate OI algorithm (MvOI) in the assimilation of ocean temperature. In the UOI case only temperature is updated using a Gaussian covariance function and in the MvOI salinity, zonal and meridional velocities as well as temperature, are updated using an empirically estimated multivariate covariance matrix. Earlier studies have shown that a univariate OI has a detrimental effect on the salinity and velocity fields of the model. Apparently, in a sequential framework it is important to analyze temperature and salinity together. For the MvOI an estimation of the model error statistics is made by Monte-Carlo techniques from an ensemble of model integrations. An important advantage of using an ensemble of ocean states is that it provides a natural way to estimate cross-covariances between the fields of different physical variables constituting the model state vector, at the same time incorporating the model's dynamical and thermodynamical constraints as well as the effects of physical boundaries. Only temperature observations from the Tropical Atmosphere-Ocean array have been assimilated in this study. In order to investigate the efficacy of the multivariate scheme two data assimilation experiments are validated with a large independent set of recently published subsurface observations of salinity, zonal velocity and temperature. For reference, a third control run with no data assimilation is used to check how the data assimilation affects systematic model errors. While the performance of the

  7. Zeolite-templated carbon replica: a Grand Canonical Monte-Carlo simulation study

    International Nuclear Information System (INIS)

    Thomas Roussel; Roland J M Pellenq; Christophe Bichara; Roger Gadiou; Antoine Didion; Cathie Vix Guterl; Fabrice Gaslain; Julien Parmentier; Valentin Valtchev; Joel Patarin

    2005-01-01

    Microporous carbon materials are interesting for several applications such as hydrogen storage, catalysis or electrical double layer capacitors. The development of the negative templating method to obtain carbon replicas from ordered templates, has lead to the synthesis of several new materials which have interesting textural properties, attractive for energy storage. Among the possible templates, zeolites can be used to obtain highly microporous carbon materials. Nevertheless, the phenomena involved in the replica synthesis are not fully understood, and the relationships between the structure of the template, the carbon precursor and the resulting carbon material need to be investigated. Experimental results for carbon zeolite-templated nano-structures can be found in a series of papers; see for instance ref. [1] in which Wang et al describe a route to ultra-small Single Wall Carbon Nano-tubes (SWNTs) using the porosity of zeolite AlPO 4 -5. After matrix removal, the resulting structure is a free-standing bundle of 4 Angstroms large nano-tubes. However, it is highly desirable to obtain an ordered porous carbon structure that forms a real 3D network to be used for instance in gas storage applications. Carbon replica of faujasite and EMT zeolites can have these properties since these zeolites have a 3D porous network made of 10 Angstroms cages connected to each other through 7 Angstroms large windows. The first step of this study was to generate a theoretical carbon replica structure of various zeolites (faujasite, EMT, AlPO 4 -5, silicalite). For this purpose, we used the Grand Canonical Monte-Carlo (GCMC) technique in which the carbon-carbon interactions were described within the frame of a newly developed Tight Binding approach and the carbon-zeolite interactions assumed to be characteristic of physi-sorption. The intrinsic stability of the subsequent carbon nano-structures was then investigated after mimicking the removal of the inorganic phase by switching

  8. Diffusion Monte Carlo study on temporal evolution of entropy and free energy in nonequilibrium processes.

    Science.gov (United States)

    Tanaka, Shigenori

    2016-03-07

    A computational scheme to describe the temporal evolution of thermodynamic functions in stochastic nonequilibrium processes of isothermal classical systems is proposed on the basis of overdamped Langevin equation under given potential and temperature. In this scheme the associated Fokker-Planck-Smoluchowski equation for the probability density function is transformed into the imaginary-time Schrödinger equation with an effective Hamiltonian. The propagator for the time-dependent wave function is expressed in the framework of the path integral formalism, which can thus represent the dynamical behaviors of nonequilibrium molecular systems such as those conformational changes observed in protein folding and ligand docking. The present study then employs the diffusion Monte Carlo method to efficiently simulate the relaxation dynamics of wave function in terms of random walker distribution, which in the long-time limit reduces to the ground-state eigenfunction corresponding to the equilibrium Boltzmann distribution. Utilizing this classical-quantum correspondence, we can describe the relaxation processes of thermodynamic functions as an approach to the equilibrium state with the lowest free energy. Performing illustrative calculations for some prototypical model potentials, the temporal evolutions of enthalpy, entropy, and free energy of the classical systems are explicitly demonstrated. When the walkers initially start from a localized configuration in one- or two-dimensional harmonic or double well potential, the increase of entropy usually dominates the relaxation dynamics toward the equilibrium state. However, when they start from a broadened initial distribution or go into a steep valley of potential, the dynamics are driven by the decrease of enthalpy, thus causing the decrease of entropy associated with the spatial localization. In the cases of one- and two-dimensional asymmetric double well potentials with two minimal points and an energy barrier between them

  9. Diffusion of small Cu islands on the Ni(111) surface: A self-learning kinetic Monte Carlo study

    Science.gov (United States)

    Acharya, Shree Ram; Shah, Syed Islamuddin; Rahman, Talat S.

    2017-08-01

    We elucidate the diffusion kinetics of a heteroepitaxial system consisting of two-dimensional small (1-8 atoms) Cu islands on the Ni(111) surface at (100-600) K using the Self-Learning Kinetic Monte Carlo (SLKMC-II) method. Study of the statics of the system shows that compact CuN (3≤N≤8) clusters made up of triangular units on fcc occupancy sites are the energetically most stable structures of those clusters. Interestingly, we find a correlation between the height of the activation energy barrier (Ea) and the location of the transition state (TS). The Ea of processes for Cu islands on the Ni(111) surface are in general smaller than those of their counterpart Ni islands on the same surface. We find this difference to correlate with the relative strength of the lateral interaction of the island atoms in the two systems. While our database consists of hundreds of possible processes, we identify and discuss the energetics of those that are the most dominant, or are rate-limiting, or most contributory to the diffusion of the islands. Since the Ea of single- and multi-atom processes that convert compact island shapes into non-compact ones are larger (with a significantly smaller Ea for their reverse processes) than that for the collective (concerted) motion of the island, the later dominate in the system kinetics - except for the cases of the dimer, pentamer and octamer. Short-jump involving one atom, long jump dimer-shearing, and long-jump corner shearing (via a single-atom) are, respectively, the dominating processes in the diffusion of the dimer, pentamer and octamer. Furthermore single-atom corner-rounding are the rate-limiting processes for the pentamer and octamer islands. Comparison of the energetics of selected processes and lateral interactions obtained from semi-empirical interatomic potentials with those from density functional theory show minor quantitative differences and overall qualitative agreement.

  10. Carlos Romero

    Directory of Open Access Journals (Sweden)

    2008-05-01

    Full Text Available Entrevista (en español Presentación Carlos Romero, politólogo, es profesor-investigador en el Instituto de Estudios Políticos de la Facultad de Ciencias Jurídicas y Políticas de la Universidad Central de Venezuela, en donde se ha desempeñado como coordinador del Doctorado, subdirector y director del Centro de Estudios de Postgrado. Cuenta con ocho libros publicados sobre temas de análisis político y relaciones internacionales, siendo uno de los últimos Jugando con el globo. La política exter...

  11. Monte Carlo study of the effective Sherman function for electron polarimetry

    International Nuclear Information System (INIS)

    Drągowski, M.; Włodarczyk, M.; Weber, G.; Ciborowski, J.; Enders, J.; Fritzsche, Y.; Poliszczuk, A.

    2016-01-01

    The PEBSI Monte Carlo simulation was upgraded towards usefulness for electron Mott polarimetry. The description of Mott scattering was improved and polarisation transfer in Møller scattering was included in the code. An improved agreement was achieved between the simulation and available experimental data for a 100 keV polarised electron beam scattering off gold foils of various thicknesses. The dependence of the effective Sherman function on scattering angle and target thickness, as well as the method of finding optimal conditions for Mott polarimetry measurements were analysed.

  12. Study of the collecting electrode material of an extrapolation chamber by Monte Carlo simulation

    International Nuclear Information System (INIS)

    Vedovato, Uly Pita; Santos, William S.; Perini, Ana Paula; Belinato, Walmir

    2017-01-01

    In this work, the influence of different materials of the collecting electrode on the response of an extrapolation ionization chamber, was evaluated. This ionization chamber was simulated with the MCNP-4C Monte Carlo code and the spectrum of a standard diagnostic radiology beam (RQR5) was utilized. The different results are due to interactions of photons with different materials of the collecting electrode contributing with different values of energy deposited in the sensitive volume of the ionization chamber, which depends on the atomic number of the evaluated materials. The material that presented the least influence was graphite, the original constituent of the ionization chamber. (author)

  13. A benchmark study of the Signed-particle Monte Carlo algorithm for the Wigner equation

    Directory of Open Access Journals (Sweden)

    Muscato Orazio

    2017-12-01

    Full Text Available The Wigner equation represents a promising model for the simulation of electronic nanodevices, which allows the comprehension and prediction of quantum mechanical phenomena in terms of quasi-distribution functions. During these years, a Monte Carlo technique for the solution of this kinetic equation has been developed, based on the generation and annihilation of signed particles. This technique can be deeply understood in terms of the theory of pure jump processes with a general state space, producing a class of stochastic algorithms. One of these algorithms has been validated successfully by numerical experiments on a benchmark test case.

  14. Counterion release from a discretely charged surface in an electrolyte: Monte Carlo simulation study

    International Nuclear Information System (INIS)

    Hernández-Contreras, M

    2015-01-01

    Monte Carlo simulations allowed us to determine the amount of released electric charges from a discretely charged surface in 1:1 aqueous electrolyte solution as a function of surface charge density. Within the restricted primitive model and for a fixed concentration of 0.1 M bulk electrolyte in solution, there is an increase in the number of released counterions per unit surface area as the strength of the surface charge is enhanced. A similar behaviour of the number of released counterions was also found through the use of mean field and liquid theory methods

  15. Monte Carlo study of four-spinon dynamic structure function in antiferromagnetic Heisenberg model

    International Nuclear Information System (INIS)

    Si-Lakhal, B.; Abada, A.

    2003-11-01

    Using Monte Carlo integration methods, we describe the behavior of the exact four-s pinon dynamic structure function S 4 in the antiferromagnetic spin 1/2 Heisenberg quantum spin chain as a function of the neutron energy ω and momentum transfer k. We also determine the fourspinon continuum, the extent of the region in the (k, ω) plane outside which S 4 is identically zero. In each case, the behavior of S 4 is shown to be consistent with the four-spinon continuum and compared to the one of the exact two-spinon dynamic structure function S 2 . Overall shape similarity is noted. (author)

  16. A Monte-Carlo study of landmines detection by neutron backscattering method

    International Nuclear Information System (INIS)

    Maucec, M.; De Meijer, R.J.

    2000-01-01

    The use of Monte-Carlo simulations for modelling a simplified landmine detector system with a 252 Cf- neutron source is presented in this contribution. Different aspects and variety of external conditions, affecting the localisation and identification of a buried suspicious object (such as landmine) have been tested. Results of sensitivity calculations confirm that the landmine detection methods, based on the analysis of the backscattered neutron radiation can be applicable in higher density formations, with the mass fraction of present pore-water <15 %. (author)

  17. A study of potential energy curves from the model space quantum Monte Carlo method

    Energy Technology Data Exchange (ETDEWEB)

    Ohtsuka, Yuhki; Ten-no, Seiichiro, E-mail: tenno@cs.kobe-u.ac.jp [Department of Computational Sciences, Graduate School of System Informatics, Kobe University, Nada-ku, Kobe 657-8501 (Japan)

    2015-12-07

    We report on the first application of the model space quantum Monte Carlo (MSQMC) to potential energy curves (PECs) for the excited states of C{sub 2}, N{sub 2}, and O{sub 2} to validate the applicability of the method. A parallel MSQMC code is implemented with the initiator approximation to enable efficient sampling. The PECs of MSQMC for various excited and ionized states are compared with those from the Rydberg-Klein-Rees and full configuration interaction methods. The results indicate the usefulness of MSQMC for precise PECs in a wide range obviating problems concerning quasi-degeneracy.

  18. Dimension of ring polymers in bulk studied by Monte-Carlo simulation and self-consistent theory.

    Science.gov (United States)

    Suzuki, Jiro; Takano, Atsushi; Deguchi, Tetsuo; Matsushita, Yushu

    2009-10-14

    We studied equilibrium conformations of ring polymers in melt over the wide range of segment number N of up to 4096 with Monte-Carlo simulation and obtained N dependence of radius of gyration of chains R(g). The simulation model used is bond fluctuation model (BFM), where polymer segments bear excluded volume; however, the excluded volume effect vanishes at N-->infinity, and linear polymer can be regarded as an ideal chain. Simulation for ring polymers in melt was performed, and the nu value in the relationship R(g) proportional to N(nu) is decreased gradually with increasing N, and finally it reaches the limiting value, 1/3, in the range of N>or=1536, i.e., R(g) proportional to N(1/3). We confirmed that the simulation result is consistent with that of the self-consistent theory including the topological effect and the osmotic pressure of ring polymers. Moreover, the averaged chain conformation of ring polymers in equilibrium state was given in the BFM. In small N region, the segment density of each molecule near the center of mass of the molecule is decreased with increasing N. In large N region the decrease is suppressed, and the density is found to be kept constant without showing N dependence. This means that ring polymer molecules do not segregate from the other molecules even if ring polymers in melt have the relationship nu=1/3. Considerably smaller dimensions of ring polymers at high molecular weight are due to their inherent nature of having no chain ends, and hence they have less-entangled conformations.

  19. A Monte Carlo Study on the Effect of Various Neutron Capturers on Dose Distribution in Brachytherapy with 252Cf Source

    Directory of Open Access Journals (Sweden)

    Firoozabadi M. M.

    2017-03-01

    Full Text Available Background: In neutron interaction with matter and reduction of neutron energy due to multiple scatterings to the thermal energy range, increasing the probability of thermal neutron capture by neutron captures makes dose enhancement in the tumors loaded with these materials. Objective: The purpose of this study is to evaluate dose distribution in the presence of 10B, 157Gd and 33S neutron capturers and to determine the effect of these materials on dose enhancement rate for 252Cf brachytherapy source. Methods: Neutron-ray flux and energy spectra, neutron and gamma dose rates and dose enhancement factor (DEF are determined in the absence and presence of 10B, 157Gd and 33S using Monte Carlo simulation. Results: The difference in the thermal neutron flux rate in the presence of 10B and 157Gd is significant, while the flux changes in the fast and epithermal energy ranges are insensible. The dose enhancement factor has increased with increasing distance from the source and reached its maximum amount equal to 258.3 and 476.1 cGy/h/µg for 157Gd and 10B, respectively at about 8 cm distance from the source center. DEF for 33S is equal to one. Conclusion: Results show that the magnitude of dose augmentation in tumors containing 10B and 157Gd in brachytherapy with 252Cf source will depend not only on the capture product dose level, but also on the tumor distance from the source. 33S makes dose enhancement under specific conditions that these conditions depend on the neutron energy spectra of source, the 33S concentration in tumor and tumor distance from the source.

  20. Patient dose in image guided radiotherapy: Monte Carlo study of the CBCT dose contribution

    Directory of Open Access Journals (Sweden)

    Salvatore Leotta

    2018-02-01

    Full Text Available Image Guided RadioTherapy (IGRT is a technique whose diffusion is growing thanks to the well-recognized gain in accuracy of dose delivery. However, multiple Cone Beam Computed Tomography (CBCT scans add dose to patients, and its contribution has to be assessed and minimized. Aim of our work was to evaluate, through Monte Carlo simulations, organ doses in IGRT due to CBCT and therapeutic MV irradiation in head-neck, thorax and pelvis districts. We developed a Monte Carlo simulation in GAMOS (Geant4-based Architecture for Medicine-Oriented Simulations, reproducing an Elekta Synergy medical linac operating at 6 and 10 MV photon energy, and we set up a scalable anthropomorphic model. After a validation by comparison with the experimental quality indexes, we evaluated the average doses to all organs and tissues belonging to the model for the three cases of irradiated district. Scattered radiation in therapy is larger than that diffused by CBCT by one to two orders of magnitude.

  1. Primary study of Monte Carlo simulation on CdZnTe nuclear detector

    International Nuclear Information System (INIS)

    Ren Shaojun; Sang Wenbin; Jin Wei; Li Wanwan; Zhang Qi; Min Jiahua

    2004-01-01

    The Monte Carlo simulation software is developed based on the operating principle of CdZnTe detector, the randomicity of γ ray reaction in the detector and the statistic rule of the amount of electron-hole pairs produced. First, the reaction depth of photons is calculated based on the disintegration rule. Secondly, the reaction section of every reaction is estimated and the reaction probability of the three atoms in CZT and the probability of every reaction of every atom are calculated. Based on these probabilities, the category of atoms and the type of reactions of a photon reacting with the detector are determined and the amount of electron-hole pairs produced by the photon is obtained. From the reaction depth and the amount of electron-hole pairs produced, the amount of charge collected can be calculated. The response energy spectra of γ ray in the CdZnTe detector are simulated by using the Monte Carlo software developed. The simulation results are well comparable with the data of the real CdZnTe devices. In addition, the ideal thickness of the device, which is of maximum detecting efficiency, is also obtained based on the analysis over the relationship between the thickness and the efficiency, assuming the device to be under the radiation of 57 Co source

  2. Monte-Carlo-based uncertainty propagation with hierarchical models—a case study in dynamic torque

    Science.gov (United States)

    Klaus, Leonard; Eichstädt, Sascha

    2018-04-01

    For a dynamic calibration, a torque transducer is described by a mechanical model, and the corresponding model parameters are to be identified from measurement data. A measuring device for the primary calibration of dynamic torque, and a corresponding model-based calibration approach, have recently been developed at PTB. The complete mechanical model of the calibration set-up is very complex, and involves several calibration steps—making a straightforward implementation of a Monte Carlo uncertainty evaluation tedious. With this in mind, we here propose to separate the complete model into sub-models, with each sub-model being treated with individual experiments and analysis. The uncertainty evaluation for the overall model then has to combine the information from the sub-models in line with Supplement 2 of the Guide to the Expression of Uncertainty in Measurement. In this contribution, we demonstrate how to carry this out using the Monte Carlo method. The uncertainty evaluation involves various input quantities of different origin and the solution of a numerical optimisation problem.

  3. The biological shield of a high-intensity spallation source: a monte Carlo design study

    International Nuclear Information System (INIS)

    Koprivnikar, I.; Schachinger, E.

    2004-01-01

    The design of high-intensity spallation sources requires the best possible estimates for the biological shield. The applicability of three-dimensional Monte Carlo simulation in the design of the biological shield of a spallation source will be discussed. In order to achieve reasonable computing times along with acceptable accuracy, biasing techniques are to be employed and it was the main purpose of this work to develop a strategy for an effective Monte Carlo simulation in shielding design. The most prominent MC computer codes, namely MCNPX and FLUKA99, have been applied to the same model spallation source (the European Spallation Source) and on the basis of the derived strategies, the design and characteristics of the target station shield are discussed. It is also the purpose of the paper to demonstrate the application of the developed strategy for the design of beam lines with their shielding using as an example the target-moderator-reflector complex of the ESS as the primary particle source. (author)

  4. Study of the IMRT interplay effect using a 4DCT Monte Carlo dose calculation.

    Science.gov (United States)

    Jensen, Michael D; Abdellatif, Ady; Chen, Jeff; Wong, Eugene

    2012-04-21

    Respiratory motion may lead to dose errors when treating thoracic and abdominal tumours with radiotherapy. The interplay between complex multileaf collimator patterns and patient respiratory motion could result in unintuitive dose changes. We have developed a treatment reconstruction simulation computer code that accounts for interplay effects by combining multileaf collimator controller log files, respiratory trace log files, 4DCT images and a Monte Carlo dose calculator. Two three-dimensional (3D) IMRT step-and-shoot plans, a concave target and integrated boost were delivered to a 1D rigid motion phantom. Three sets of experiments were performed with 100%, 50% and 25% duty cycle gating. The log files were collected, and five simulation types were performed on each data set: continuous isocentre shift, discrete isocentre shift, 4DCT, 4DCT delivery average and 4DCT plan average. Analysis was performed using 3D gamma analysis with passing criteria of 2%, 2 mm. The simulation framework was able to demonstrate that a single fraction of the integrated boost plan was more sensitive to interplay effects than the concave target. Gating was shown to reduce the interplay effects. We have developed a 4DCT Monte Carlo simulation method that accounts for IMRT interplay effects with respiratory motion by utilizing delivery log files.

  5. Geometrically Constructed Markov Chain Monte Carlo Study of Quantum Spin-phonon Complex Systems

    Science.gov (United States)

    Suwa, Hidemaro

    2013-03-01

    We have developed novel Monte Carlo methods for precisely calculating quantum spin-boson models and investigated the critical phenomena of the spin-Peierls systems. Three significant methods are presented. The first is a new optimization algorithm of the Markov chain transition kernel based on the geometric weight allocation. This algorithm, for the first time, satisfies the total balance generally without imposing the detailed balance and always minimizes the average rejection rate, being better than the Metropolis algorithm. The second is the extension of the worm (directed-loop) algorithm to non-conserved particles, which cannot be treated efficiently by the conventional methods. The third is the combination with the level spectroscopy. Proposing a new gap estimator, we are successful in eliminating the systematic error of the conventional moment method. Then we have elucidated the phase diagram and the universality class of the one-dimensional XXZ spin-Peierls system. The criticality is totally consistent with the J1 -J2 model, an effective model in the antiadiabatic limit. Through this research, we have succeeded in investigating the critical phenomena of the effectively frustrated quantum spin system by the quantum Monte Carlo method without the negative sign. JSPS Postdoctoral Fellow for Research Abroad

  6. Development of a shield based on Monte-Carlo studies for the COBRA experiment

    Energy Technology Data Exchange (ETDEWEB)

    Heidrich, Nadine [Institut fuer Experimentalphysik, 22761 Hamburg (Germany); Collaboration: COBRA-Collaboration

    2013-07-01

    COBRA is a next-generation experiment searching for neutrinoless double beta decay using CdZnTe semiconductor detectors. The main focus is on {sup 116}Cd, with a decay energy of 2813.5 keV well above the highest naturally occurring gamma lines. The concept for a large scale set-up consists of an array of CdZnTe detectors with a total mass of 420 kg enriched in {sup 116}Cd up to 90 %. With a background rate in the order of 10{sup -3} counts/keV/kg/year, the experiment would be sensitive to a half-life larger than 10{sup 26} years, corresponding to a Majorana mass term m{sub ββ} smaller than 50 meV. To achieve the background level, an appropriate shield is necessary. The shield is developed based on Monte-Carlo simulations. For that, different materials and configurations are tested. In the talk the current status of the Monte-Carlo survey is presented and discussed.

  7. Monte carlo study of MOSFET packaging, optimised for improved energy response: single MOSFET filtration.

    Science.gov (United States)

    Othman, M A R; Cutajar, D L; Hardcastle, N; Guatelli, S; Rosenfeld, A B

    2010-09-01

    Monte Carlo simulations of the energy response of a conventionally packaged single metal-oxide field effect transistors (MOSFET) detector were performed with the goal of improving MOSFET energy dependence for personal accident or military dosimetry. The MOSFET detector packaging was optimised. Two different 'drop-in' design packages for a single MOSFET detector were modelled and optimised using the GEANT4 Monte Carlo toolkit. Absorbed photon dose simulations of the MOSFET dosemeter placed in free-air response, corresponding to the absorbed doses at depths of 0.07 mm (D(w)(0.07)) and 10 mm (D(w)(10)) in a water equivalent phantom of size 30 x 30 x 30 cm(3) for photon energies of 0.015-2 MeV were performed. Energy dependence was reduced to within + or - 60 % for photon energies 0.06-2 MeV for both D(w)(0.07) and D(w)(10). Variations in the response for photon energies of 15-60 keV were 200 and 330 % for D(w)(0.07) and D(w)(10), respectively. The obtained energy dependence was reduced compared with that for conventionally packaged MOSFET detectors, which usually exhibit a 500-700 % over-response when used in free-air geometry.

  8. Analisis Risiko Finansial Dengan Metode Simulasi Monte Carlo (Studi Kasus: Pt. Phase Delta Control

    Directory of Open Access Journals (Sweden)

    Atikah Aghdhi Pratiwi

    2016-10-01

    Full Text Available Basically, the purpose of a company is make a profit and enrich the owners of the company. This is manifested by development and achievement of good performance, both in financial and operational perspective. But in reality, not all of companies can achieve good performance. One of them is because exposure of risk. This could threaten achievement of the objectives and existence of the company. Therefore, companies need to have an idea related to possible condition and financial projection in future periods that are affected by risk. One of the possible method is Monte Carlo Simulation. Research will be conducted at PT. Phase Delta Control with historical data related to production/sales volume, cost of production and selling price. Historical data will be used as Monte Carlo Simulation with random numbers that describe probability of each risk variables describing reality. The main result is estimated profitability of PT. Phase Delta Control in given period. Profit estimation will be uncertain variable due to some uncertainty

  9. Zeolite-templated carbon replica: a grand canonical Monte-Carlo simulation study

    International Nuclear Information System (INIS)

    Roussel, Th.; Pellenq, R.J.M.; Bichara, Ch.; Gadiou, R.; Didion, A.; Vix-Guterl, C.; Gaslain, F.; Parmentier, J.; Valtchev, V.; Patarin, J.

    2005-01-01

    Microporous carbon materials are interesting for several applications such as hydrogen storage, catalysis or electrical double layer capacitors. The development of the negative templating method to obtain carbon replicas from ordered templates, has lead to the synthesis of several new materials which have interesting textural properties, attractive for energy storage. Among the possible templates, zeolites can be used to obtain highly microporous carbon materials. Nevertheless, the phenomena involved in the replica synthesis are not fully understood, and the relationships between the structure of the template, the carbon precursor and the resulting carbon material need to be investigated. Experimental results for carbon zeolite-templated nano-structures can be found in a series of papers; see for instance ref. [1] in which Wang et al describe a route to ultra-small Single Wall Carbon Nano-tubes (SWNTs) using the porosity of zeolite AlPO 4 -5. After matrix removal, the resulting structure is a free-standing bundle of 4 Angstroms large nano-tubes. However, it is highly desirable to obtain an ordered porous carbon structure that forms a real 3D network to be used for instance in gas storage applications. Carbon replica of faujasite and EMT zeolites can have these properties since these zeolites have a 3D porous network made of 10 Angstroms cages connected to each other through 7 Angstroms large windows. The first step of this study was to generate a theoretical carbon replica structure of various zeolites (faujasite, EMT, AlPO 4 -5, silicalite). For this purpose, we used the Grand Canonical Monte-Carlo (GCMC) technique in which the carbon-carbon interactions were described within the frame of a newly developed Tight Binding approach and the carbon-zeolite interactions assumed to be characteristic of physisorption. The intrinsic stability of the subsequent carbon nano-structures was then investigated after mimicking the removal of the inorganic phase by switching

  10. Studies on top-quark Monte Carlo modelling with Sherpa and MG5_aMC@NLO

    CERN Document Server

    The ATLAS collaboration

    2017-01-01

    This note presents the status of recent studies of modern Monte Carlo generator setups for the pair production of top quarks at the LHC. Samples at a center of mass energy of 13 TeV have been generated using MG5_aMC@NLO+Pythia8 at at next-to-leading order and Sherpa 2.2 at next-to-leading order precision in QCD. Results are compared to unfolded ATLAS data. The effects of varying relevant parameters are also presented for Sherpa 2.2.

  11. Monte Carlo studies of the Portuguese gamma irradiation facility. The irradiator geometry and its influence on process parameters

    International Nuclear Information System (INIS)

    Oliveira, C.; Ferreira, L.; Salgado, J.

    2001-01-01

    The paper describes a Monte Carlo study of dose distributions, minimum dose and uniformity ratio for the Portuguese Gamma Irradiation Facility. These process parameters are calculated using the MCNP code for several irradiator geometries. The comparison of the simulated results with the experimental results carried out using Amber Perspex dosimeters in a routine process of the gamma facility for a given material composition and density reveals good agreement. The results already obtained allow to conclude that the dose uniformity is not very sensitive to the irradiator geometry for density value ρ = 0.1 and for a dynamic process. (orig.)

  12. Study of the heterogeneities effect in the dose distributions of Leksell Gamma Knife (R), through Monte Carlo simulation; Estudio del efecto de las heterogeneidades en las distribuciones de dosis del Leksell GammaKnife (R), mediante simulacion Monte Carlo

    Energy Technology Data Exchange (ETDEWEB)

    Rojas C, E.L. [ININ, 52045 Ocoyoacac, Estado de Mexico (Mexico); Al-Dweri, F.M.O.; Lallena R, A.M. [Universidad de Granada, Granada (Spain)]. e-mail: elrc@nuclear.inin.mx

    2005-07-01

    In this work they are studied, by means of Monte Carlo simulation, the effects that take place in the dose profiles that are obtained with the Leksell Gamma Knife (R), when they are kept in account heterogeneities. The considered heterogeneities simulate the skull and the spaces of air that are in the head, like they can be the nasal breasts or the auditory conduits. The calculations were made using the Monte Carlo Penelope simulation code (v. 2003). The geometry of each one of the 201 sources that this instrument is composed, as well as of the corresponding channels of collimation of the Gamma Knife (R), it was described by means of a simplified model of geometry that has been recently studied. The obtained results when they are kept in mind the heterogeneities they present non worthless differences regarding those obtained when those are not considered. These differences are maximum in the proximities of the interfaces among different materials. (Author)

  13. Quantum Monte Carlo Studies of Bulk and Few- or Single-Layer Black Phosphorus

    Science.gov (United States)

    Shulenburger, Luke; Baczewski, Andrew; Zhu, Zhen; Guan, Jie; Tomanek, David

    2015-03-01

    The electronic and optical properties of phosphorus depend strongly on the structural properties of the material. Given the limited experimental information on the structure of phosphorene, it is natural to turn to electronic structure calculations to provide this information. Unfortunately, given phosphorus' propensity to form layered structures bound by van der Waals interactions, standard density functional theory methods provide results of uncertain accuracy. Recently, it has been demonstrated that Quantum Monte Carlo (QMC) methods achieve high accuracy when applied to solids in which van der Waals forces play a significant role. In this talk, we will present QMC results from our recent calculations on black phosphorus, focusing on the structural and energetic properties of monolayers, bilayers and bulk structures. Sandia National Laboratories is a multi-program laboratory managed and operated by Sandia Corporation, a wholly owned subsidiary of Lockheed Martin Corporation, for the U.S. DOE's National Nuclear Security Administration under Contract DE-AC04-94AL85000.

  14. Monte-Carlo studies of the performance of scintillator detectors for time-of-flight measurements

    International Nuclear Information System (INIS)

    Yang, X.H.

    1995-01-01

    In this paper we report on a Monte-Carlo program, SToF, developed to evaluate the performance of scintillator-based Time-of-Flight (TOF) detectors. This program has been used in the design of the TOF system for the PHENIX experiment at RHIC. The program was used to evaluate the intrinsic time-of-flight resolution of various scintillator and light-guide geometries, and the results of these simulations are presented here. The simulation results agree extremely well with measured pulse-height and time distributions with one adjustable parameter. These results, thus, explain also the reduced quantities, such as the position dependence of the time resolution, etc, implying that SToF will be generally useful for estimating the performance of TOF detectors. ((orig.))

  15. Monte Carlo simulation study of a selforganisation process leading to ordered precipitate structures

    International Nuclear Information System (INIS)

    Zirkelbach, F.; Haeberlen, M.; Lindner, J.K.N.; Stritzker, B.

    2007-01-01

    Periodically arranged, selforganised, nanometric, amorphous precipitates have been observed after high-fluence ion implantations into solids for a number of ion/target combinations at certain implantation conditions. A model describing the ordering process based on compressive stress exerted by the amorphous inclusions as a result of the density change upon amorphisation is introduced. A Monte Carlo simulation code, which focuses on high-fluence carbon implantations into silicon, is able to reproduce experimentally observed nanolamella distributions as well as the formation of continuous amorphous layers. By means of simulation, the selforganisation process becomes traceable and detailed information about the compositional and structural state during the ordering process is obtained. Based on simulation results, a recipe is proposed for producing broad distributions of ordered lamellar structures

  16. Quantum dynamics at finite temperature: Time-dependent quantum Monte Carlo study

    Energy Technology Data Exchange (ETDEWEB)

    Christov, Ivan P., E-mail: ivan.christov@phys.uni-sofia.bg

    2016-08-15

    In this work we investigate the ground state and the dissipative quantum dynamics of interacting charged particles in an external potential at finite temperature. The recently devised time-dependent quantum Monte Carlo (TDQMC) method allows a self-consistent treatment of the system of particles together with bath oscillators first for imaginary-time propagation of Schrödinger type of equations where both the system and the bath converge to their finite temperature ground state, and next for real time calculation where the dissipative dynamics is demonstrated. In that context the application of TDQMC appears as promising alternative to the path-integral related techniques where the real time propagation can be a challenge.

  17. Monte Carlo simulation for background study of geophysical inspection with cosmic-ray muons

    Science.gov (United States)

    Nishiyama, Ryuichi; Taketa, Akimichi; Miyamoto, Seigo; Kasahara, Katsuaki

    2016-08-01

    Several attempts have been made to obtain a radiographic image inside volcanoes using cosmic-ray muons (muography). Muography is expected to resolve highly heterogeneous density profiles near the surface of volcanoes. However, several prior works have failed to make clear observations due to contamination by background noise. The background contamination leads to an overestimation of the muon flux and consequently a significant underestimation of the density in the target mountains. To investigate the origin of the background noise, we performed a Monte Carlo simulation. The main components of the background noise in muography are found to be low-energy protons, electrons and muons in case of detectors without particle identification and with energy thresholds below 1 GeV. This result was confirmed by comparisons with actual observations of nuclear emulsions. This result will be useful for detector design in future works, and in addition some previous works of muography should be reviewed from the view point of background contamination.

  18. Monte-Carlo study of electron noise in compensated InSb

    International Nuclear Information System (INIS)

    Ašmontas, S; Raguotis, R; Bumelienė, S

    2015-01-01

    The results of Monte Carlo simulations of the electron noise in lightly doped and strongly compensated n-type InSb are presented. The strong electron scattering by ionized impurities is established to change essentially the electron distribution function, spectral density of velocity fluctuations and the dependence of noise temperature on the electric field strength. It is found that the electron noise temperature in strongly compensated InSb with low electron density at liquid nitrogen temperature is close to the lattice temperature in a wide range of electric field strength in which the electron gas cooling effect takes place. The increase of electron density is shown to weaken the electron gas cooling effect due to more intensive electron–electron collisions stimulating delocalization of electrons from the bottom of the conduction band. A satisfactory agreement between calculations and available experimental data is obtained. (paper)

  19. Monte Carlo study of the honeycomb structure of anthraquinone molecules on Cu(111)

    Science.gov (United States)

    Kim, Kwangmoo; Einstein, T. L.

    2011-06-01

    Using Monte Carlo calculations of the two-dimensional (2D) triangular lattice gas model, we demonstrate a mechanism for the spontaneous formation of honeycomb structure of anthraquinone (AQ) molecules on a Cu(111) plane. In our model long-range attractions play an important role, in addition to the long-range repulsions and short-range attractions proposed by Pawin, Wong, Kwon, and Bartels [ScienceSCIEAS0036-807510.1126/science.1129309 313, 961 (2006)]. We provide a global account of the possible combinations of long-range attractive coupling constants which lead to a honeycomb superstructure. We also provide the critical temperature of disruption of the honeycomb structure and compare the critical local coverage rate of AQ’s where the honeycomb structure starts to form with the experimental observations.

  20. Dynamic Value at Risk: A Comparative Study Between Heteroscedastic Models and Monte Carlo Simulation

    Directory of Open Access Journals (Sweden)

    José Lamartine Távora Junior

    2006-12-01

    Full Text Available The objective of this paper was to analyze the risk management of a portfolio composed by Petrobras PN, Telemar PN and Vale do Rio Doce PNA stocks. It was verified if the modeling of Value-at-Risk (VaR through the place Monte Carlo simulation with volatility of GARCH family is supported by hypothesis of efficient market. The results have shown that the statistic evaluation in inferior to dynamics, evidencing that the dynamic analysis supplies support to the hypothesis of efficient market of the Brazilian share holding market, in opposition of some empirical evidences. Also, it was verified that the GARCH models of volatility is enough to accommodate the variations of the shareholding Brazilian market, since the model is capable to accommodate the great dynamic of the Brazilian market.

  1. Thermal studies of a superconducting current limiter using Monte-Carlo method

    International Nuclear Information System (INIS)

    Leveque, J.; Rezzoug, A.

    1999-01-01

    Considering the increase of the fault current level in electrical network, the current limiters become very interesting. The superconducting limiters are based on the quasi-instantaneous intrinsic transition from superconducting state to normal resistive one. Without detection of default or given order, they reduce the constraints supported by electrical installations above the fault. To avoid the destruction of the superconducting coil, the temperature must not exceed a certain value. Therefore the design of a superconducting coil needs the simultaneous resolution of an electrical equation and a thermal one. This papers deals with a resolution of this coupled problem by the method of Monte-Carlo. This method allows us to calculate the evolution of the resistance of the coil as well as the current of limitation. Experimental results are compared with theoretical ones. (orig.)

  2. Monte Carlo techniques for the study of cancer patients fractionation in head and neck treated with radiotherapy; Tecnicas de Monte Carlo para el estudio del fraccionamiento en pacientes de cancer de cabeza y cuello tratados con radioterapia

    Energy Technology Data Exchange (ETDEWEB)

    Carrasco Herrera, M. A.; Jimenez Dominguez, M.; Perucha Ortega, M.; Herrador Cordoba, M.

    2011-07-01

    The dose fractionation than the standard head and neck cancer in some situations involve a significant increase of local control and overall survival. There is clinical evidence of these results in case of hyperfractionated treatments, although the choice of optimal fractionation generally is not obtained from the results of any model, in this study has provided the tumor control probability (TCP) for various subdivisions modified (hypo fractionated and hyperfractionated) using Monte Carlo simulation techniques.

  3. Experimental and Monte Carlo studies of fluence corrections for graphite calorimetry in low- and high-energy clinical proton beams

    International Nuclear Information System (INIS)

    Lourenço, Ana; Thomas, Russell; Bouchard, Hugo; Kacperek, Andrzej; Vondracek, Vladimir; Royle, Gary; Palmans, Hugo

    2016-01-01

    Purpose: The aim of this study was to determine fluence corrections necessary to convert absorbed dose to graphite, measured by graphite calorimetry, to absorbed dose to water. Fluence corrections were obtained from experiments and Monte Carlo simulations in low- and high-energy proton beams. Methods: Fluence corrections were calculated to account for the difference in fluence between water and graphite at equivalent depths. Measurements were performed with narrow proton beams. Plane-parallel-plate ionization chambers with a large collecting area compared to the beam diameter were used to intercept the whole beam. High- and low-energy proton beams were provided by a scanning and double scattering delivery system, respectively. A mathematical formalism was established to relate fluence corrections derived from Monte Carlo simulations, using the FLUKA code [A. Ferrari et al., “FLUKA: A multi-particle transport code,” in CERN 2005-10, INFN/TC 05/11, SLAC-R-773 (2005) and T. T. Böhlen et al., “The FLUKA Code: Developments and challenges for high energy and medical applications,” Nucl. Data Sheets 120, 211–214 (2014)], to partial fluence corrections measured experimentally. Results: A good agreement was found between the partial fluence corrections derived by Monte Carlo simulations and those determined experimentally. For a high-energy beam of 180 MeV, the fluence corrections from Monte Carlo simulations were found to increase from 0.99 to 1.04 with depth. In the case of a low-energy beam of 60 MeV, the magnitude of fluence corrections was approximately 0.99 at all depths when calculated in the sensitive area of the chamber used in the experiments. Fluence correction calculations were also performed for a larger area and found to increase from 0.99 at the surface to 1.01 at greater depths. Conclusions: Fluence corrections obtained experimentally are partial fluence corrections because they account for differences in the primary and part of the secondary

  4. Experimental and Monte Carlo studies of fluence corrections for graphite calorimetry in low- and high-energy clinical proton beams

    Energy Technology Data Exchange (ETDEWEB)

    Lourenço, Ana, E-mail: am.lourenco@ucl.ac.uk [Department of Medical Physics and Biomedical Engineering, University College London, London WC1E 6BT, United Kingdom and Division of Acoustics and Ionising Radiation, National Physical Laboratory, Teddington TW11 0LW (United Kingdom); Thomas, Russell; Bouchard, Hugo [Division of Acoustics and Ionising Radiation, National Physical Laboratory, Teddington TW11 0LW (United Kingdom); Kacperek, Andrzej [National Eye Proton Therapy Centre, Clatterbridge Cancer Centre, Wirral CH63 4JY (United Kingdom); Vondracek, Vladimir [Proton Therapy Center, Budinova 1a, Prague 8 CZ-180 00 (Czech Republic); Royle, Gary [Department of Medical Physics and Biomedical Engineering, University College London, London WC1E 6BT (United Kingdom); Palmans, Hugo [Division of Acoustics and Ionising Radiation, National Physical Laboratory, Teddington TW11 0LW, United Kingdom and Medical Physics Group, EBG MedAustron GmbH, A-2700 Wiener Neustadt (Austria)

    2016-07-15

    Purpose: The aim of this study was to determine fluence corrections necessary to convert absorbed dose to graphite, measured by graphite calorimetry, to absorbed dose to water. Fluence corrections were obtained from experiments and Monte Carlo simulations in low- and high-energy proton beams. Methods: Fluence corrections were calculated to account for the difference in fluence between water and graphite at equivalent depths. Measurements were performed with narrow proton beams. Plane-parallel-plate ionization chambers with a large collecting area compared to the beam diameter were used to intercept the whole beam. High- and low-energy proton beams were provided by a scanning and double scattering delivery system, respectively. A mathematical formalism was established to relate fluence corrections derived from Monte Carlo simulations, using the FLUKA code [A. Ferrari et al., “FLUKA: A multi-particle transport code,” in CERN 2005-10, INFN/TC 05/11, SLAC-R-773 (2005) and T. T. Böhlen et al., “The FLUKA Code: Developments and challenges for high energy and medical applications,” Nucl. Data Sheets 120, 211–214 (2014)], to partial fluence corrections measured experimentally. Results: A good agreement was found between the partial fluence corrections derived by Monte Carlo simulations and those determined experimentally. For a high-energy beam of 180 MeV, the fluence corrections from Monte Carlo simulations were found to increase from 0.99 to 1.04 with depth. In the case of a low-energy beam of 60 MeV, the magnitude of fluence corrections was approximately 0.99 at all depths when calculated in the sensitive area of the chamber used in the experiments. Fluence correction calculations were also performed for a larger area and found to increase from 0.99 at the surface to 1.01 at greater depths. Conclusions: Fluence corrections obtained experimentally are partial fluence corrections because they account for differences in the primary and part of the secondary

  5. Performance Study of Monte Carlo Codes on Xeon Phi Coprocessors — Testing MCNP 6.1 and Profiling ARCHER Geometry Module on the FS7ONNi Problem

    Science.gov (United States)

    Liu, Tianyu; Wolfe, Noah; Lin, Hui; Zieb, Kris; Ji, Wei; Caracappa, Peter; Carothers, Christopher; Xu, X. George

    2017-09-01

    This paper contains two parts revolving around Monte Carlo transport simulation on Intel Many Integrated Core coprocessors (MIC, also known as Xeon Phi). (1) MCNP 6.1 was recompiled into multithreading (OpenMP) and multiprocessing (MPI) forms respectively without modification to the source code. The new codes were tested on a 60-core 5110P MIC. The test case was FS7ONNi, a radiation shielding problem used in MCNP's verification and validation suite. It was observed that both codes became slower on the MIC than on a 6-core X5650 CPU, by a factor of 4 for the MPI code and, abnormally, 20 for the OpenMP code, and both exhibited limited capability of strong scaling. (2) We have recently added a Constructive Solid Geometry (CSG) module to our ARCHER code to provide better support for geometry modelling in radiation shielding simulation. The functions of this module are frequently called in the particle random walk process. To identify the performance bottleneck we developed a CSG proxy application and profiled the code using the geometry data from FS7ONNi. The profiling data showed that the code was primarily memory latency bound on the MIC. This study suggests that despite low initial porting e_ort, Monte Carlo codes do not naturally lend themselves to the MIC platform — just like to the GPUs, and that the memory latency problem needs to be addressed in order to achieve decent performance gain.

  6. On the use of stochastic approximation Monte Carlo for Monte Carlo integration

    KAUST Repository

    Liang, Faming

    2009-01-01

    The stochastic approximation Monte Carlo (SAMC) algorithm has recently been proposed as a dynamic optimization algorithm in the literature. In this paper, we show in theory that the samples generated by SAMC can be used for Monte Carlo integration

  7. Monte Carlo simulation of expert judgments on human errors in chemical analysis--a case study of ICP-MS.

    Science.gov (United States)

    Kuselman, Ilya; Pennecchi, Francesca; Epstein, Malka; Fajgelj, Ales; Ellison, Stephen L R

    2014-12-01

    Monte Carlo simulation of expert judgments on human errors in a chemical analysis was used for determination of distributions of the error quantification scores (scores of likelihood and severity, and scores of effectiveness of a laboratory quality system in prevention of the errors). The simulation was based on modeling of an expert behavior: confident, reasonably doubting and irresolute expert judgments were taken into account by means of different probability mass functions (pmfs). As a case study, 36 scenarios of human errors which may occur in elemental analysis of geological samples by ICP-MS were examined. Characteristics of the score distributions for three pmfs of an expert behavior were compared. Variability of the scores, as standard deviation of the simulated score values from the distribution mean, was used for assessment of the score robustness. A range of the score values, calculated directly from elicited data and simulated by a Monte Carlo method for different pmfs, was also discussed from the robustness point of view. It was shown that robustness of the scores, obtained in the case study, can be assessed as satisfactory for the quality risk management and improvement of a laboratory quality system against human errors. Copyright © 2014 Elsevier B.V. All rights reserved.

  8. Implementation of the n-body Monte-Carlo event generator into the Geant4 toolkit for photonuclear studies

    Energy Technology Data Exchange (ETDEWEB)

    Luo, Wen, E-mail: wenluo-ok@163.com [School of Nuclear Science and Technology, University of South China, Hengyang 421001 (China); Lan, Hao-yang [School of Nuclear Science and Technology, University of South China, Hengyang 421001 (China); Xu, Yi; Balabanski, Dimiter L. [Extreme Light Infrastructure-Nuclear Physics, “Horia Hulubei” National Institute for Physics and Nuclear Engineering (IFIN-HH), 30 Reactorului, 077125 Bucharest-Magurele (Romania)

    2017-03-21

    A data-based Monte Carlo simulation algorithm, Geant4-GENBOD, was developed by coupling the n-body Monte-Carlo event generator to the Geant4 toolkit, aiming at accurate simulations of specific photonuclear reactions for diverse photonuclear physics studies. Good comparisons of Geant4-GENBOD calculations with reported measurements of photo-neutron production cross-sections and yields, and with reported energy spectra of the {sup 6}Li(n,α)t reaction were performed. Good agreements between the calculations and experimental data were found and the validation of the developed program was verified consequently. Furthermore, simulations for the {sup 92}Mo(γ,p) reaction of astrophysics relevance and photo-neutron production of {sup 99}Mo/{sup 99m}Tc and {sup 225}Ra/{sup 225}Ac radioisotopes were investigated, which demonstrate the applicability of this program. We conclude that the Geant4-GENBOD is a reliable tool for study of the emerging experiment programs at high-intensity γ-beam laboratories, such as the Extreme Light Infrastructure – Nuclear Physics facility and the High Intensity Gamma-Ray Source at Duke University.

  9. Accuracy and Radiation Dose of CT-Based Attenuation Correction for Small Animal PET: A Monte Carlo Simulation Study

    International Nuclear Information System (INIS)

    Yang, Ching-Ching; Chan, Kai-Chieh

    2013-06-01

    -Small animal PET allows qualitative assessment and quantitative measurement of biochemical processes in vivo, but the accuracy and reproducibility of imaging results can be affected by several parameters. The first aim of this study was to investigate the performance of different CT-based attenuation correction strategies and assess the resulting impact on PET images. The absorbed dose in different tissues caused by scanning procedures was also discussed to minimize biologic damage generated by radiation exposure due to PET/CT scanning. A small animal PET/CT system was modeled based on Monte Carlo simulation to generate imaging results and dose distribution. Three energy mapping methods, including the bilinear scaling method, the dual-energy method and the hybrid method which combines the kVp conversion and the dual-energy method, were investigated comparatively through assessing the accuracy of estimating linear attenuation coefficient at 511 keV and the bias introduced into PET quantification results due to CT-based attenuation correction. Our results showed that the hybrid method outperformed the bilinear scaling method, while the dual-energy method achieved the highest accuracy among the three energy mapping methods. Overall, the accuracy of PET quantification results have similar trend as that for the estimation of linear attenuation coefficients, whereas the differences between the three methods are more obvious in the estimation of linear attenuation coefficients than in the PET quantification results. With regards to radiation exposure from CT, the absorbed dose ranged between 7.29-45.58 mGy for 50-kVp scan and between 6.61-39.28 mGy for 80-kVp scan. For 18 F radioactivity concentration of 1.86x10 5 Bq/ml, the PET absorbed dose was around 24 cGy for tumor with a target-to-background ratio of 8. The radiation levels for CT scans are not lethal to the animal, but concurrent use of PET in longitudinal study can increase the risk of biological effects. The

  10. Influence of chromatin condensation on the number of direct DSB damages induced by ions studied using a Monte Carlo code

    International Nuclear Information System (INIS)

    Dos Santos, M.; Clairand, I.; Gruel, G.; Barquinero, J.F.; Villagrasa, C.; Incerti, S.

    2014-01-01

    The purpose of this work is to evaluate the influence of the chromatin condensation on the number of direct double-strand break (DSB) damages induced by ions. Two geometries of chromosome territories containing either condensed or de-condensed chromatin were implemented as biological targets in the Geant4 Monte Carlo simulation code and proton and alpha irradiation was simulated using the Geant4-DNA processes. A DBSCAN algorithm was used in order to detect energy deposition clusters that could give rise to single-strand breaks or DSBs on the DNA molecule. The results of this study show an increase in the number and complexity of DNA DSBs in condensed chromatin when compared with de-condensed chromatin. This work aims to evaluate the influence of the chromatin condensation in the number and complexity of direct DSB damages induced by proton and alpha irradiation. With the simulations of this study, the increase in the number and complexity of DSB-like clusters induced by ions in the heterochromatin when compared with euchromatin regions of the cell nucleus has been observed and quantified. These results suggest that condensed chromatin can be the location of more severe radiation-induced lesions, more difficult to repair, than de-condensed chromatin. On the other hand, it was also observed that, whatever the chromatin condensation, more possible damages are found after proton irradiation compared with alpha particles of the same LET. Nevertheless, as already remarked, this study concerns only the direct effect of ionising radiation that can be calculated from the results of the physical stage simulated with Geant4-DNA. To include indirect effects induced by radicals around the DNA molecule, the elements needed for simulating the chemical stage are being developed in the frame of the Geant4-DNA project(15, 16) and they are planned to be included in future work. With a complete calculation (direct + indirect damages) it would then be possible to estimate an energy

  11. Carlo Caso (1940 - 2007)

    CERN Multimedia

    Leonardo Rossi

    Carlo Caso (1940 - 2007) Our friend and colleague Carlo Caso passed away on July 7th, after several months of courageous fight against cancer. Carlo spent most of his scientific career at CERN, taking an active part in the experimental programme of the laboratory. His long and fruitful involvement in particle physics started in the sixties, in the Genoa group led by G. Tomasini. He then made several experiments using the CERN liquid hydrogen bubble chambers -first the 2000HBC and later BEBC- to study various facets of the production and decay of meson and baryon resonances. He later made his own group and joined the NA27 Collaboration to exploit the EHS Spectrometer with a rapid cycling bubble chamber as vertex detector. Amongst their many achievements, they were the first to measure, with excellent precision, the lifetime of the charmed D mesons. At the start of the LEP era, Carlo and his group moved to the DELPHI experiment, participating in the construction and running of the HPC electromagnetic c...

  12. Title: Studies on drug switchability showed heterogeneity in methodological approaches: a scoping review.

    Science.gov (United States)

    Belleudi, Valeria; Trotta, Francesco; Vecchi, Simona; Amato, Laura; Addis, Antonio; Davoli, Marina

    2018-05-16

    Several drugs share the same therapeutic indication, including those undergoing patent expiration. Concerns on the interchangeability are frequent in clinical practice, challenging the evaluation of switchability through observational research. To conduct a scoping review of observational studies on drug switchability to identify methodological strategies adopted to deal with bias and confounding. We searched PubMed, EMBASE, and Web of Science (updated 1/31/2017) to identify studies evaluating switchability in terms of effectiveness/safety outcomes or compliance. Three reviewers independently screened studies extracting all characteristics. Strategies to address confounding, particularly, previous drug use and switching reasons were considered. All findings were summarized in descriptive analyses. Thirty-two studies, published in the last 10 years, met the inclusion criteria. Epilepsy, cardiovascular and rheumatology were the most frequently represented clinical areas. 75% of the studies reported data on effectiveness/safety outcomes. The most frequent study design was cohort (65.6%) followed by case-control (21.9%) and self-controlled (12.5%). Case-control and case-crossover studies showed homogeneous methodological strategies to deal with bias and confounding. Among cohort studies, the confounding associated with previous drug use was addressed introducing variables in multivariate model (47.3%) or selecting only adherent patients (14.3%). Around 30% of cohort studies did not report reasons for switching. In the remaining 70%, clinical parameters or previous occurrence of outcomes were measured to identify switching connected with lack of effectiveness or adverse events. This study represents a starting point for researchers and administrators who are approaching the investigation and assessment of issues related to interchangeability of drugs. Copyright © 2018. Published by Elsevier Inc.

  13. Thermal studies of a superconducting current limiter using Monte-Carlo method

    Science.gov (United States)

    Lévêque, J.; Rezzoug, A.

    1999-07-01

    Considering the increase of the fault current level in electrical network, the current limiters become very interesting. The superconducting limiters are based on the quasi-instantaneous intrinsic transition from superconducting state to normal resistive one. Without detection of default or given order, they reduce the constraints supported by electrical installations above the fault. To avoid the destruction of the superconducting coil, the temperature must not exceed a certain value. Therefore the design of a superconducting coil needs the simultaneous resolution of an electrical equation and a thermal one. This papers deals with a resolution of this coupled problem by the method of Monte-Carlo. This method allows us to calculate the evolution of the resistance of the coil as well as the current of limitation. Experimental results are compared with theoretical ones. L'augmentation des courants de défaut dans les grands réseaux électriques ravive l'intérêt pour les limiteurs de courant. Les limiteurs supraconducteurs de courants peuvent limiter quasi-instantanément, sans donneur d'ordre ni détection de défaut, les courants de court-circuit réduisant ainsi les contraintes supportées par les installations électriques situées en amont du défaut. La limitation s'accompagne nécessairement de la transition du supraconducteur par dépassement de son courant critique. Pour éviter la destruction de la bobine supraconductrice la température ne doit pas excéder une certaine valeur. La conception d'une bobine supraconductrice exige donc la résolution simultanée d'une équation électrique et d'une équation thermique. Nous présentons une résolution de ce problème electrothermique par la méthode de Monte-Carlo. Cette méthode nous permet de calculer l'évolution de la résistance de la bobine et du courant de limitation. Des résultats expérimentaux sont comparés avec les résultats théoriques.

  14. Collimator and energy window optimization for 90Y bremsstrahlung SPECT imaging: A SIMIND Monte Carlo study

    International Nuclear Information System (INIS)

    Roshan, Hoda Rezaei; Mahmoudian, Babak; Gharepapagh, Esmaeil; Azarm, Ahmadreza; Pirayesh Islamian, Jalil

    2016-01-01

    Treatment efficacy of radioembolization using Yttrium-90 ( 90 Y) microspheres is assessed by the 90 Y bremsstrahlung single photon emission computed tomography (SPECT) imaging following radioembolization. The radioisotopic image has the potential of providing reliable activity map of 90 Y microspheres distribution. One of the main reasons of the poor image quality in 90 Y bremsstrahlung SPECT imaging is the continuous and broad energy spectrum of the related bremsstrahlung photons. Furthermore, collimator geometry plays an impressive role in the spatial resolution, sensitivity and image contrast. Due to the relatively poor quality of the 90 Y bremsstrahlung SPECT images, we intend to optimize the medium-energy (ME) parallel-hole collimator and energy window. The Siemens e.cam gamma camera equipped with a ME collimator and a voxelized phantom was simulated by the SImulating Medical Imaging Nuclear Detectors (SIMIND) program. We used the SIMIND Monte Carlo program to generate the 90 Y bremsstrahlung SPECT projection of the digital Jaszczak phantom. The phantom consist of the six hot spheres ranging from 9.5 to 31.8 mm in diameter, which are used to evaluate the image contrast. In order to assess the effect of the energy window on the image contrast, three energy windows ranging from 60 to 160 KeV, 160 to 400 KeV, and 60 to 400 KeV were set on a 90 Y bremsstrahlung spectrum. As well, the effect of the hole diameter of a ME collimator on the image contrast and bremsstrahlung spectrum were investigated. For the fixed collimator and septa thickness values (3.28 cm and 1.14 mm, respectively), a hole diameter range (2.35–3.3 mm) was chosen based on the appropriate balance between the spatial resolution and sensitivity. The optimal energy window for 90 Y bremsstrahlung SPECT imaging was extended energy window from 60 to 400 KeV. Besides, The optimal value of the hole diameter of ME collimator was obtained 3.3 mm. Geometry of the ME parallel-hole collimator and energy

  15. Monte Carlo application based on GEANT4 toolkit to simulate a laser–plasma electron beam line for radiobiological studies

    Energy Technology Data Exchange (ETDEWEB)

    Lamia, D., E-mail: debora.lamia@ibfm.cnr.it [Institute of Molecular Bioimaging and Physiology IBFM CNR – LATO, Cefalù (Italy); Russo, G., E-mail: giorgio.russo@ibfm.cnr.it [Institute of Molecular Bioimaging and Physiology IBFM CNR – LATO, Cefalù (Italy); Casarino, C.; Gagliano, L.; Candiano, G.C. [Institute of Molecular Bioimaging and Physiology IBFM CNR – LATO, Cefalù (Italy); Labate, L. [Intense Laser Irradiation Laboratory (ILIL) – National Institute of Optics INO CNR, Pisa (Italy); National Institute for Nuclear Physics INFN, Pisa Section and Frascati National Laboratories LNF (Italy); Baffigi, F.; Fulgentini, L.; Giulietti, A.; Koester, P.; Palla, D. [Intense Laser Irradiation Laboratory (ILIL) – National Institute of Optics INO CNR, Pisa (Italy); Gizzi, L.A. [Intense Laser Irradiation Laboratory (ILIL) – National Institute of Optics INO CNR, Pisa (Italy); National Institute for Nuclear Physics INFN, Pisa Section and Frascati National Laboratories LNF (Italy); Gilardi, M.C. [Institute of Molecular Bioimaging and Physiology IBFM CNR, Segrate (Italy); University of Milano-Bicocca, Milano (Italy)

    2015-06-21

    We report on the development of a Monte Carlo application, based on the GEANT4 toolkit, for the characterization and optimization of electron beams for clinical applications produced by a laser-driven plasma source. The GEANT4 application is conceived so as to represent in the most general way the physical and geometrical features of a typical laser-driven accelerator. It is designed to provide standard dosimetric figures such as percentage dose depth curves, two-dimensional dose distributions and 3D dose profiles at different positions both inside and outside the interaction chamber. The application was validated by comparing its predictions to experimental measurements carried out on a real laser-driven accelerator. The work is aimed at optimizing the source, by using this novel application, for radiobiological studies and, in perspective, for medical applications. - Highlights: • Development of a Monte Carlo application based on GEANT4 toolkit. • Experimental measurements carried out with a laser-driven acceleration system. • Validation of Geant4 application comparing experimental data with the simulated ones. • Dosimetric characterization of the acceleration system.

  16. Contesting the "Nature" Of Conformity: what Milgram and Zimbardo's studies really show.

    Directory of Open Access Journals (Sweden)

    S Alexander Haslam

    Full Text Available Understanding of the psychology of tyranny is dominated by classic studies from the 1960s and 1970s: Milgram's research on obedience to authority and Zimbardo's Stanford Prison Experiment. Supporting popular notions of the banality of evil, this research has been taken to show that people conform passively and unthinkingly to both the instructions and the roles that authorities provide, however malevolent these may be. Recently, though, this consensus has been challenged by empirical work informed by social identity theorizing. This suggests that individuals' willingness to follow authorities is conditional on identification with the authority in question and an associated belief that the authority is right.

  17. Influence of electrodes on the photon energy deposition in CVD-diamond dosimeters studied with the Monte Carlo code PENELOPE

    International Nuclear Information System (INIS)

    Gorka, B; Nilsson, B; Fernandez-Varea, J M; Svensson, R; Brahme, A

    2006-01-01

    A new dosimeter, based on chemical vapour deposited (CVD) diamond as the active detector material, is being developed for dosimetry in radiotherapeutic beams. CVD-diamond is a very interesting material, since its atomic composition is close to that of human tissue and in principle it can be designed to introduce negligible perturbations to the radiation field and the dose distribution in the phantom due to its small size. However, non-tissue-equivalent structural components, such as electrodes, wires and encapsulation, need to be carefully selected as they may induce severe fluence perturbation and angular dependence, resulting in erroneous dose readings. By introducing metallic electrodes on the diamond crystals, interface phenomena between high- and low-atomic-number materials are created. Depending on the direction of the radiation field, an increased or decreased detector signal may be obtained. The small dimensions of the CVD-diamond layer and electrodes (around 100 μm and smaller) imply a higher sensitivity to the lack of charged-particle equilibrium and may cause severe interface phenomena. In the present study, we investigate the variation of energy deposition in the diamond detector for different photon-beam qualities, electrode materials and geometric configurations using the Monte Carlo code PENELOPE. The prototype detector was produced from a 50 μm thick CVD-diamond layer with 0.2 μm thick silver electrodes on both sides. The mean absorbed dose to the detector's active volume was modified in the presence of the electrodes by 1.7%, 2.1%, 1.5%, 0.6% and 0.9% for 1.25 MeV monoenergetic photons, a complete (i.e. shielded) 60 Co photon source spectrum and 6, 18 and 50 MV bremsstrahlung spectra, respectively. The shift in mean absorbed dose increases with increasing atomic number and thickness of the electrodes, and diminishes with increasing thickness of the diamond layer. From a dosimetric point of view, graphite would be an almost perfect electrode

  18. Monte Carlo Simulation Study of Atomic Structure of alnico Permanent Magnets

    Science.gov (United States)

    Nguyen, Manh Cuong; Wang, Cai-Zhuang; Ho, Kai-Ming

    Lattice Monte Carlo simulation based on quinternary cluster expansion energy model is used to investigate nano-scale structure of alnico alloy, which is considered as a candidate material for rare-earth free high performance permanent magnets, especially for high or elevated temperature applications such as electric motor for vehicles. We observe phase decomposition of the master alnico alloy into FeCo-rich magnetic (α1) and NiAl-rich matrix (α2) phases. Concentrations of Fe and Co in α1 phase and Ni and Al in α2 phase are higher for lower annealing temperature. Ti is residing mostly in the α2 phase. The phase boundary between α1 and α2 phases are quite sharp with only few atomic layers. The α1 phase is in B2 ordering with Fe and Al occupying the α-site and Ni and Co occupying the β-site. The α2 phase is in L21 ordering with Al occupying the 4a-site. The phase composition profile again annealing temperature suggests that lower annealing temperature would improve the magnetism of α2 and diminish the magnetism of α2 phase, hence improve shape anisotropy of α1 phase rods and that of alnico.

  19. Monte Carlo studies and optimization for the calibration system of the GERDA experiment

    Science.gov (United States)

    Baudis, L.; Ferella, A. D.; Froborg, F.; Tarka, M.

    2013-11-01

    The GERmanium Detector Array, GERDA, searches for neutrinoless double β decay in 76Ge using bare high-purity germanium detectors submerged in liquid argon. For the calibration of these detectors γ emitting sources have to be lowered from their parking position on the top of the cryostat over more than 5 m down to the germanium crystals. With the help of Monte Carlo simulations, the relevant parameters of the calibration system were determined. It was found that three 228Th sources with an activity of 20 kBq each at two different vertical positions will be necessary to reach sufficient statistics in all detectors in less than 4 h of calibration time. These sources will contribute to the background of the experiment with a total of (1.07±0.04(stat)-0.19+0.13(sys))×10-4 cts/(keV kg yr)) when shielded from below with 6 cm of tantalum in the parking position.

  20. Monte Carlo studies and optimization for the calibration system of the GERDA experiment

    Energy Technology Data Exchange (ETDEWEB)

    Baudis, L. [Physics Institute, University of Zurich, Winterthurerstrasse 190, 8057 Zürich (Switzerland); Ferella, A.D. [Physics Institute, University of Zurich, Winterthurerstrasse 190, 8057 Zürich (Switzerland); INFN Laboratori Nazionali del Gran Sasso, 67010 Assergi (Italy); Froborg, F., E-mail: francis@froborg.de [Physics Institute, University of Zurich, Winterthurerstrasse 190, 8057 Zürich (Switzerland); Tarka, M. [Physics Institute, University of Zurich, Winterthurerstrasse 190, 8057 Zürich (Switzerland); Physics Department, University of Illinois, 1110 West Green Street, Urbana, IL 61801 (United States)

    2013-11-21

    The GERmanium Detector Array, GERDA, searches for neutrinoless double β decay in {sup 76}Ge using bare high-purity germanium detectors submerged in liquid argon. For the calibration of these detectors γ emitting sources have to be lowered from their parking position on the top of the cryostat over more than 5 m down to the germanium crystals. With the help of Monte Carlo simulations, the relevant parameters of the calibration system were determined. It was found that three {sup 228}Th sources with an activity of 20 kBq each at two different vertical positions will be necessary to reach sufficient statistics in all detectors in less than 4 h of calibration time. These sources will contribute to the background of the experiment with a total of (1.07±0.04(stat){sub −0.19}{sup +0.13}(sys))×10{sup −4}cts/(keVkgyr)) when shielded from below with 6 cm of tantalum in the parking position.

  1. Monte Carlo study of voxel S factor dependence on tissue density and atomic composition

    Energy Technology Data Exchange (ETDEWEB)

    Amato, Ernesto, E-mail: eamato@unime.it [University of Messina, Department of Biomedical Sciences and of Morphologic and Functional Imaging, Section of Radiological Sciences, via Consolare Valeria, 1, I-98125 Messina (Italy); Italiano, Antonio [INFN – Istituto Nazionale di Fisica Nucleare, Gruppo Collegato di Messina (Italy); Baldari, Sergio [University of Messina, Department of Biomedical Sciences and of Morphologic and Functional Imaging, Section of Radiological Sciences, via Consolare Valeria, 1, I-98125 Messina (Italy)

    2013-11-21

    Voxel dosimetry is a common approach to the internal dosimetry of non-uniform activity distributions in nuclear medicine therapies with radiopharmaceuticals and in the estimation of the radiation hazard due to internal contamination of radionuclides. Aim of the present work is to extend our analytical approach for the calculation of voxel S factors to materials different from the soft tissue. We used a Monte Carlo simulation in GEANT4 of a voxelized region of each material in which the source of monoenergetic electrons or photons was uniformly distributed within the central voxel, and the energy deposition was scored over the surrounding 11×11×11 voxels. Voxel S factors were obtained for the following standard ICRP materials: Adipose tissue, Bone cortical, Brain, Lung, Muscle skeletal and Tissue soft with 1 g cm{sup −3} density. Moreover, we considered the standard ICRU materials: Bone compact and Muscle striated. Voxel S factors were represented as a function of the “normalized radius”, defined as the ratio between the source–target voxel distance and the voxel side. We found that voxel S factors and related analytical fit functions are mainly affected by the tissue density, while the material composition gives only a slight contribution to the difference between data series, which is negligible for practical purposes. Our results can help in broadening the dosimetric three-dimensional approach based on voxel S factors to other tissues where diagnostic and therapeutic radionuclides can be taken up and radiation can propagate.

  2. Monte Carlo study of voxel S factor dependence on tissue density and atomic composition

    International Nuclear Information System (INIS)

    Amato, Ernesto; Italiano, Antonio; Baldari, Sergio

    2013-01-01

    Voxel dosimetry is a common approach to the internal dosimetry of non-uniform activity distributions in nuclear medicine therapies with radiopharmaceuticals and in the estimation of the radiation hazard due to internal contamination of radionuclides. Aim of the present work is to extend our analytical approach for the calculation of voxel S factors to materials different from the soft tissue. We used a Monte Carlo simulation in GEANT4 of a voxelized region of each material in which the source of monoenergetic electrons or photons was uniformly distributed within the central voxel, and the energy deposition was scored over the surrounding 11×11×11 voxels. Voxel S factors were obtained for the following standard ICRP materials: Adipose tissue, Bone cortical, Brain, Lung, Muscle skeletal and Tissue soft with 1 g cm −3 density. Moreover, we considered the standard ICRU materials: Bone compact and Muscle striated. Voxel S factors were represented as a function of the “normalized radius”, defined as the ratio between the source–target voxel distance and the voxel side. We found that voxel S factors and related analytical fit functions are mainly affected by the tissue density, while the material composition gives only a slight contribution to the difference between data series, which is negligible for practical purposes. Our results can help in broadening the dosimetric three-dimensional approach based on voxel S factors to other tissues where diagnostic and therapeutic radionuclides can be taken up and radiation can propagate

  3. H + H2 reaction barrier: A fixed-node quantum Monte Carlo study

    International Nuclear Information System (INIS)

    Barnett, R.N.; Reynolds, P.J.; Lester, W.A. Jr.

    1985-01-01

    The classical barrier height for the H+H 2 exchange reaction, as well as the energies at two other points along the reaction path, are calculated using fixed-node quantum Monte Carlo (FNQMC). Several single-determinant importance functions are used at the saddle point in order to relate the quality of the importance function to the accuracy and precision of the final result. The computed barrier is an upper bound since the energy of H and of H 2 is obtained exactly by FNQMC. Our best upper bound (9.70 +- 0.13 kcal/mol) has a mean within 0.1 kcal/mol of the presumed exact value. This best bound is obtained with a single determinant, double-zeta basis importance function. Contrary to experience with expansion methods, it is found that an importance function with a basis set of near Hartree--Fock quality, as well as one derived from a spin-unrestricted SCF calculation, are among the least efficient and least accurate of the importance functions used. Specifically, a nodal surface appearing in the lowest energy molecular orbital in these functions apparently increases the FNQMC energy. The FNQMC energy at the two other points along the reaction path is found to agree with the most accurate CI results of Liu to within statistical error

  4. Diagrammatic Monte Carlo study of Fröhlich polaron dispersion in two and three dimensions

    Science.gov (United States)

    Hahn, Thomas; Klimin, Sergei; Tempere, Jacques; Devreese, Jozef T.; Franchini, Cesare

    2018-04-01

    We present results for the solution of the large polaron Fröhlich Hamiltonian in 3 dimensions (3D) and 2 dimensions (2D) obtained via the diagrammatic Monte Carlo (DMC) method. Our implementation is based on the approach by Mishchenko [A. S. Mishchenko et al., Phys. Rev. B 62, 6317 (2000), 10.1103/PhysRevB.62.6317]. Polaron ground state energies and effective polaron masses are successfully benchmarked with data obtained using Feynman's path integral formalism. By comparing 3D and 2D data, we verify the analytically exact scaling relations for energies and effective masses from 3 D →2 D , which provides a stringent test for the quality of DMC predictions. The accuracy of our results is further proven by providing values for the exactly known coefficients in weak- and strong-coupling expansions. Moreover, we compute polaron dispersion curves which are validated with analytically known lower and upper limits in the small-coupling regime and verify the first-order expansion results for larger couplings, thus disproving previous critiques on the apparent incompatibility of DMC with analytical results and furnishing useful reference for a wide range of coupling strengths.

  5. Stochastic theory of interfacial enzyme kinetics: A kinetic Monte Carlo study

    International Nuclear Information System (INIS)

    Das, Biswajit; Gangopadhyay, Gautam

    2012-01-01

    Graphical abstract: Stochastic theory of interfacial enzyme kinetics is formulated. Numerical results of macroscopic phenomenon of lag-burst kinetics is obtained by using a kinetic Monte Carlo approach to single enzyme activity. Highlights: ► An enzyme is attached with the fluid state phospholipid molecules on the Langmuir monolayer. ► Through the diffusion, the enzyme molecule reaches the gel–fluid interface. ► After hydrolysing a phospholipid molecule it predominantly leaves the surface in the lag phase. ► The enzyme is strictly attached to the surface with scooting mode of motion and the burst phase appears. - Abstract: In the spirit of Gillespie’s stochastic approach we have formulated a theory to explore the advancement of the interfacial enzyme kinetics at the single enzyme level which is ultimately utilized to obtain the ensemble average macroscopic feature, lag-burst kinetics. We have provided a theory of the transition from the lag phase to the burst phase kinetics by considering the gradual development of electrostatic interaction among the positively charged enzyme and negatively charged product molecules deposited on the phospholipid surface. It is shown that the different diffusion time scales of the enzyme over the fluid and product regions are responsible for the memory effect in the correlation of successive turnover events of the hopping mode in the single trajectory analysis which again is reflected on the non-Gaussian distribution of turnover times on the macroscopic kinetics in the lag phase unlike the burst phase kinetics.

  6. An Ab Initio and Kinetic Monte Carlo Simulation Study of Lithium Ion Diffusion on Graphene

    Directory of Open Access Journals (Sweden)

    Kehua Zhong

    2017-07-01

    Full Text Available The Li+ diffusion coefficients in Li+-adsorbed graphene systems were determined by combining first-principle calculations based on density functional theory with Kinetic Monte Carlo simulations. The calculated results indicate that the interactions between Li ions have a very important influence on lithium diffusion. Based on energy barriers directly obtained from first-principle calculations for single-Li+ and two-Li+ adsorbed systems, a new equation predicting energy barriers with more than two Li ions was deduced. Furthermore, it is found that the temperature dependence of Li+ diffusion coefficients fits well to the Arrhenius equation, rather than meeting the equation from electrochemical impedance spectroscopy applied to estimate experimental diffusion coefficients. Moreover, the calculated results also reveal that Li+ concentration dependence of diffusion coefficients roughly fits to the equation from electrochemical impedance spectroscopy in a low concentration region; however, it seriously deviates from the equation in a high concentration region. So, the equation from electrochemical impedance spectroscopy technique could not be simply used to estimate the Li+ diffusion coefficient for all Li+-adsorbed graphene systems with various Li+ concentrations. Our work suggests that interactions between Li ions, and among Li ion and host atoms will influence the Li+ diffusion, which determines that the Li+ intercalation dependence of Li+ diffusion coefficient should be changed and complex.

  7. Monte Carlo Study of the Fish-like Patterns of Anthracenes on Cu(111)

    Science.gov (United States)

    Kim, Kwangmoo; Einstein, T. L.; Sun, Dezheng; Kim, Dae-Ho; Bartels, Ludwig

    2011-03-01

    Using Monte Carlo calculations of the two-dimensional triangular lattice with a 2-component 3-state Potts model, we demonstrate a mechanism for the spontaneous formation of fish-like patterns of anthracene (AC) molecules on Cu(111) by sputtering and annealing, then cooling to ~ 80 K. The two components are an AC on a hollow site and another on a bridge site of Cu(111). The liquid crystal model with two separate parts, positional and orientational, only explains a part of the fish-like pattern, not the whole regular pattern. Our model fixes the positional order of AC's into the triangular lattice and the orientational order into three angles as observed in the experiments. The variation of the coverages of AC's is reflected in the change of the ratio of two components in our model. We also try to understand the compression of AC's with the introduction of Gaussian dispersion of AC's about their triangular lattice sites. Supported primarily by NSF Grants CHE 07-50334 with a secondary support from NSF-MRSEC at the University of Maryland, DMR05-20471. Work at UCR supported primarily by NSF CHE 07-49949.

  8. Ion channeling study of defects in compound crystals using Monte Carlo simulations

    Science.gov (United States)

    Turos, A.; Jozwik, P.; Nowicki, L.; Sathish, N.

    2014-08-01

    Ion channeling is a well-established technique for determination of structural properties of crystalline materials. Defect depth profiles have been usually determined basing on the two-beam model developed by Bøgh (1968) [1]. As long as the main research interest was focused on single element crystals it was considered as sufficiently accurate. New challenge emerged with growing technological importance of compound single crystals and epitaxial heterostructures. Overlap of partial spectra due to different sublattices and formation of complicated defect structures makes the two beam method hardly applicable. The solution is provided by Monte Carlo computer simulations. Our paper reviews principal aspects of this approach and the recent developments in the McChasy simulation code. The latter made it possible to distinguish between randomly displaced atoms (RDA) and extended defects (dislocations, loops, etc.). Hence, complex defect structures can be characterized by the relative content of these two components. The next refinement of the code consists of detailed parameterization of dislocations and dislocation loops. Defect profiles for variety of compound crystals (GaN, ZnO, SrTiO3) have been measured and evaluated using the McChasy code. Damage accumulation curves for RDA and extended defects revealed non monotonous defect buildup with some characteristic steps. Transition to each stage is governed by the different driving force. As shown by the complementary high resolution XRD measurements lattice strain plays here the crucial role and can be correlated with the concentration of extended defects.

  9. Monte Carlo simulation study of the ICRF minority heating in the Large Helical Device

    International Nuclear Information System (INIS)

    Murakami, S.; Okamoto, M.; Nakajima, N.; Ohnishi, M.; Okada, H.

    1993-10-01

    A Monte Carlo simulation code is developed for the ICRF heating in helical systems, which takes into account finite beta effects, complicated orbits of high energetic particles, Coulomb collisions, and interactions between the particles and the applied waves. The code is used to investigate the ICRF minority heating in the Large Helical Device. The configuration of the magnetic fields changes significantly due to finite beta effects in the Large Helical Device. The resonance layer position is found to be crucial to the heating efficiency as the plasma beta increases. When the strength of the resonance magnetic field is set to the value at the magnetic axis, the higher heat efficiency is obtained and no clear difference of the heat efficiency due to the finite beta effects is found at the high ICRF wave power region. However the radial profile of the transferred power to majority ions and electrons from minority ions changes by the deformation of the trapped particle orbits due to the finite beta effects. The heat efficiency is improved if the radial electric field, E r , is positive (E r is directed radially outward) and it is also improved by supplying 3 He minority ions rather than proton minority ions. (author)

  10. Bayesian calibration of terrestrial ecosystem models: a study of advanced Markov chain Monte Carlo methods

    Science.gov (United States)

    Lu, Dan; Ricciuto, Daniel; Walker, Anthony; Safta, Cosmin; Munger, William

    2017-09-01

    Calibration of terrestrial ecosystem models is important but challenging. Bayesian inference implemented by Markov chain Monte Carlo (MCMC) sampling provides a comprehensive framework to estimate model parameters and associated uncertainties using their posterior distributions. The effectiveness and efficiency of the method strongly depend on the MCMC algorithm used. In this work, a differential evolution adaptive Metropolis (DREAM) algorithm is used to estimate posterior distributions of 21 parameters for the data assimilation linked ecosystem carbon (DALEC) model using 14 years of daily net ecosystem exchange data collected at the Harvard Forest Environmental Measurement Site eddy-flux tower. The calibration of DREAM results in a better model fit and predictive performance compared to the popular adaptive Metropolis (AM) scheme. Moreover, DREAM indicates that two parameters controlling autumn phenology have multiple modes in their posterior distributions while AM only identifies one mode. The application suggests that DREAM is very suitable to calibrate complex terrestrial ecosystem models, where the uncertain parameter size is usually large and existence of local optima is always a concern. In addition, this effort justifies the assumptions of the error model used in Bayesian calibration according to the residual analysis. The result indicates that a heteroscedastic, correlated, Gaussian error model is appropriate for the problem, and the consequent constructed likelihood function can alleviate the underestimation of parameter uncertainty that is usually caused by using uncorrelated error models.

  11. Monte Carlo simulation study of ICRF minority heating in the large helical device

    International Nuclear Information System (INIS)

    Murakami, S.; Okamoto, M.; Ohnishi, M.; Okada, H.

    1994-01-01

    A Monte Carlo simulation code is developed for ion cyclotron range of frequencies (ICRF) heating in helical systems, which takes into account finite beta effects, complicated orbits of high energetic particles, Coulomb collisions and interactions between particles and the applied waves. The code is used to investigate ICRF minority heating in the Large Helical Device (LHD). The configuration of the magnetic fields changes significantly due to finite beta effects in the LHD. The resonance layer position is found to be crucial to the heating efficiency as the plasma beta increases. When the strength of the resonance magnetic field is set to the value at the magnetic axis, a higher heat efficiency is obtained and no clear difference of the heat efficiency due to finite beta effects is found in the high ICRF wave power region. However, the radial profile of the power transferred to majority ions and electrons from minority ions changes because of the deformation of the trapped particle due to the finite beta effects. The heat efficiency is improved if the radial electric field, E r , is positive (E r is directed radially outward) and it is also improved by supplying 3 He minority ions rather than proton minority ions. (author). 26 refs, 11 figs, 2 tabs

  12. Monte Carlo study of the double and super-exchange model with lattice distortion

    Energy Technology Data Exchange (ETDEWEB)

    Suarez, J R; Vallejo, E; Navarro, O [Instituto de Investigaciones en Materiales, Universidad Nacional Autonoma de Mexico, Apartado Postal 70-360, 04510 Mexico D. F. (Mexico); Avignon, M, E-mail: jrsuarez@iim.unam.m [Institut Neel, Centre National de la Recherche Scientifique (CNRS) and Universite Joseph Fourier, BP 166, 38042 Grenoble Cedex 9 (France)

    2009-05-01

    In this work a magneto-elastic phase transition was obtained in a linear chain due to the interplay between magnetism and lattice distortion in a double and super-exchange model. It is considered a linear chain consisting of localized classical spins interacting with itinerant electrons. Due to the double exchange interaction, localized spins tend to align ferromagnetically. This ferromagnetic tendency is expected to be frustrated by anti-ferromagnetic super-exchange interactions between neighbor localized spins. Additionally, lattice parameter is allowed to have small changes, which contributes harmonically to the energy of the system. Phase diagram is obtained as a function of the electron density and the super-exchange interaction using a Monte Carlo minimization. At low super-exchange interaction energy phase transition between electron-full ferromagnetic distorted and electron-empty anti-ferromagnetic undistorted phases occurs. In this case all electrons and lattice distortions were found within the ferromagnetic domain. For high super-exchange interaction energy, phase transition between two site distorted periodic arrangement of independent magnetic polarons ordered anti-ferromagnetically and the electron-empty anti-ferromagnetic undistorted phase was found. For this high interaction energy, Wigner crystallization, lattice distortion and charge distribution inside two-site polarons were obtained.

  13. Structure of Se-Te glasses studied using neutron, X-ray diffraction and reverse Monte Carlo modelling

    Energy Technology Data Exchange (ETDEWEB)

    Itoh, Keiji, E-mail: itoh@okayama-u.ac.jp [Graduate School of Education, Okayama University, Tsushima-naka, Okayama 700-8530 (Japan); Research Reactor Institute, Kyoto University, Kumatori, Osaka 590-0494 (Japan)

    2017-02-15

    Pulsed neutron diffraction and synchrotron X-ray diffraction measurements were performed on Se{sub 100-x}Te{sub x} bulk glasses with x=10, 20, 30 and 40. The coordination numbers obtained from the diffraction results demonstrate that Se and Te atoms are twofold coordinated and the glass structure is formed by the chain network. The three-dimensional structure model for Se{sub 60}Te{sub 40} glass obtained by using reverse Monte Carlo modelling shows that the alternating arrangements of Se and Te atoms compose the major part of the chain clusters but several other fragments such as Se{sub n} chains and Te-Te dimers are also present in large numbers. The chain clusters have geometrically disordered forms and the interchain atomic order is different from those in the crystal structures of trigonal Se and trigonal Te. - Graphical abstract: Coordination environment in Se{sub 60}Te{sub 40} glass.

  14. Monte Carlo study of alternate mixed spin-5/2 and spin-2 Ising ferrimagnetic system on the Bethe lattice

    Energy Technology Data Exchange (ETDEWEB)

    Jabar, A. [Laboratoire de Magnétisme et Physique des Hautes Energies L.M.P.H.E.URAC 12, Université Mohammed V, Faculté des Sciences, B.P. 1014 Rabat (Morocco); Masrour, R., E-mail: rachidmasrour@hotmail.com [Laboratoire de Magnétisme et Physique des Hautes Energies L.M.P.H.E.URAC 12, Université Mohammed V, Faculté des Sciences, B.P. 1014 Rabat (Morocco); Laboratory of Materials, Processes, Environment and Quality, Cady Ayyed University, National School of Applied Sciences, PB 63 46000 Safi (Morocco); Benyoussef, A. [Laboratoire de Magnétisme et Physique des Hautes Energies L.M.P.H.E.URAC 12, Université Mohammed V, Faculté des Sciences, B.P. 1014 Rabat (Morocco); Institute of Nanomaterials and Nanotechnologies, MAScIR, Rabat (Morocco); Hassan II Academy of Science and Technology, Rabat (Morocco); Hamedoun, M. [Institute of Nanomaterials and Nanotechnologies, MAScIR, Rabat (Morocco)

    2016-01-01

    The magnetic properties of alternate mixed spin-5/2 and spin-2 Ising model on the Bethe lattice have been studied by using the Monte Carlo simulations. The ground state phase diagrams of alternate mixed spin-5/2 and spin-2 Ising model on the Bethe lattice has been obtained. The thermal total magnetization and magnetization of spins-5/2 and spin-2 with the different exchange interactions, external magnetic field and temperatures have been studied. The critical temperature have been deduced. The magnetic hysteresis cycle on the Bethe lattice has been deduced for different values of exchange interactions, for different values of crystal field and for different sizes. The magnetic coercive field has been deduced. - Highlights: • The alternate mixed spin-5/2 and -2 on the Bethe lattice is studied. • The critical temperature has been deduced. • The magnetic coercive filed has been deduced.

  15. Assessment of influence of OSL dosimeters in the skin dose in radiotherapy: study for Monte Carlo simulation; Avaliacao da influencia de dosimetros OSL na dose na pele em radioterapia: estudo por simulacao Monte Carlo

    Energy Technology Data Exchange (ETDEWEB)

    Schuch, Franciely F.; Nicolucci, Patricia, E-mail: franschuch@yahoo.com.br [Universidade de Sao Paulo (USP), Ribeiraoo Preto, SP (Brazil)

    2017-11-01

    The interest in optically stimulated luminescence (OSL) dosimetry materials is growing due to its potential use in quality control in Radiotherapy. The use of these dosimeters for in vivo dosimetry, however, may influence the dose to the skin and deeper tissues in the patient. The goal of this study is to evaluate the influence of the OSL Al{sub 2}O{sub 3} material in dose deposited in the skin and deep in Radiotherapy. Monte Carlo simulation is used to evaluate this purpose when OSL dosimeters of Al{sub 2}O{sub 3} are positioned on the skin surface of the patient. Percentage depth dose curves for clinical beams of 6 and 10 MV were simulated with and without the presence of the dosimeter on the surface of a water phantom. The results showed a decrease of doses in regions close to the surface of the skin. In the build-up region, the maximum decreases of dose produced by the presence of the dosimeters were 52,5% and 47,5% for the 6 and 10 MV beams, respectively. After the build-up region, there are not significant changes in the doses for any of the used beams. The differences of doses found are due to the influence of the dosimetric material on the relative fluence of electrons near the end surface of the dosimeter. Thus, the results showed that the presence of the dosimetric material on the surface interferes on the skin dose. However, these dosimeters do not cause dose variations in depths of clinical interest, allowing its application in routine in vivo dosimetry in Radiotherapy. (author)

  16. A multicenter study of using carbon nanoparticles to show sentinel lymph nodes in early gastric cancer.

    Science.gov (United States)

    Yan, Jun; Zheng, Xiaoling; Liu, Zhangyuanzhu; Yu, Jiang; Deng, Zhenwei; Xue, Fangqing; Zheng, Yu; Chen, Feng; Shi, Hong; Chen, Gang; Lu, Jianping; Cai, Lisheng; Cai, Mingzhi; Xiang, Gao; Hong, Yunfeng; Chen, Wenbo; Li, Guoxin

    2016-04-01

    Lymph node metastasis occurs in approximately 10% of early gastric cancer. Preoperative or intra-operative identification of lymph node metastasis in early gastric cancer is crucial for surgical planning. The purpose of this study was to evaluate the feasibility of using carbon nanoparticles to show sentinel lymph nodes (SLNs) in early gastric cancer. A multicenter study was performed between July 2012 and November 2014. Ninety-one patients with early gastric cancer identified by preoperative endoscopic ultrasonography were recruited. One milliliter carbon nanoparticles suspension, which is approved by Chinese Food and Drug Administration, was endoscopically injected into the submucosal layer at four points around the site of the primary tumor 6-12 h before surgery. Laparoscopic radical resection with D2 lymphadenectomy was performed. SLNs were defined as nodes that were black-dyed by carbon nanoparticles in greater omentum and lesser omentum near gastric cancer. Lymph node status and SLNs accuracy were confirmed by pathological analysis. All patients had black-dyed SLNs lying in greater omentum and/or lesser omentum. SLNs were easily found under laparoscopy. The mean number of SLNs was 4 (range 1-9). Carbon nanoparticles were around cancer in specimen. After pathological analysis, 10 patients (10.99%) had lymph node metastasis in 91 patients with early gastric cancer. SLNs were positive in 9 cases and negative in 82 cases. In pathology, carbon nanoparticles were seen in lymphatic vessels, lymphoid sinus, and macrophages in SLNs. When SLNs were positive, cancer cells were seen in lymph nodes. The sensitivity, specificity, and accuracy of black-dyed SLNs in early gastric cancers were 90, 100, and 98.9 %, respectively. No patient had any side effects of carbon nanoparticles in this study. It is feasible to use carbon nanoparticles to show SLNs in early gastric cancer. Carbon nanoparticles suspension is safe for submucosal injection.

  17. Helical tomotherapy for SIB and hypo-fractionated treatments in lung carcinomas: A 4D Monte Carlo treatment planning study

    International Nuclear Information System (INIS)

    Sterpin, Edmond; Janssens, Guillaume; Orban de Xivry, Jonathan; Goossens, Samuel; Wanet, Marie; Lee, John A.; Delor, Antoine; Bol, Vanesa; Vynckier, Stefaan; Gregoire, Vincent; Geets, Xavier

    2012-01-01

    Purpose: To evaluate the impact of intra-fraction motion induced by regular breathing on treatment quality for helical tomotherapy treatments. Material and methods: Four patients treated by simultaneous-integrated boost (SIB) and three by hypo-fractionated stereotactic treatments (hypo-fractionated, 18 Gy/fraction) were included. All patients were coached to ensure regular breathing. For the SIB group, the tumor volume was delineated using CT information only (CTV CT ) and the boost region was based on PET information (GTV PET , no CTV extension). In the hypo-fractionated group, a GTV based on CT information was contoured. In both groups, ITVs were defined according to 4D data. The PTV included the ITV plus a setup error margin. The treatment was planned using the tomotherapy TPS on 3D CT images. In order to verify the impact of intra-fraction motion and interplay effects, dose calculations were performed using a previously validated Monte Carlo model of tomotherapy (TomoPen): first on the planning 3D CT (“planned dose”) and second, on the 10 phases of the 4D scan. For the latter, two dose distributions, termed “interplay simulated” or “no interplay” were computed with and without beamlet-phase correlation over the 10 phases and combined using deformable dose registration. Results: In all cases, DVHs of “interplay simulated” dose distributions complied within 1% of the original clinical objectives used for planning, defined according to ICRU (report 83) and RTOG (trials 0236 and 0618) recommendations, for SIB and hypo-fractionated groups, respectively. For one patient in the hypo-fractionated group, D mean to the CTV CT was 2.6% and 2.5% higher than “planned” for “interplay simulated” and “no interplay”, respectively. Conclusion: For the patients included in this study, assuming regular breathing, the results showed that interplay of breathing and tomotherapy delivery motions did not affect significantly plan delivery accuracy. Hence

  18. Monte-Carlo study on primary knock-on atom energy spectrum produced by neutron radiation

    International Nuclear Information System (INIS)

    Zhou Wei; Liu Yongkang; Deng Yongjun; Ma Jimin

    2012-01-01

    Computational method on energy distribution of primary knock-on atom (PKA) produced by neutron radiation was built in the paper. Based on the DBCN card in MCNP, reaction position, reaction type and energy transfer between neutrons and atoms were recorded. According to statistic of these data, energy and space distributions of PKAs were obtained. The method resolves preferably randomicity of random number and efficiency of random sampling computation. The results show small statistical fluctuation and well statistical. Three-dimensional figure of energy and space distribution of PKAs were obtained, which would be important to evaluate radiation capability of materials and study radiation damage by neutrons. (authors)

  19. Studies of a deep burn fuel cycle for the incineration of military plutonium in the GT-MHR using the Monte-Carlo burnup code

    International Nuclear Information System (INIS)

    Talamo, A.; Gudowski, W.

    2004-01-01

    The deep burn fuel cycle for the incineration of military plutonium in the GT-MHR is studied using the Monte-Carlo burnup code. The irradiation is DF is so rich in fissile isotopes that the TF cannot guarantee a negative reactive feedback, and the presence of erbium as burnable poison is absolutely necessary for the reactivity safety reasons. At beginning of life (BOL) the fuel composed of DF, consisting of fresh military plutonium, after an irradiation period of three years the fuel is reprocessed into post driver fuel (PDF). The mass flow of the GT-MHR fuelled by military plutonium at the equilibrium of the fuel composition shows that 66% of 239 Pu is burned in three years and 92% in six years. (authors)

  20. Monte-Carlo simulation of the SL-ELEKTA-20 medical linear accelerator. Dosimetric study of a water phantom

    International Nuclear Information System (INIS)

    Thiam, Ch. O.

    2003-06-01

    In radiotherapy, it is essential to have a precise knowledge of the dose delivered in the target volume and the neighbouring critical organs. To be usable clinically, the models of calculation must take into account the exact characteristics of the beams used and the densities of fabrics. Today we can use sophisticated irradiation techniques and get a more precise assessment of the dose and with a better knowledge of its distribution. Thus in this report, will be detailed a simulation of the head of irradiation of accelerator SL-ELEKTA-20 in electrons mode and a dosimetric study of a water phantom. This study is carried out with the code of simulation Monte Carlo GATE adapted for applications of medical physics; the results are compared with the data obtained by the anticancer center 'Jean Perrin' on a similar accelerator. (author)

  1. Monte Carlo Study of Four-Dimensional Self-avoiding Walks of up to One Billion Steps

    Science.gov (United States)

    Clisby, Nathan

    2018-04-01

    We study self-avoiding walks on the four-dimensional hypercubic lattice via Monte Carlo simulations of walks with up to one billion steps. We study the expected logarithmic corrections to scaling, and find convincing evidence in support the scaling form predicted by the renormalization group, with an estimate for the power of the logarithmic factor of 0.2516(14), which is consistent with the predicted value of 1/4. We also characterize the behaviour of the pivot algorithm for sampling four dimensional self-avoiding walks, and conjecture that the probability of a pivot move being successful for an N-step walk is O([ log N ]^{-1/4}).

  2. Radiation protection studies for medical particle accelerators using FLUKA Monte Carlo code

    International Nuclear Information System (INIS)

    Infantino, Angelo; Mostacci, Domiziano; Cicoria, Gianfranco; Lucconi, Giulia; Pancaldi, Davide; Vichi, Sara; Zagni, Federico; Marengo, Mario

    2017-01-01

    Radiation protection (RP) in the use of medical cyclotrons involves many aspects both in the routine use and for the decommissioning of a site. Guidelines for site planning and installation, as well as for RP assessment, are given in international documents; however, the latter typically offer analytic methods of calculation of shielding and materials activation, in approximate or idealised geometry set-ups. The availability of Monte Carlo (MC) codes with accurate up-to-date libraries for transport and interaction of neutrons and charged particles at energies below 250 MeV, together with the continuously increasing power of modern computers, makes the systematic use of simulations with realistic geometries possible, yielding equipment and site-specific evaluation of the source terms, shielding requirements and all quantities relevant to RP at the same time. In this work, the well-known FLUKA MC code was used to simulate different aspects of RP in the use of biomedical accelerators, particularly for the production of medical radioisotopes. In the context of the Young Professionals Award, held at the IRPA 14 conference, only a part of the complete work is presented. In particular, the simulation of the GE PETtrace cyclotron (16.5 MeV) installed at S. Orsola-Malpighi University Hospital evaluated the effective dose distribution around the equipment; the effective number of neutrons produced per incident proton and their spectral distribution; the activation of the structure of the cyclotron and the vault walls; the activation of the ambient air, in particular the production of "4"1Ar. The simulations were validated, in terms of physical and transport parameters to be used at the energy range of interest, through an extensive measurement campaign of the neutron environmental dose equivalent using a rem-counter and TLD dosemeters. The validated model was then used in the design and the licensing request of a new Positron Emission Tomography facility. (authors)

  3. Atomistic kinetic Monte Carlo study of atomic layer deposition derived from density functional theory.

    Science.gov (United States)

    Shirazi, Mahdi; Elliott, Simon D

    2014-01-30

    To describe the atomic layer deposition (ALD) reactions of HfO2 from Hf(N(CH3)2)4 and H2O, a three-dimensional on-lattice kinetic Monte-Carlo model is developed. In this model, all atomistic reaction pathways in density functional theory (DFT) are implemented as reaction events on the lattice. This contains all steps, from the early stage of adsorption of each ALD precursor, kinetics of the surface protons, interaction between the remaining precursors (steric effect), influence of remaining fragments on adsorption sites (blocking), densification of each ALD precursor, migration of each ALD precursors, and cooperation between the remaining precursors to adsorb H2O (cooperative effect). The essential chemistry of the ALD reactions depends on the local environment at the surface. The coordination number and a neighbor list are used to implement the dependencies. The validity and necessity of the proposed reaction pathways are statistically established at the mesoscale. The formation of one monolayer of precursor fragments is shown at the end of the metal pulse. Adsorption and dissociation of the H2O precursor onto that layer is described, leading to the delivery of oxygen and protons to the surface during the H2O pulse. Through these processes, the remaining precursor fragments desorb from the surface, leaving the surface with bulk-like and OH-terminated HfO2, ready for the next cycle. The migration of the low coordinated remaining precursor fragments is also proposed. This process introduces a slow reordering motion (crawling) at the mesoscale, leading to the smooth and conformal thin film that is characteristic of ALD. Copyright © 2013 Wiley Periodicals, Inc.

  4. Investigation of time-of-flight benefits in an LYSO-based PET/CT scanner: A Monte Carlo study using GATE

    International Nuclear Information System (INIS)

    Geramifar, P.; Ay, M.R.; Shamsaie Zafarghandi, M.; Sarkar, S.; Loudos, G.; Rahmim, A.

    2011-01-01

    The advent of fast scintillators yielding great light yield and/or stopping power, along with advances in photomultiplier tubes and electronics, have rekindled interest in time-of-flight (TOF) PET. Because the potential performance improvements offered by TOF PET are substantial, efforts to improve PET timing should prove very fruitful. In this study, we performed Monte Carlo simulations to explore what gains in PET performance could be achieved if the coincidence resolving time (CRT) in the LYSO-based PET component of Discovery RX PET/CT scanner were improved. For this purpose, the GATE Monte Carlo package was utilized, providing the ability to model and characterize various physical phenomena in PET imaging. For the present investigation, count rate performance and signal to noise ratio (SNR) values in different activity concentrations were simulated for different coincidence timing windows of 4, 5.85, 6, 6.5, 8, 10 and 12 ns and with different CRTs of 100-900 ps FWHM involving 50 ps FWHM increments using the NEMA scatter phantom. Strong evidence supporting robustness of the simulations was found as observed in the good agreement between measured and simulated data for the cases of estimating axial sensitivity, axial and transaxial detection position, gamma non-collinearity angle distribution and positron annihilation distance. In the non-TOF context, the results show that the random event rate can be reduced by using narrower coincidence timing window widths, demonstrating considerable enhancements in the peak noise equivalent count rate (NECR) performance. The peak NECR had increased by ∼50% when utilizing the coincidence window width of 4 ns. At the same time, utilization of TOF information resulted in improved NECR and SNR with the dramatic reduction of random coincidences as a function of CRT. For example, with CRT of 500 ps FWHM, a factor of 2.3 reduction in random rates, factor of 1.5 increase in NECR and factor of 2.1 improvement in SNR is achievable

  5. Investigation of time-of-flight benefits in an LYSO-based PET/CT scanner: A Monte Carlo study using GATE

    Energy Technology Data Exchange (ETDEWEB)

    Geramifar, P. [Faculty of Physics and Nuclear Engineering, Amir Kabir University of Technology (Tehran Polytechnic), Tehran (Iran, Islamic Republic of); Research Center for Science and Technology in Medicine, Tehran University of Medical Sciences, Tehran (Iran, Islamic Republic of); Research Institute for Nuclear Medicine, Tehran University of Medical Sciences, Shariati Hospital, Tehran (Iran, Islamic Republic of); Ay, M.R., E-mail: mohammadreza_ay@tums.ac.ir [Research Center for Science and Technology in Medicine, Tehran University of Medical Sciences, Tehran (Iran, Islamic Republic of); Research Institute for Nuclear Medicine, Tehran University of Medical Sciences, Shariati Hospital, Tehran (Iran, Islamic Republic of); Department of Medical Physics and Biomedical Engineering, Tehran University of Medical Sciences, Tehran (Iran, Islamic Republic of); Shamsaie Zafarghandi, M. [Faculty of Physics and Nuclear Engineering, Amir Kabir University of Technology (Tehran Polytechnic), Tehran (Iran, Islamic Republic of); Sarkar, S. [Research Center for Science and Technology in Medicine, Tehran University of Medical Sciences, Tehran (Iran, Islamic Republic of); Research Institute for Nuclear Medicine, Tehran University of Medical Sciences, Shariati Hospital, Tehran (Iran, Islamic Republic of); Loudos, G. [Department of Medical Instruments Technology, Technological Educational Institute, Athens (Greece); Rahmim, A. [Department of Radiology, School of Medicine, Johns Hopkins University, Baltimore (United States); Department of Electrical and Computer Engineering, School of Engineering, Johns Hopkins University, Baltimore (United States)

    2011-06-11

    The advent of fast scintillators yielding great light yield and/or stopping power, along with advances in photomultiplier tubes and electronics, have rekindled interest in time-of-flight (TOF) PET. Because the potential performance improvements offered by TOF PET are substantial, efforts to improve PET timing should prove very fruitful. In this study, we performed Monte Carlo simulations to explore what gains in PET performance could be achieved if the coincidence resolving time (CRT) in the LYSO-based PET component of Discovery RX PET/CT scanner were improved. For this purpose, the GATE Monte Carlo package was utilized, providing the ability to model and characterize various physical phenomena in PET imaging. For the present investigation, count rate performance and signal to noise ratio (SNR) values in different activity concentrations were simulated for different coincidence timing windows of 4, 5.85, 6, 6.5, 8, 10 and 12 ns and with different CRTs of 100-900 ps FWHM involving 50 ps FWHM increments using the NEMA scatter phantom. Strong evidence supporting robustness of the simulations was found as observed in the good agreement between measured and simulated data for the cases of estimating axial sensitivity, axial and transaxial detection position, gamma non-collinearity angle distribution and positron annihilation distance. In the non-TOF context, the results show that the random event rate can be reduced by using narrower coincidence timing window widths, demonstrating considerable enhancements in the peak noise equivalent count rate (NECR) performance. The peak NECR had increased by {approx}50% when utilizing the coincidence window width of 4 ns. At the same time, utilization of TOF information resulted in improved NECR and SNR with the dramatic reduction of random coincidences as a function of CRT. For example, with CRT of 500 ps FWHM, a factor of 2.3 reduction in random rates, factor of 1.5 increase in NECR and factor of 2.1 improvement in SNR is

  6. Applicability of dose conversion coefficients of ICRP 74 to Asian adult males: Monte Carlo simulation study

    International Nuclear Information System (INIS)

    Lee, Choonsik; Lee, Choonik; Lee, Jai-Ki

    2007-01-01

    International Commission on Radiological Protection (ICRP) reported comprehensive dose conversion coefficients for adult population, which is exposed to external photon sources in the Publication 74. However, those quantities were calculated from so-called stylized (or mathematical) phantoms composed of simplified mathematical surface equations so that the discrepancy between the phantoms and real human anatomy has been investigated by several authors using Caucasian-based voxel phantoms. To address anatomical and racial limitations of the stylized phantoms, several Asian-based voxel phantoms have been developed by Korean and Japanese investigators, independently. In the current study, photon dose conversion coefficients of ICRP 74 were compared with those from a total of five Asian-based male voxel phantoms, whose body dimensions were almost identical. Those of representative radio-sensitive organs (testes, red bone marrow, colon, lungs, and stomach), and effective dose conversion coefficients were obtained for comparison. Even though organ doses for testes, colon and lungs, and effective doses from ICRP 74 agreed well with those from Asian voxel phantoms within 10%, absorbed doses for red bone marrow and stomach showed significant discrepancies up to 30% which was mainly attributed to difference of phantom description between stylized and voxel phantoms. This study showed that the ICRP 74 dosimetry data, which have been reported to be unrealistic compared to those from Caucasian-based voxel phantoms, are also not appropriate for Asian population

  7. Monte Carlo study of the pure and dilute Baxter-Wu model

    International Nuclear Information System (INIS)

    Schreiber, Nir; Adler, Joan

    2005-01-01

    We studied the pure and dilute Baxter-Wu (BW) models using the Wang-Landau (WL) sampling method to calculate the density-of-states (DOS). We first used the exact result for the DOS of the Ising model to test our code. Then we calculated the DOS of the dilute Ising model to obtain a phase diagram, in good agreement with previous studies. We calculated the energy distribution, together with its first, second and fourth moments, to give the specific heat and the energy fourth order cumulant, better known as the Binder parameter, for the pure BW model. For small samples, the energy distribution displayed a doubly peaked shape, and finite size scaling analysis showed the expected reciprocal scaling of the positions of the peaks with L. The energy distribution yielded the expected BW α = 2/3 critical exponent for the specific heat. The Binder parameter minimum appeared to scale with lattice size L with an exponent θ B equal to the specific heat exponent. Its location (temperature) showed a large correction-to-scaling term θ 1 = 0.248 ± 0.025. For the dilute BW model we found a clear crossover to a single peak in the energy distribution even for small sizes and the expected α = 0 was recovered

  8. Contributions to the Monte-Carlo methods development for the criticality studies: the anisotropy diffusion representation, the perturbations study; Contributions au developpement des methodes de Monte-Carlo pour les etudes de criticite: representation de l'anisotropie de la diffusion, etude des perturbations

    Energy Technology Data Exchange (ETDEWEB)

    Le Cocq, A

    1998-11-23

    The aim of this work is the performances improvement of the Monte-Carlo codes for the criticality studies. MORET IV is especially concerned. With multigroup approximations, the anisotropy equations are very irregular and show quick variations. In a Monte-Carlo codes, they are estimated only by the first coefficients of Legendre polynomials development. Many methods have been characterised using variable number of these coefficients, allowing their reconstruction. So reference representations were defined. Thus they showed that the approximation by only one Dirac could lead to a reactivity under-evaluations. Referring to these representations, new methods have been introduced in MORET IV and instructions have been proposed. Two methods (the correlated samples method and the derivatives sampling method) have been studied to define the divergence between two closely configurations result. A few variance formula of the collision density variation for an infinite medium to an energy group, have been established. These formula have been perfected by simulation for a finite medium. (A.L.B.)

  9. Contributions to the Monte-Carlo methods development for the criticality studies: the anisotropy diffusion representation, the perturbations study; Contributions au developpement des methodes de Monte-Carlo pour les etudes de criticite: representation de l'anisotropie de la diffusion, etude des perturbations

    Energy Technology Data Exchange (ETDEWEB)

    Le Cocq, A

    1998-11-23

    The aim of this work is the performances improvement of the Monte-Carlo codes for the criticality studies. MORET IV is especially concerned. With multigroup approximations, the anisotropy equations are very irregular and show quick variations. In a Monte-Carlo codes, they are estimated only by the first coefficients of Legendre polynomials development. Many methods have been characterised using variable number of these coefficients, allowing their reconstruction. So reference representations were defined. Thus they showed that the approximation by only one Dirac could lead to a reactivity under-evaluations. Referring to these representations, new methods have been introduced in MORET IV and instructions have been proposed. Two methods (the correlated samples method and the derivatives sampling method) have been studied to define the divergence between two closely configurations result. A few variance formula of the collision density variation for an infinite medium to an energy group, have been established. These formula have been perfected by simulation for a finite medium. (A.L.B.)

  10. Material rhetoric: spreading stones and showing bones in the study of prehistory.

    Science.gov (United States)

    Van Reybrouck, David; de Bont, Raf; Rock, Jan

    2009-06-01

    Since the linguistic turn, the role of rhetoric in the circulation and the popular representation of knowledge has been widely accepted in science studies. This article aims to analyze not a textual form of scientific rhetoric, but the crucial role of materiality in scientific debates. It introduces the concept of material rhetoric to understand the promotional regimes in which material objects play an essential argumentative role. It analyzes the phenomenon by looking at two students of prehistory from nineteenth-century Belgium. In the study of human prehistory and evolution, material data are either fairly abundant stone tools or very scarce fossil bones. These two types of material data stand for two different strategies in material rhetoric. In this article, the first strategy is exemplified by Aimé Rutot, who gathered great masses of eoliths (crudely chipped stones which he believed to be prehistoric tools). The second strategy is typified by the example of Julien Fraipont, who based his scientific career on only two Neanderthal skeletons. Rutot sent his "artifacts" to a very wide audience, while Fraipont showed his skeletons to only a few selected scholars. Unlike Rutot, however, Fraipont was able to monitor his audience's interpretation of the finds by means of personal contacts. What an archaeologist gains in reach, he or she apparently loses in control. In this article we argue that only those scholars who find the right balance between the extremes of reach and control will prove to be successful.

  11. Nature of Interlayer Binding and Stacking of sp–sp 2 Hybridized Carbon Layers: A Quantum Monte Carlo Study

    International Nuclear Information System (INIS)

    Shin, Hyeondeok; Lee, Hoonkyung; Heinonen, Olle; Benali, Anouar; Kwon, Yongkyung

    2017-01-01

    α-graphyne is a two-dimensional sheet of sp-sp2 hybridized carbon atoms in a honeycomb lattice. While the geometrical structure is similar to that of graphene, the hybridized triple bonds give rise to electronic structure that is different from that of graphene. Similar to graphene, α-graphyne can be stacked in bilayers with two stable configurations, but the different stackings have very different electronic structures: one is predicted to have gapless parabolic bands and the other a tunable bandgap which is attractive for applications. In order to realize applications, it is crucial to understand which stacking is more stable. This is difficult to model, as the stability is a result of weak interlayer van der Waals interactions which are not well captured by density functional theory (DFT). We have used quantum Monte Carlo simulations that accurately include van der Waals interactions to calculate the interlayer binding energy of bilayer graphyne and to determine its most stable stacking mode. Our results show that inter-layer bindings of sp- and sp2-bonded carbon networks are significantly underestimated in a Kohn-Sham DFT approach, even with an exchange-correlation potential corrected to include, in some approximation, van der Waals interactions. Finally, our quantum Monte Carlo calculations reveal that the interlayer binding energy difference between the two stacking modes is only 0.9(4) eV/atom. From this we conclude that the two stable stacking modes of bilayer α-graphyne are almost degenerate with each other, and both will occur with about the same probability at room temperature unless there is a synthesis path that prefers one stacking over the other.

  12. SU-E-T-20: Removal of Electron Contamination in Longitudinal Field MRI-Linac Systems: A Monte Carlo Study.

    Science.gov (United States)

    Oborn, B M; Metcalfe, P; Butson, M; Crozier, S; Keall, P

    2012-06-01

    The prototype inline MRI-linac system has some advantages over perpendicular models including avoiding the electron return effect. One of the disadvantages of the inline approach is the increased skin dose, estimated to be 400-1000% of the dmax dose. The purpose of this work was to design a feasible method to reduce this skin dose to acceptable levels. Magnetic modeling of proposed MRI-linac designs have been simulated with the inclusion of an optimized permanent magnet system to purge/deflect the electron contamination. The region of air above the phantom was also replaced with a helium bag (region of helium gas) and a beam scrapper below the deflector was added to collect deflected off-axis contamination. Monte Carlo simulations were then performed including the accurate 3D magnetic field maps. Surface dosimetry was recorded to verify the changes to the skin doses. Magnetic modelling showed that an optimized NdFeB permanent magnet system located outside the MRI coils (below the MLC's) can provide a strong enough region to purge/deflect a significant portion of the electron contamination from the x-ray beam. The impact on the MRI uniformity is around 100 ppm and hence is correctable via active/passive shimming of the MRI. The helium region also significantly limits the production of contamination traveling towards the phantom surface. Entry doses near CAX are predicted to be similar to the 0 T case. Magnetic and Monte Carlo modeling were performed to estimate the effect that a permanent magnet purging system, beam scrapper, and helium bag would have on lowering the skin doses in an inline MRI-Linac system. MRI non-uniformities introduced by the deflector could be corrected, contamination is mostly purged or blocked, and the helium bag minimizes air-generated contamination. As a result skin doses are comparable to having zero magnetic field. © 2012 American Association of Physicists in Medicine.

  13. Brownian dynamics and dynamic Monte Carlo simulations of isotropic and liquid crystal phases of anisotropic colloidal particles: a comparative study.

    Science.gov (United States)

    Patti, Alessandro; Cuetos, Alejandro

    2012-07-01

    We report on the diffusion of purely repulsive and freely rotating colloidal rods in the isotropic, nematic, and smectic liquid crystal phases to probe the agreement between Brownian and Monte Carlo dynamics under the most general conditions. By properly rescaling the Monte Carlo time step, being related to any elementary move via the corresponding self-diffusion coefficient, with the acceptance rate of simultaneous trial displacements and rotations, we demonstrate the existence of a unique Monte Carlo time scale that allows for a direct comparison between Monte Carlo and Brownian dynamics simulations. To estimate the validity of our theoretical approach, we compare the mean square displacement of rods, their orientational autocorrelation function, and the self-intermediate scattering function, as obtained from Brownian dynamics and Monte Carlo simulations. The agreement between the results of these two approaches, even under the condition of heterogeneous dynamics generally observed in liquid crystalline phases, is excellent.

  14. Lectures on Monte Carlo methods

    CERN Document Server

    Madras, Neal

    2001-01-01

    Monte Carlo methods form an experimental branch of mathematics that employs simulations driven by random number generators. These methods are often used when others fail, since they are much less sensitive to the "curse of dimensionality", which plagues deterministic methods in problems with a large number of variables. Monte Carlo methods are used in many fields: mathematics, statistics, physics, chemistry, finance, computer science, and biology, for instance. This book is an introduction to Monte Carlo methods for anyone who would like to use these methods to study various kinds of mathemati

  15. Monte Carlo study of the three-dimensional spatially anisotropic Ising superantiferromagnet in the presence of a magnetic field

    Energy Technology Data Exchange (ETDEWEB)

    Salmon, Octavio D.R., E-mail: octaviors@gmail.com [Departamento de Física, Universidade Federal do Amazonas, 3000, Japiim, 69077-000 Manaus-AM (Brazil); Neto, Minos A., E-mail: minosneto@pq.cnpq.br [Departamento de Física, Universidade Federal do Amazonas, 3000, Japiim, 69077-000 Manaus-AM (Brazil); Viana, J. Roberto, E-mail: vianafisica@bol.com.br [Departamento de Física, Universidade Federal do Amazonas, 3000, Japiim, 69077-000 Manaus-AM (Brazil); Padilha, Igor T., E-mail: igorfis@ufam.edu.br [Departamento de Física, Universidade Federal do Amazonas, 3000, Japiim, 69077-000 Manaus-AM (Brazil); Sousa, J. Ricardo de, E-mail: jsousa@ufam.edu.br [Departamento de Física, Universidade Federal do Amazonas, 3000, Japiim, 69077-000 Manaus-AM (Brazil); National Institute of Science and Technology for Complex Systems, 3000, Japiim, 69077-000 Manaus-AM (Brazil)

    2013-11-01

    The phase transition of the three-dimensional spatially anisotropic Ising antiferromagnetic model in the presence of an uniform longitudinal magnetic field H is studied by using the traditional Monte Carlo (MC) simulation for sizes L=16, 32 and 64. The model consists of ferromagnetic interactions J{sub z}=λ{sub 2}J{sub x} in the x(z) direction and antiferromagnetic interactions J{sub y}=λ{sub 1}J{sub x} in the y direction (Ising superantiferromagnetic). For the particular case λ{sub 1}=λ{sub 2}=1 we obtain the phase diagram in the T–H plane. Was observed first- and second-order transitions in the low and high temperature limits, respectively, with the presence of a tricritical point.

  16. Monte Carlo FLUKA code simulation for study of {sup 68}Ga production by direct proton-induced reaction

    Energy Technology Data Exchange (ETDEWEB)

    Mokhtari Oranj, Leila; Kakavand, Tayeb [Physics Faculty, Zanjan University, P.O. Box 451-313, Zanjan (Iran, Islamic Republic of); Sadeghi, Mahdi, E-mail: msadeghi@nrcam.org [Agricultural, Medical and Industrial Research School, Nuclear Science and Technology Research Institute, P.O. Box 31485-498, Karaj (Iran, Islamic Republic of); Aboudzadeh Rovias, Mohammadreza [Agricultural, Medical and Industrial Research School, Nuclear Science and Technology Research Institute, P.O. Box 31485-498, Karaj (Iran, Islamic Republic of)

    2012-06-11

    {sup 68}Ga is an important radionuclide for positron emission tomography. {sup 68}Ga can be produced by the {sup 68}Zn(p,n){sup 68}Ga reaction in a common biomedical cyclotrons. To facilitate optimization of target design and study activation of materials, Monte Carlo code can be used to simulate the irradiation of the target materials with charged hadrons. In this paper, FLUKA code simulation was employed to prototype a Zn target for the production of {sup 68}Ga by proton irradiation. Furthermore, the experimental data were compared with the estimated values for the thick target yield produced in the irradiation time according to FLUKA code. In conclusion, FLUKA code can be used for estimation of the production yield.

  17. Optimization of mass of plastic scintillator film for flow-cell based tritium monitoring: a Monte Carlo study

    International Nuclear Information System (INIS)

    Roy, Arup Singha; Palani Selvam, T.; Raman, Anand; Raja, V.; Chaudhury, Probal

    2014-01-01

    Over the years, various types of tritium-in-air monitors have been designed and developed based on different principles. Ionization chamber, proportional counter and scintillation detector systems are few among them. A plastic scintillator based, flow-cell type online tritium-in-air monitoring system was developed for online monitoring of tritium in air. The value of the scintillator mass inside the cell-volume, which maximizes the response of the detector system, should be obtained to get maximum efficiency. The present study is aimed to optimize the amount of mass of the plastic scintillator film for the flow-cell based tritium monitoring instrument so that maximum efficiency is achieved. The Monte Carlo based EGSnrc code system has been used for this purpose

  18. PENENTUAN HARGA OPSI BELI TIPE ASIA DENGAN METODE MONTE CARLO-CONTROL VARIATE

    Directory of Open Access Journals (Sweden)

    NI NYOMAN AYU ARTANADI

    2017-01-01

    Full Text Available Option is a contract between the writer and the holder which entitles the holder to buy or sell an underlying asset at the maturity date for a specified price known as an exercise price. Asian option is a type of financial derivatives which the payoff taking the average value over the time series of the asset price. The aim of the study is to present the Monte Carlo-Control Variate as an extension of Standard Monte Carlo applied on the calculation of the Asian option price. Standard Monte Carlo simulations 10.000.000 generate standard error 0.06 and the option price convergent at Rp.160.00 while Monte Carlo-Control Variate simulations 100.000 generate standard error 0.01 and the option price convergent at Rp.152.00. This shows the Monte Carlo-Control Variate achieve faster option price toward convergent of the Monte Carlo Standar.

  19. [Study of Determination of Oil Mixture Components Content Based on Quasi-Monte Carlo Method].

    Science.gov (United States)

    Wang, Yu-tian; Xu, Jing; Liu, Xiao-fei; Chen, Meng-han; Wang, Shi-tao

    2015-05-01

    Gasoline, kerosene, diesel is processed by crude oil with different distillation range. The boiling range of gasoline is 35 ~205 °C. The boiling range of kerosene is 140~250 °C. And the boiling range of diesel is 180~370 °C. At the same time, the carbon chain length of differentmineral oil is different. The carbon chain-length of gasoline is within the scope of C7 to C11. The carbon chain length of kerosene is within the scope of C12 to C15. And the carbon chain length of diesel is within the scope of C15 to C18. The recognition and quantitative measurement of three kinds of mineral oil is based on different fluorescence spectrum formed in their different carbon number distribution characteristics. Mineral oil pollution occurs frequently, so monitoring mineral oil content in the ocean is very important. A new method of components content determination of spectra overlapping mineral oil mixture is proposed, with calculation of characteristic peak power integrationof three-dimensional fluorescence spectrum by using Quasi-Monte Carlo Method, combined with optimal algorithm solving optimum number of characteristic peak and range of integral region, solving nonlinear equations by using BFGS(a rank to two update method named after its inventor surname first letter, Boyden, Fletcher, Goldfarb and Shanno) method. Peak power accumulation of determined points in selected area is sensitive to small changes of fluorescence spectral line, so the measurement of small changes of component content is sensitive. At the same time, compared with the single point measurement, measurement sensitivity is improved by the decrease influence of random error due to the selection of points. Three-dimensional fluorescence spectra and fluorescence contour spectra of single mineral oil and the mixture are measured by taking kerosene, diesel and gasoline as research objects, with a single mineral oil regarded whole, not considered each mineral oil components. Six characteristic peaks are

  20. Studies of vector boson transverse momentum simulation in Monte Carlo event generators

    CERN Document Server

    The ATLAS collaboration

    2011-01-01

    We present studies of event generator behaviours regarding vector boson production characteristics, in particular the transverse momentum, pT, of the $Z$ boson as measured by ATLAS, for discussion at the LPCC working group meeting on precision electroweak physics at the LHC. The results discussed focus on the poor descriptions of ATLAS $W$ and $Z$ pT spectra by the ATLAS AUET2B LO** tune of PYTHIA6, and by the shower-matched NLO generator combination POWHEG+PYTHIA6. We show that both standalone PYTHIA6 and POWHEG can be made to describe the Sudakov peak of the ATLAS $Z$ pT distribution by tuning of the PYTHIA parton shower -- different approaches are required in each case. Comparisons of other NLO generators to the $Z$ pT data are also shown.

  1. Dosimetric study of prostate brachytherapy using techniques of Monte-Carlo simulation, experimental measurements and comparison with a treatment plan

    International Nuclear Information System (INIS)

    Teles, Pedro; Barros, Silvia; Vaz, Pedro; Goncalves, Isabel; Facure, Alessandro; Rosa, Luiz da; Santos, Maira; Pereira Junior, Pedro Paulo; Zankl, Maria

    2013-01-01

    Prostate Brachytherapy is a radiotherapy technique, which consists in inserting a number of radioactive seeds (containing, usually, the following radionuclides 125 l, 241 Am or 103 Pd ) surrounding or in the vicinity of, prostate tumor tissue . The main objective of this technique is to maximize the radiation dose to the tumor and minimize it in other tissues and organs healthy, in order to reduce its morbidity. The absorbed dose distribution in the prostate, using this technique is usually non-homogeneous and time dependent. Various parameters such as the type of seed, the attenuation interactions between them, their geometrical arrangement within the prostate, the actual geometry of the seeds,and further swelling of the prostate gland after implantation greatly influence the course of absorbed dose in the prostate and surrounding areas. Quantification of these parameters is therefore extremely important for dose optimization and improvement of their plans conventional treatment, which in many cases not fully take into account. The Monte Carlo techniques allow to study these parameters quickly and effectively. In this work, we use the program MCNPX and generic voxel phantom (GOLEM) where simulated different geometric arrangements of seeds containing 125 I, Amersham Health model of type 6711 in prostates of different sizes, in order to try to quantify some of the parameters. The computational model was validated using a phantom prostate cubic RW3 type , consisting of tissue equivalent, and thermoluminescent dosimeters. Finally, to have a term of comparison with a treatment real plan it was simulate a treatment plan used in a hospital of Rio de Janeiro, with exactly the same parameters, and our computational model. The results obtained in our study seem to indicate that the parameters described above may be a source of uncertainty in the correct evaluation of the dose required for actual treatment plans. The use of Monte Carlo techniques can serve as a complementary

  2. SU-G-IeP2-13: Toward Heavy Ion Computed Tomography with Carbon Ions: A Monte Carlo Study

    Energy Technology Data Exchange (ETDEWEB)

    Shrestha, D; Qin, N; Zhang, Y; Jia, X; Wang, J [UT Southwestern Medical Center, Dallas, TX (United States)

    2016-06-15

    Purpose: In the present Monte Carlo study, we investigated the use of Carbon ions for computed tomography (CT) with a relatively low imaging dose. This will enable us to avoid any conversion of X-ray CT numbers to the relative stopping power (or relative electron density) values and the associated uncertainties in Carbon dose calculation. Methods: In the first stage, we studied the propagation of Carbon nuclei through a water phantom using the Geant4 specially to understand their lateral displacement inside the phantom. In the second stage, we used our GPU-based Monte Carlo code, which has been cross validated against Geant4, to create the 2D map of the water equivalent path length (WEPL) inside a human head size phantom by acquiring 240 projections each 1.5° apart. Subsequently the 3D relative electron density map of the phantom was reconstructed from the 2D WEPL map using the Algebraic Reconstruction Technique (ART) coupled with total variation (TV) minimization Results: A high quality image of the relative electron density inside the phantom was reconstructed by ARTTV. The mean relative error between the reconstructed image for low contrast object (PMMA) was about 1.74%. The delivered dose per scan at the center of the phantom was about 0.1 Gy. Conclusion: We have been able to obtain a 3D map of the electron density using a human head size phantom while keeping the delivered dose to relatively low value. Using the GPU capabilities of our simulation engine, we believe that a real time CT with Carbon ions could be a reality in future.

  3. A cross-sectional study of Tritrichomonas foetus infection among healthy cats at shows in Norway

    Directory of Open Access Journals (Sweden)

    Nødtvedt Ane

    2011-06-01

    Full Text Available Abstract Background In recent years, the protozoan Tritrichomonas foetus has been recognised as an important cause of chronic large-bowel diarrhoea in purebred cats in many countries, including Norway. The aim of this cross-sectional study was to determine the proportion of animals with T. foetus infection among clinically healthy cats in Norway and to assess different risk factors for T. foetus infection, such as age, sex, former history of gastrointestinal symptoms and concurrent infections with Giardia duodenalis and Cryptosporidium sp. Methods The sample population consisted of 52 cats participating in three cat shows in Norway in 2009. Samples were examined for motile T. foetus by microscopy, after culturing and for T. foetus-DNA by species-specific nested PCR, as well as for Giardia cysts and Cryptosporidium oocysts by immunofluorescent antibody test (IFAT. Results By PCR, T. foetus-DNA was demonstrated in the faeces of 11 (21% of the 52 cats tested. DNA-sequencing of five positive samples yielded 100% identity with previous isolates of T. foetus from cats. Only one sample was positive for T. foetus by microscopy. By IFAT, four samples were positive for Giardia cysts and one for Cryptosporidium oocysts, none of which was co-infected with T. foetus. No significant associations were found between the presence of T. foetus and the various risk factors examined. Conclusions T. foetus was found to be a common parasite in clinically healthy cats in Norway.

  4. Monte Carlo simulation to study the doses in an accelerator BNCT treatment

    International Nuclear Information System (INIS)

    Burlon, Alejandro A.; Valda, Alejandro A.; Somacal, Hector R.; Kreiner, Andres J.; Minsky, Daniel M.

    2003-01-01

    In this work the 7 Li(p, n) 7 Be reaction has been studied as a neutron source for accelerator-based BNCT (Boron Neutron Capture Therapy). In order to optimize the design of the neutron production target and the beam shaping assembly, extensive MCNP simulations have been performed. These simulations include a thick Li metal target, a whole-body phantom, a moderator-reflector assembly (Al/AlF 3 as moderator and graphite as reflector) and the treatment room. The doses were evaluated for two proton bombarding energies of 1.92 MeV (near to the threshold of the reaction) and 2.3 MeV (near to the resonance of the reaction) and for three Al/ALF 3 moderator thicknesses (18, 26 and 34 cm). To assess the doses, a comparison using a Tumor Control Probability (TCP) model was done. In a second instance, the effect of the specific skin radiosensitivity (an RBE of 2.5 for the 10 B(n,α) 7 Li reaction) and a 10 B uptake of 17 ppm was considered for the scalp. Finally, the simulations show the advantage of irradiating with near-resonance-energy protons (2.3 MeV) because of the high neutron yield at this energy, leading to the lowest treatment times. Moreover, the 26 cm Al/AlF 3 moderator has shown the best performance among the studied cases. (author)

  5. Bayesian Monte Carlo method

    International Nuclear Information System (INIS)

    Rajabalinejad, M.

    2010-01-01

    To reduce cost of Monte Carlo (MC) simulations for time-consuming processes, Bayesian Monte Carlo (BMC) is introduced in this paper. The BMC method reduces number of realizations in MC according to the desired accuracy level. BMC also provides a possibility of considering more priors. In other words, different priors can be integrated into one model by using BMC to further reduce cost of simulations. This study suggests speeding up the simulation process by considering the logical dependence of neighboring points as prior information. This information is used in the BMC method to produce a predictive tool through the simulation process. The general methodology and algorithm of BMC method are presented in this paper. The BMC method is applied to the simplified break water model as well as the finite element model of 17th Street Canal in New Orleans, and the results are compared with the MC and Dynamic Bounds methods.

  6. Cadmium in Salix. A study to show the capacity of Salix to remove cadmium from farmland

    International Nuclear Information System (INIS)

    Oestman, G.

    1994-01-01

    The aim of this report has been to show the ability of Salix to take up cadmium and how the uptake varies between different types of soil. The information that the results are based on has been obtained from analyses of soil and Salix. The samples were taken at five sites in the district around Lake Maelaren. Two or three stands were taken at each place. The factors studied were the pH, the organic matter content, and the concentration of cadmium in the soil. Salix has a good ability, relative to other crops, to remove cadmium from arable land. The cadmium uptake is 35 times higher with Salix than with straw or energy grass. Salix uptake of cadmium varies between 3 and 14% of the cadmium content in the soil that is accessible to plants. The present annual increase of cadmium in arable land is 1 g/ha, whereas the removal in a Salix plantation is 21 g Cd/ha, yr at an annual growth of 10 tonnes DM. If the Cd uptake is the same each year, then a total of 420 g Cd/ha is removed when Salix is grown over a 20-year period. This is a very large part of the topsoil's total cadmium content, which is 550 g/ha on average in Sweden. The investigation reveals no clear relationship between the Cd concentration in Salix and the concentration of Cd in the soil, the organic matter content or the pH. 22 refs, 4 figs, 2 tabs

  7. Complement activation in leprosy: a retrospective study shows elevated circulating terminal complement complex in reactional leprosy.

    Science.gov (United States)

    Bahia El Idrissi, N; Hakobyan, S; Ramaglia, V; Geluk, A; Morgan, B Paul; Das, P Kumar; Baas, F

    2016-06-01

    Mycobacterium leprae infection gives rise to the immunologically and histopathologically classified spectrum of leprosy. At present, several tools for the stratification of patients are based on acquired immunity markers. However, the role of innate immunity, particularly the complement system, is largely unexplored. The present retrospective study was undertaken to explore whether the systemic levels of complement activation components and regulators can stratify leprosy patients, particularly in reference to the reactional state of the disease. Serum samples from two cohorts were analysed. The cohort from Bangladesh included multi-bacillary (MB) patients with (n = 12) or without (n = 46) reaction (R) at intake and endemic controls (n = 20). The cohort from Ethiopia included pauci-bacillary (PB) (n = 7) and MB (n = 23) patients without reaction and MB (n = 15) patients with reaction. The results showed that the activation products terminal complement complex (TCC) (P ≤ 0·01), C4d (P ≤ 0·05) and iC3b (P ≤ 0·05) were specifically elevated in Bangladeshi patients with reaction at intake compared to endemic controls. In addition, levels of the regulator clusterin (P ≤ 0·001 without R; P < 0·05 with R) were also elevated in MB patients, irrespective of a reaction. Similar analysis of the Ethiopian cohort confirmed that, irrespective of a reaction, serum TCC levels were increased significantly in patients with reactions compared to patients without reactions (P ≤ 0·05). Our findings suggests that serum TCC levels may prove to be a valuable tool in diagnosing patients at risk of developing reactions. © 2016 British Society for Immunology.

  8. Assessment study for multi-barrier system used in radioactive borate waste isolation based on Monte Carlo simulations.

    Science.gov (United States)

    Bayoumi, T A; Reda, S M; Saleh, H M

    2012-01-01

    Radioactive waste generated from the nuclear applications should be properly isolated by a suitable containment system such as, multi-barrier container. The present study aims to evaluate the isolation capacity of a new multi-barrier container made from cement and clay and including borate waste materials. These wastes were spiked by (137)Cs and (60)Co radionuclides to simulate that waste generated from the primary cooling circuit of pressurized water reactors. Leaching of both radionuclides in ground water was followed and calculated during ten years. Monte Carlo (MCNP5) simulations computed the photon flux distribution of the multi-barrier container, including radioactive borate waste of specific activity 11.22KBq/g and 4.18KBq/g for (137)Cs and (60)Co, respectively, at different periods of 0, 15.1, 30.2 and 302 years. The average total flux for 100cm radius of spherical cell was 0.192photon/cm(2) at initial time and 2.73×10(-4)photon/cm(2) after 302 years. Maximum waste activity keeping the surface radiation dose within the permissible level was calculated and found to be 56KBq/g with attenuation factors of 0.73cm(-1) and 0.6cm(-1) for cement and clay, respectively. The average total flux was 1.37×10(-3)photon/cm(2) after 302 years. Monte Carlo simulations revealed that the proposed multi-barrier container is safe enough during transportation, evacuation or rearrangement in the disposal site for more than 300 years. Copyright © 2011 Elsevier Ltd. All rights reserved.

  9. EGSNRC Monte Carlo study of the effect of photon energy and field margin in phantoms simulating small lung lesions

    International Nuclear Information System (INIS)

    Osei, E.K.; Darko, J.; Mosseri, A.; Jezioranski, J.

    2003-01-01

    The dose distribution in small lung tumors (coin lesions) is affected by the combined effects of reduced attenuation of photons and extended range of electrons in lung. The increased range of electrons in low-density tissues can lead to loss of field flatness and increased penumbra width, especially at high energies. The EGSNRC Monte Carlo code, together with DOSXYZNRC, a three-dimensional voxel dose calculation module has been used to study the characteristics of the penumbra in the region of the target-lung interfaces for various radiation beam energies, lung densities, target-field edge distances, target size, and depth. The Monte Carlo model was validated by film measurements made in acrylic (simulating a tumor) imbedded in cork (simulating the lung). Beam profiles that are deemed to be acceptable are defined as those in which no point within the planning target volume (target volume plus 1 cm margin) received less than 95% of the dose prescribed to the center of the target. For parallel opposed beams and 2 cm cube target size, 6 MV photons produce superior dose distribution with respect to penumbra at the lateral, anterior, and posterior surfaces and midplane of the simulated target, with a target-field edge distance of 2.5 cm. A lesser target-field edge distance of 2.0 cm is required for 4 MV photons to produce acceptable dose distribution. To achieve equivalent dose distribution with 10 and 18 MV photons, a target-field edge distance of 3.0 and 3.5 cm, respectively, is required. For a simulated target size of 4 cm cube, a target-field edge distance of 2, 2.5, and 3 cm is required for 6, 10, and 18 MV photons, respectively, to yield acceptable PTV coverage. The effect, which is predominant in determining the target dose, depends on the beam energy, target-field edge distance, lung density, and the depth and size of the target

  10. Strain Distribution in a Partially Molten Crust: Insights from the AMS Study of Carlos Chagas Anatexite, ARAÇUAI Belt (se Brazil)

    Science.gov (United States)

    Cavalcante, G.; Silva, M.; Vauchez, A. R.

    2012-12-01

    Anatectic domains, characterized by abundant migmatites, represent portions of the middle crust that have been partially molten. The Carlos Chagas anatexite is a unit that includes diatexites, metaxites and anatetic, peraluminous granites. It is localized in eastern domain of the Araçuaí Belt, which was formed during the amalgamation of West Gondwana by the collision of the Sao Francisco and Congo cratons. This orogenic segment underwent a synkinematic high temperature (>750oC)-low pressure (~ 6MPa) metamorphism that causes widespread partial melting of the middle crust. The Carlos Chagas unit is composed by quartz, feldspar, garnet, biotite, sillimanite, ilmenite, rutile and cordierite. U-Pb data indicates that its crystallization occurred c. a. 574 ~ 3 Ma. The main feature of this migmatite is the presence of a pervasive magmatic foliation, which is marked by the preferential alignment of biotite, alkali feldspars and plagioclase. At the grain scale, quartz displays evidence of interstitial crystallization and few solid-state deformation fabrics are observed. We used anisotropy of magnetic susceptibility (AMS) as a tool for recovering mineral fabric and thus the flow field of the Carlos Chagas anatexite. Magnetic properties of 153 samples were measured. They yield dominantly low values of the bulk magnetic susceptibility (km 0) being dominantly more frequent than prolates ones. These magnetics characteristics are consistent with biotite being the dominant carrier of the AMS. Magnetic foliations and lineations suggest two main structural patterns. The northern portion of the studied area shows shallowly plunging lineations (02° - 20°) to SE (140°-120°) or NW (340°-300°), while the foliation strikes NW-SE with shallow dips (03°-10°). Local subvertical foliation dips (70°) are due to NE-SW trending transcurrent shear zones. The southern region shows complex magnetic fabric patterns. Magnetic lineation plunges range from 05° to 58°, in varied directions

  11. Monte Carlo Studies of two Different Conversion Layers for Neutron Measurements with Medipix Silicon Detector.

    CERN Document Server

    Larsen, Andreas

    2013-01-01

    In 2007 the ventilation system of CNGS failed and investigations showed that the failure was due to Single Event Upset (SEU). Since then there has been increased interest in studies of neutron flux, that can potentially cause SEU. Two Medipix detectors have previously been installed in the CMS cavern on a test basis and have shown to work as intended[1]. More Medipix detectors will be installed to provide high resolution measurements of the particle flux in the vicinity of the CMS, focusing on measurements of the neutron flux. The measurements will provide an important basis to know what precautions to take to avoid another failure due to SEU. The measurements will also constitute a valuably reference to the FLUKA simulations of the general flux in the CMS cavern, that can potentially lead to important corrections of the simulations. Furthermore, measurements from the Medipix detectors will act as a cross check on the hadronic forward detector radiation monitoring system (HF radmon). Bonnos spheres are alread...

  12. Organ S values and effective doses for family members exposed to adult patients following I-131 treatment: A Monte Carlo simulation study

    Energy Technology Data Exchange (ETDEWEB)

    Han, Eun Young [Department of Radiation Oncology, University of Arkansas Medical Sciences, Little Rock, Arkansas 72205 (United States); Lee, Choonsik [Division of Cancer Epidemiology and Genetics, National Cancer Institute, National Institute of Health, Bethesda, Maryland 20852 (United States); Mcguire, Lynn; Brown, Tracy L. Y. [Department of Radiology, Division of Nuclear Medicine, University of Arkansas Medical Sciences, Little Rock, Arkansas 72205 (United States); Bolch, Wesley E. [J. Crayton Pruitt Family Department of Biomedical Engineering, University of Florida, Gainesville, Florida 32611 (United States)

    2013-08-15

    Purpose: To calculate organ S values (mGy/Bq-s) and effective doses per time-integrated activity (mSv/Bq-s) for pediatric and adult family members exposed to an adult male or female patient treated with I-131 using a series of hybrid computational phantoms coupled with a Monte Carlo radiation transport technique.Methods: A series of pediatric and adult hybrid computational phantoms were employed in the study. Three different exposure scenarios were considered: (1) standing face-to-face exposures between an adult patient and pediatric or adult family phantoms at five different separation distances; (2) an adult female patient holding her newborn child, and (3) a 1-yr-old child standing on the lap of an adult female patient. For the adult patient model, two different thyroid-related diseases were considered: hyperthyroidism and differentiated thyroid cancer (DTC) with corresponding internal distributions of {sup 131}I. A general purpose Monte Carlo code, MCNPX v2.7, was used to perform the Monte Carlo radiation transport.Results: The S values show a strong dependency on age and organ location within the family phantoms at short distances. The S values and effective dose per time-integrated activity from the adult female patient phantom are relatively high at shorter distances and to younger family phantoms. At a distance of 1 m, effective doses per time-integrated activity are lower than those values based on the NRC (Nuclear Regulatory Commission) by a factor of 2 for both adult male and female patient phantoms. The S values to target organs from the hyperthyroid-patient source distribution strongly depend on the height of the exposed family phantom, so that their values rapidly decrease with decreasing height of the family phantom. Active marrow of the 10-yr-old phantom shows the highest S values among family phantoms for the DTC-patient source distribution. In the exposure scenario of mother and baby, S values and effective doses per time-integrated activity to

  13. Organ S values and effective doses for family members exposed to adult patients following I-131 treatment: A Monte Carlo simulation study

    International Nuclear Information System (INIS)

    Han, Eun Young; Lee, Choonsik; Mcguire, Lynn; Brown, Tracy L. Y.; Bolch, Wesley E.

    2013-01-01

    Purpose: To calculate organ S values (mGy/Bq-s) and effective doses per time-integrated activity (mSv/Bq-s) for pediatric and adult family members exposed to an adult male or female patient treated with I-131 using a series of hybrid computational phantoms coupled with a Monte Carlo radiation transport technique.Methods: A series of pediatric and adult hybrid computational phantoms were employed in the study. Three different exposure scenarios were considered: (1) standing face-to-face exposures between an adult patient and pediatric or adult family phantoms at five different separation distances; (2) an adult female patient holding her newborn child, and (3) a 1-yr-old child standing on the lap of an adult female patient. For the adult patient model, two different thyroid-related diseases were considered: hyperthyroidism and differentiated thyroid cancer (DTC) with corresponding internal distributions of 131 I. A general purpose Monte Carlo code, MCNPX v2.7, was used to perform the Monte Carlo radiation transport.Results: The S values show a strong dependency on age and organ location within the family phantoms at short distances. The S values and effective dose per time-integrated activity from the adult female patient phantom are relatively high at shorter distances and to younger family phantoms. At a distance of 1 m, effective doses per time-integrated activity are lower than those values based on the NRC (Nuclear Regulatory Commission) by a factor of 2 for both adult male and female patient phantoms. The S values to target organs from the hyperthyroid-patient source distribution strongly depend on the height of the exposed family phantom, so that their values rapidly decrease with decreasing height of the family phantom. Active marrow of the 10-yr-old phantom shows the highest S values among family phantoms for the DTC-patient source distribution. In the exposure scenario of mother and baby, S values and effective doses per time-integrated activity to the

  14. CERN honours Carlo Rubbia

    CERN Multimedia

    2009-01-01

    On 7 April CERN will be holding a symposium to mark the 75th birthday of Carlo Rubbia, who shared the 1984 Nobel Prize for Physics with Simon van der Meer for contributions to the discovery of the W and Z bosons, carriers of the weak interaction. Following a presentation by Rolf Heuer, lectures will be given by eminent speakers on areas of science to which Carlo Rubbia has made decisive contributions. Michel Spiro, Director of the French National Institute of Nuclear and Particle Physics (IN2P3) of the CNRS, Lyn Evans, sLHC Project Leader, and Alan Astbury of the TRIUMF Laboratory will talk about the physics of the weak interaction and the discovery of the W and Z bosons. Former CERN Director-General Herwig Schopper will lecture on CERN’s accelerators from LEP to the LHC. Giovanni Bignami, former President of the Italian Space Agency and Professor at the IUSS School for Advanced Studies in Pavia will speak about his work with Carlo Rubbia. Finally, Hans Joachim Sch...

  15. Monte Carlo design and simulation of a grid-type multi-layer pixel collimator for radiotherapy: feasibility study

    Energy Technology Data Exchange (ETDEWEB)

    Yoon, Do-Kun; Jung, Joo-Young; Suh, Tae-Suk [The Catholic University of Korea, Seoul (Korea, Republic of)

    2014-05-15

    In order to confirm the possibility of field application of a different type collimator with a multileaf collimator (MLC), we constructed a grid-type multi-layer pixel collimator (GTPC) by using a Monte Carlo n-particle simulation (MCNPX). In this research, a number of factors related to the performance of the GPTC were evaluated using simulated output data of a basic MLC model. A layer was comprised of a 1024-pixel collimator (5.0 x 5.0 mm{sup 2}) which could operate individually as a grid-type collimator (32 x 32). A 30-layer collimator was constructed for a specific portal form to pass radiation through the opening and closing of each pixel cover. The radiation attenuation level and the leakage were compared between the GTPC modality simulation and MLC modeling (tungsten, 17.50 g/cm{sup 3}, 5.0 x 70.0 x 160.0 mm{sup 3}) currently used for a radiation field. Comparisons of the portal imaging, the lateral dose profile from a virtual water phantom, the dependence of the performance on the increase in the number of layers, the radiation intensity modulation verification, and the geometric error between the GTPC and the MLC were done using the MCNPX simulation data. From the simulation data, the intensity modulation of the GTPC showed a faster response than the MLC's (29.6%). In addition, the agreement between the doses that should be delivered to the target region was measured as 97.0%, and the GTPC system had an error below 0.01%, which is identical to that of MLC. A Monte Carlo simulation of the GTPC could be useful for verification of application possibilities. Because the line artifact is caused by the grid frame and the folded cover, a lineal dose transfer type is chosen for the operation of this system. However, the result of GTPC's performance showed that the methods of effective intensity modulation and the specific geometric beam shaping differed with the MLC modality.

  16. Monte Carlo design and simulation of a grid-type multi-layer pixel collimator for radiotherapy: Feasibility study

    Science.gov (United States)

    Yoon, Do-Kun; Jung, Joo-Young; Suh, Tae Suk

    2014-05-01

    In order to confirm the possibility of field application of a different type collimator with a multileaf collimator (MLC), we constructed a grid-type multi-layer pixel collimator (GTPC) by using a Monte Carlo n-particle simulation (MCNPX). In this research, a number of factors related to the performance of the GPTC were evaluated using simulated output data of a basic MLC model. A layer was comprised of a 1024-pixel collimator (5.0 × 5.0 mm2) which could operate individually as a grid-type collimator (32 × 32). A 30-layer collimator was constructed for a specific portal form to pass radiation through the opening and closing of each pixel cover. The radiation attenuation level and the leakage were compared between the GTPC modality simulation and MLC modeling (tungsten, 17.50 g/cm3, 5.0 × 70.0 × 160.0 mm3) currently used for a radiation field. Comparisons of the portal imaging, the lateral dose profile from a virtual water phantom, the dependence of the performance on the increase in the number of layers, the radiation intensity modulation verification, and the geometric error between the GTPC and the MLC were done using the MCNPX simulation data. From the simulation data, the intensity modulation of the GTPC showed a faster response than the MLC's (29.6%). In addition, the agreement between the doses that should be delivered to the target region was measured as 97.0%, and the GTPC system had an error below 0.01%, which is identical to that of MLC. A Monte Carlo simulation of the GTPC could be useful for verification of application possibilities. Because the line artifact is caused by the grid frame and the folded cover, a lineal dose transfer type is chosen for the operation of this system. However, the result of GTPC's performance showed that the methods of effective intensity modulation and the specific geometric beam shaping differed with the MLC modality.

  17. Monte Carlo design and simulation of a grid-type multi-layer pixel collimator for radiotherapy: feasibility study

    International Nuclear Information System (INIS)

    Yoon, Do-Kun; Jung, Joo-Young; Suh, Tae-Suk

    2014-01-01

    In order to confirm the possibility of field application of a different type collimator with a multileaf collimator (MLC), we constructed a grid-type multi-layer pixel collimator (GTPC) by using a Monte Carlo n-particle simulation (MCNPX). In this research, a number of factors related to the performance of the GPTC were evaluated using simulated output data of a basic MLC model. A layer was comprised of a 1024-pixel collimator (5.0 x 5.0 mm 2 ) which could operate individually as a grid-type collimator (32 x 32). A 30-layer collimator was constructed for a specific portal form to pass radiation through the opening and closing of each pixel cover. The radiation attenuation level and the leakage were compared between the GTPC modality simulation and MLC modeling (tungsten, 17.50 g/cm 3 , 5.0 x 70.0 x 160.0 mm 3 ) currently used for a radiation field. Comparisons of the portal imaging, the lateral dose profile from a virtual water phantom, the dependence of the performance on the increase in the number of layers, the radiation intensity modulation verification, and the geometric error between the GTPC and the MLC were done using the MCNPX simulation data. From the simulation data, the intensity modulation of the GTPC showed a faster response than the MLC's (29.6%). In addition, the agreement between the doses that should be delivered to the target region was measured as 97.0%, and the GTPC system had an error below 0.01%, which is identical to that of MLC. A Monte Carlo simulation of the GTPC could be useful for verification of application possibilities. Because the line artifact is caused by the grid frame and the folded cover, a lineal dose transfer type is chosen for the operation of this system. However, the result of GTPC's performance showed that the methods of effective intensity modulation and the specific geometric beam shaping differed with the MLC modality.

  18. Studying the Effect of a Competitive Game Show in a Learning by Teaching Environment

    Science.gov (United States)

    Matsuda, Noboru; Yarzebinski, Evelyn; Keiser, Victoria; Raizada, Rohan; Stylianides, Gabriel J.; Koedinger, Kenneth R.

    2013-01-01

    In this paper we investigate how competition among tutees in the context of learning by teaching affects tutors' engagement as well as tutor learning. We conducted this investigation by incorporating a competitive Game Show feature into an online learning environment where students learn to solve algebraic equations by teaching a synthetic…

  19. Sauerbraten, Rotkappchen und Goethe: The Quiz Show as an Introduction to German Studies.

    Science.gov (United States)

    White, Diane

    1980-01-01

    Proposes an adaptation of the quiz-show format for classroom use, discussing a set of rules and sample questions designed for beginning and intermediate German students. Presents questions based on German life and culture which are especially selected to encourage participation from students majoring in subjects other than German. (MES)

  20. Magnetism reflectometer study shows LiF layers improve efficiency in spin valve devices

    Energy Technology Data Exchange (ETDEWEB)

    Bardoel, Agatha A [ORNL; Lauter, Valeria [ORNL; Szulczewski, Greg J [ORNL

    2012-01-01

    -emitting diodes, has been found to enhance the injection of electrons through the semiconductor. Researchers from the University of Alabama and ORNL used polarized neutrons at the magnetism reflectometer at SNS to investigate the electronic, magnetic, and structural properties of the electrodes in a novel system. In this system, the magnetic layers cobalt and Ni{sub 80}Fe{sub 20} are interfaced with spacer layers composed of the organic semiconductor Alq3. A coupling layer of LiF is inserted to separate the magnetized layers from the semiconductor. 'ALQ3 is an organic semiconductor material,' said Lauter. 'Normally in these systems a first magnetic layer is grown on a hard substrate so that one can get the controlled magnetic parameters. Then you grow the organic semiconductor layer, followed by another magnetic material layer, such as cobalt.' In addition to determining the effect of the LiF layers on the efficiency of the electron injection, the researchers wanted to determine the magnetic properties of the cobalt and Ni{sub 80}Fe{sub 20} as well as the interfacial properties: whether there is interdiffusion of cobalt through the LiF layer to the semiconductor, for example. The researchers used polarized neutrons at beam line 4A to probe the entire, layer-by-layer assembly of the system. 'Reflectometry with polarized neutrons is a perfect method to study thin magnetic films,' Lauter said. 'These thin films - if you put one on a substrate, you see it just like a mirror. However, this mirror has a very complicated internal multilayer structure. The neutrons look inside this complicated structure and characterize each and every interface. Due to the depth sensitivity of the method, we measure the structural and magnetic properties of each layer with the resolution of 0.5 nm. The neutron scattering results found that inserting LiF as a barrier significantly improves the quality of the interface, increasing the injection of electrons from the

  1. Monte Carlo studies of TPP+ and BE+ arrangements in the interlayer and at the external surface of montmorillonite

    International Nuclear Information System (INIS)

    Jeschke, F.; Meleshyn, A.

    2010-01-01

    Document available in extended abstract form only. Unlike natural clay minerals, organically modified montmorillonite possesses a very high sorption capacity for anions, which favors its use for waste storage and sewage purposes. Understanding of this anion sorption requires a detailed knowledge about the underlying structure, which is only partially accessible with currently applied experimental methods. To get more structural information, Na-montmorillonite modified with tetraphenyl-phosphonium (TPP + , (C 6 H 5 ) 4 P + ) chloride or benzethonium (BE + , C 27 H 42 O 2 N + ) chloride was simulated using the Metropolis Monte Carlo method as extended by the configurational-bias procedure for flexible organic molecules. The simulated interlayer content of TPP + varied between 8% and 100% of CEC (cation exchange capacity). Two different initial arrangements of TPP + were considered, taking into account experimentally derived suggestions: 1) 'mono-facial' arrangement with three of the phenyl groups of all TPP + aligned to the same basal surface, and 2) 'bi-facial' arrangement with an equivalent distribution of phenyl groups between the two opposite basal surfaces of the montmorillonite. Pressure, temperature and number of particles were kept constant whereas the layer spacing was allowed to vary during the simulations. The OPLS-AA force field was used for calculation of the intermolecular and intramolecular interactions and Ewald summation was used to calculate the electrostatic interactions. The layer spacings, determined for the first arrangement, are between 17.4 A for the lowest and 19 A for the highest TPP + contents and show a very good agreement with experimental values. For this arrangement, a segregation of organic (TPP + ) and inorganic (Na + , Cl - and H 2 O) phases is observed. On the contrary, the simulated layer spacings for the second arrangement agree with the experimental data only for lower contents of TPP + . For higher contents

  2. Excessive users of violent video games do not show emotional desensitization: an fMRI study.

    Science.gov (United States)

    Szycik, Gregor R; Mohammadi, Bahram; Hake, Maria; Kneer, Jonas; Samii, Amir; Münte, Thomas F; Te Wildt, Bert T

    2017-06-01

    Playing violent video games have been linked to long-term emotional desensitization. We hypothesized that desensitization effects in excessive users of violent video games should lead to decreased brain activations to highly salient emotional pictures in emotional sensitivity brain regions. Twenty-eight male adult subjects showing excessive long-term use of violent video games and age and education matched control participants were examined in two experiments using standardized emotional pictures of positive, negative and neutral valence. No group differences were revealed even at reduced statistical thresholds which speaks against desensitization of emotion sensitive brain regions as a result of excessive use of violent video games.

  3. Monte Carlo study of a new I‐125 brachytherapy prototype seed with a ceramic radionuclide carrier and radiographic marker

    Science.gov (United States)

    Paixão, Lucas; Santos, Ana Maria M.; dos Santos, Adriano Márcio; Grynberg, Suely Epsztein

    2012-01-01

    In prostate cancer treatment, there is an increasing interest in the permanent radioactive seeds implant technique. Currently, in Brazil, the seeds are imported with high prices, which prohibit their use in public hospitals. A ceramic matrix that can be used as a radioisotope carrier and radiographic marker was developed at our institution. The ceramic matrix is distinguished by the characteristic of maintaining the radioactive material uniformly distributed in its surface. In this work, Monte Carlo simulations were performed in order to assess the dose distributions generated by this prototype seed model, with the ceramic matrix encapsulated in titanium, in the same way as the commercial 6711 seed. The obtained data was assessed, as described in the TG‐43U1 report by the American Association of Physicists in Medicine, for two seed models: (1) the most used model 6711 source — for validation and comparison, and (2) for the prototype model with the ceramic matrix. The dosimetric parameters dose rate constant, Λ, radial dose function, gL(r), and anisotropy function, F(r,θ), were derived from simulations by the Monte Carlo method using the MCNP5 code. A Λ 0.992 (±2.33%) cGyh−1U−1 was found for the prototype model. In comparison with the 6711 model, a lower dose fall‐off on transverse axis was found, as well as a lower dose anisotropy for the radius r= 0.25 cm. In general, for all distances, the prototype seed model presents a slightly larger anisotropy between 0° ≤ Θ < 50° and anisotropy similar to the 6711 model for Θ ≥ 50°. The dosimetric characteristics of the prototype model presented in this study suggest that its use is feasible. Because of the model's characteristics, seeds of lower specific activity iodine might be necessary which, on the other hand, would help to reduce costs. However, it has to be emphasized that the proposed source is a prototype, and the required (AAPM prerequisites) experimental study and tolerance

  4. Decomposition of a laser-Doppler spectrum for estimation of speed distribution of particles moving in an optically turbid medium: Monte Carlo validation study

    International Nuclear Information System (INIS)

    Liebert, A; Zolek, N; Maniewski, R

    2006-01-01

    A method for measurement of distribution of speed of particles moving in an optically turbid medium is presented. The technique is based on decomposition of the laser-Doppler spectrum. The theoretical background is shown together with the results of Monte Carlo simulations, which were performed to validate the proposed method. The laser-Doppler spectra were obtained by Monte Carlo simulations for assumed uniform and Gaussian speed distributions of particles moving in the turbid medium. The Doppler shift probability distributions were calculated by Monte Carlo simulations for several anisotropy factors of the medium, assuming the Hanyey-Greenstein phase function. The results of the spectra decomposition show that the calculated speed distribution of moving particles match well the distribution assumed for Monte Carlo simulations. This result was obtained for the spectra simulated in optical conditions, in which the photon is scattered with the Doppler shift not more than once during its travel between the source and detector. Influence of multiple scattering of the photon is analysed and a perspective of spectrum decomposition under such conditions is considered. Potential applications and limitations of the method are discussed

  5. Determination of the distal dose edge in a human phantom by measuring the prompt gamma distribution: a Monte Carlo study

    Energy Technology Data Exchange (ETDEWEB)

    Min, Chul Hee; Lee, Han Rim; Yeom, Yeon Su; Cho, Sung Koo; Kim, Chan Hyeong [Hanyang University, Seoul (Korea, Republic of)

    2010-06-15

    The close relationship between the proton dose distribution and the distribution of prompt gammas generated by proton-induced nuclear interactions along the path of protons in a water phantom was demonstrated by means of both Monte Carlo simulations and limited experiments. In order to test the clinical applicability of the method for determining the distal dose edge in a human body, a human voxel model, constructed based on a body-composition-approximated physical phantom, was used, after which the MCNPX code was used to analyze the energy spectra and the prompt gamma yields from the major elements composing the human voxel model; finally, the prompt gamma distribution, generated from the voxel model and measured by using an array-type prompt gamma detection system, was calculated and compared with the proton dose distribution. According to the results, effective prompt gammas were produced mainly by oxygen, and the specific energy of the prompt gammas, allowing for selective measurement, was found to be 4.44 MeV. The results also show that the distal dose edge in the human phantom, despite the heterogeneous composition and the complicated shape, can be determined by measuring the prompt gamma distribution with an array-type detection system.

  6. Study by Monte Carlo methods of an explosive detection system using a D-D generator and Nal (Tl) detectors

    International Nuclear Information System (INIS)

    Cevallos R, L. E.; Guzman G, K. A.; Gallego, E.; Garcia F, G.; Vega C, H. R.

    2017-10-01

    The detection of hidden explosive material is very important for national security. Using Monte Carlo methods, with the code MCNP6, several proposed configurations of a detection system with a Deuterium-Deuterium (D-D) generator, in conjunction with NaI (Tl) scintillation detectors, have been evaluated to intercept hidden explosives. The response of the system to various explosive samples such as Rdx and ammonium nitrate are analyzed as the main components of home-military explosives. The D-D generator produces fast neutrons of 2.5 MeV in a maximum field of 10 10 n/s (Dd-110) which is surrounded with high density polyethylene in order to thermalized the fast neutrons making them interact with the sample inspected, giving rise to the emission of gamma rays that generates a characteristic spectrum of the elements that constitute it, being able in this way to determine its chemical composition and identify the type of substance. The necessary shielding is evaluated to estimate the admissible operation dose, with thicknesses of lead and borated polyethylene, in order to place it at some point of the Laboratory of Neutron Measurements of the Polytechnic University of Madrid where the shielding is optimal. The results show that its functionality is promising in the field of national security for the explosives inspection. (Author)

  7. Mobility and stability of large vacancy and vacancy-copper clusters in iron: An atomistic kinetic Monte Carlo study

    Energy Technology Data Exchange (ETDEWEB)

    Castin, N., E-mail: ncastin@sckcen.be [Studiecentrum voor Kernenergie - Centre d' Etudes de l' energie Nucleaire (SCK-CEN), Nuclear Materials Science Institute, Unit Structural Materials Modelling and Microstructure-Boeretang 200, B2400 Mol (Belgium); Pascuet, M.I., E-mail: pascuet@cnea.gov.ar [Consejo Nacional de Investigaciones Cientificas y Tecnicas (CONICET), Av. Rivadavia 1917, C1033AAJ Buenos Aires (Argentina); Malerba, L. [Studiecentrum voor Kernenergie - Centre d' Etudes de l' energie Nucleaire (SCK-CEN), Nuclear Materials Science Institute, Unit Structural Materials Modelling and Microstructure-Boeretang 200, B2400 Mol (Belgium)

    2012-10-15

    The formation of Cu-rich precipitates under irradiation is a major cause for changes in the mechanical response to load of reactor pressure vessel steels. In previous works, it has been shown that the mechanism under which precipitation occurs is governed by diffusion of vacancy-copper (VCu) complexes, also in the absence of irradiation. Coarse-grained computer models (such as object kinetic Monte Carlo) aimed at simulating irradiation processes in model alloys or steels should therefore explicitly include the mobility of Cu precipitates, as a consequence of vacancy hops at their surface. For this purpose, in this work we calculate diffusion coefficients and lifetimes for a large variety of VCu complexes. We use an innovative atomistic model, where vacancy migration energies are calculated with little approximations, taking into account all effects of static relaxation and long-range chemical interaction as predicted by an interatomic potential. Our results show that, contrary to what intuition might suggest, saturation in vacancies tend to slow down the transport of Cu atoms.

  8. Monte Carlo Studies of a Novel LiF Radiator for RICH Detectors

    OpenAIRE

    Efimov, A.; Artuso, M.; Gao, Min; Mountain, R.; Muheim, F.; Mukhin, Y.; Playfer, S.

    1995-01-01

    We show that a multifaceted LiF radiator produces more Cherenkov light and has better resolution per photon than a flat radiator slab when used in a ring imaging Cherenkov counter. Such a system is being considered for the CLEO III upgrade.

  9. A case study of lightning attachment to flat ground showing multiple unconnected upward leaders

    Science.gov (United States)

    Cummins, Kenneth L.; Krider, E. Philip; Olbinski, Mike; Holle, Ronald L.

    2018-04-01

    On 10 July 2015, a cloud-to-ground (CG) lightning flash that produced two ground terminations was photographed from inside the safety of a truck in southern New Mexico. An analysis of archived NLDN data verified that this was a two-stroke flash, and a close-up view of the first stroke shows that it also initiated at least 12 unconnected, upward leaders (or "streamers") near the ground termination. No unconnected upward leaders were seen near the second ground attachment. After combining an analysis of the photograph with information provided by the NLDN, we infer that the first stroke was of negative (normal) polarity, had modest peak current, and struck about 460 m (± 24%) from the camera. Attachment occurred when an upward-propagating positive leader reached an inferred height of about 21 m above local ground. The second stroke struck ground about 740 m from the camera, and the height of its attachment leader is estimated to be 15 m. The estimated lengths of the unconnected upward leaders in the two-dimensional (2-D) plane of the first stroke range from 2 to 8 m, and all appear to be located within 15 m (2-D) of the main ground termination, with 24% uncertainty. Many of the unconnected upward leaders (inferred to be positive) exhibit multiple upward branches, and most of those branches have upward-directed forks or splits at their ends. This is the first report showing such extensive branching for positive upward leaders in natural lightning strikes to ground. None of the upward leaders can be seen to emanate from the tops of tall, isolated, or pointed objects on the ground, but they likely begin on small plants and rocks, or flat ground. In terms of lightning safety, this photo demonstrates that numerous upward leaders can be produced near a lightning strike point and have the potential to damage or cause injury at more than one specific point on the ground.

  10. Monte-Carlo method - codes for the study of criticality problems (on IBM 7094); Methode de Monte- Carlo - codes pour l'etude des problemes de criticite (IBM 7094)

    Energy Technology Data Exchange (ETDEWEB)

    Moreau, J; Rabot, H; Robin, C [Commissariat a l' Energie Atomique, Saclay (France). Centre d' Etudes Nucleaires

    1965-07-01

    The two codes presented here allow to determine the multiplication constant of media containing fissionable materials under numerous and divided forms; they are based on the Monte-Carlo method. The first code apply to x, y, z, geometries. The volume to be studied ought to be divisible in parallelepipeds, the media within each parallelepiped being limited by non-secant surfaces. The second code is intended for r, 0, z geometries. The results include an analysis of collisions in each medium. Applications and examples with informations on time and accuracy are given. (authors) [French] Les deux codes presentes dans ce rapport permettent la determination des coefficients de multiplication de milieux contenant des matieres fissiles sous des formes tres variees et divisees, ils reposent sur la methode de Monte-Carlo. Le premier code s'applique aux geometries x, y, z, le volume a etudier doit pouvoir etre decompose en parallelepipedes, les milieux a l'interieur de chaque parallelepipede etant limites par des surfaces non secantes. Le deuxieme code s'applique aux geometries r, 0, z. Les resultats comportent une analyse des collisions dans chaque milieu. Des applications et des exemples avec les indications de temps et de precision sont fournis. (auteurs)

  11. Photon penetration depth in human brain for light stimulation and treatment: A realistic Monte Carlo simulation study

    Directory of Open Access Journals (Sweden)

    Ting Li

    2017-09-01

    Full Text Available Light has been clinically utilized as a stimulation in medical treatment, such as Low-level laser therapy and photodynamic therapy, which has been more and more widely accepted in public. The penetration depth of the treatment light is important for precision treatment and safety control. The issue of light penetration has been highlighted in biomedical optics field for decades. However, quantitative research is sparse and even there are conflicts of view on the capability of near-infrared light penetration into brain tissue. This study attempts to quantitatively revisit this issue by innovative high-realistic 3D Monte Carlo modeling of stimulated light penetration within high-precision Visible Chinese human head. The properties of light, such as its wavelength, illumination profile and size are concern in this study. We made straightforward and quantitative comparisons among the effects by the light properties (i.e., wavelengths: 660, 810 and 980nm; beam types: Gaussian and flat beam; beam diameters: 0, 2, 4 and 6cm which are in the range of light treatment. The findings include about 3% of light dosage within brain tissue; the combination of Gaussian beam and 810nm light make the maximum light penetration (>5cm, which allows light to cross through gray matter into white mater. This study offered us, the first time as we know, quantitative guide for light stimulation parameter optimization in medical treatment.

  12. New study shows normally helpful natural bacteria may also trigger lupus | Center for Cancer Research

    Science.gov (United States)

    CCR scientists have discovered that a protein produced by bacteria that naturally inhabit our bodies may trigger the autoimmune disease lupus. The results of the study could unveil an entirely new set of drug targets for treating lupus and other autoimmune diseases. Read more…

  13. Older Adults Show Deficits in Retrieving and Decoding Associative Mediators Generated at Study

    Science.gov (United States)

    Hertzog, Christopher; Fulton, Erika K.; Mandviwala, Lulua; Dunlosky, John

    2013-01-01

    We instructed the use of mediators to encode paired-associate items, and then measured both cued recall of targets and mediators. Older adults (n = 49) and younger adults (n = 57) studied a mixed list of concrete and abstract noun pairs under instructions to either generate a sentence or an image to form a new association between normatively…

  14. Study of medication-free children with Tourette syndrome do not show imaging abnormalities

    DEFF Research Database (Denmark)

    Jeppesen, Signe Søndergaard; Debes, Nanette Mol; Simonsen, Helle Juhl

    2014-01-01

    BACKGROUND: Imaging studies of patients with Tourette's syndrome (TS) across different cohorts have shown alterations in gray and white matter in areas associated with the cortico-striato-thalamic-cortical (CSTC) pathways; however, no consistent findings have subsequently established a clear...

  15. Affiliation, joint venture or PSO? Case studies show why provider strategies differ.

    Science.gov (United States)

    1998-03-01

    Joint venture, affiliation or PSO? Here are three case studies of providers who chose different paths under Medicare risk, plus some key questions you'll want to ask of your own provider organization. Learn from these examples so you'll make the best contracting decisions.

  16. Material Rhetoric: Spreading Stones and Showing Bones in the Study of Prehistory

    NARCIS (Netherlands)

    Van Reybrouck, D.; de Bont, R.; Rock, J.

    2009-01-01

    Since the linguistic turn, the role of rhetoric in the circulation and the popular representation of knowledge has been widely accepted in science studies. This article aims to analyze not a textual form of scientific rhetoric, but the crucial role of materiality in scientific debates. It introduces

  17. Modelling of a linear accelerator VARIAN 600 C/D for dosimetric study using the Monte Carlo Method

    International Nuclear Information System (INIS)

    Cancino, Jorge Luis Batista

    2016-01-01

    Based on the high availability of low energy linear accelerators in Brazil and with the goal of developing a reliable tool for dose distribution calculations in radiotherapy; this research aims to validate a linear accelerator head model using MCNP Monte Carlo code. The Varian 600 C/D linear accelerator installed at the Hospital São João de is taken as reference. The main components of the linear accelerator head were simulated based on detailed information of the manufacturer. In order to calculate dose distribution, a water phantom with dimensions of 30 x 30 x 30 cm 3 was simulated and placed at 100 cm of source-surface distance. A monoenergetic electron beam of 6,3 MeV was considered as a source. The number of primary particles used in the simulation was 10 8 . A Phase-Space Surface was used to scoring the photon spectrum below the tungsten target. Others two were placed in the model in order to reduce computational time and improve statistical accuracy. In order to validate the developed model, the X-ray spectrum generated by Bremsstrahlung was calculated and analyzed. Furthermore, the results of percentage depth doses and beam profiles calculations were compared with available measurements. The MCNP calculations results were compared to measurement showing good agreement between them. The comparison between MCNP calculations and measurement of PDD showed reasonable coherence at build-up region. The results were in an acceptable interval of confidence at the flat region of beam profiles comparison for three different field sizes. In this work, we compared MCNP calculations to experimental data in order to validate the developed LINAC head model. The results showed a good agreement according to the recommended criteria. The developed model was validated as an accurate tool for LINAC quality control procedures. (author)

  18. A morphometric CT study of Down's syndrome showing small posterior fossa and calcification of basal ganglia

    International Nuclear Information System (INIS)

    Ieshima, A.; Yoshino, K.; Takashima, S.; Takeshita, K.; Kisa, T.

    1984-01-01

    We report characteristic and morphometric changes of cranial computed tomography (CT) with increasing age in 56 patients with Down's syndrome aged from 0 month to 37 years. Patients were compared with 142 normal controls aged 0 to 59 years. Width of ventricles, Sylvian fissures, posterior fossa, pons and cisterna magna were measured on CT. The incidences of the cavum septi pellucidi, cavum vergae and cavum veli interpositi and high density in the basal ganglia were examined. There was high incidence (10.7%) of bilateral calcification of basal ganglia in Down's syndrome, although that of pineal body and choroid plexus calcification was similar in Down's syndrome and controls. Basal ganglia calcification is more frequently seen in young Down's syndrome and may be related to the premature aging characteristic of Down's syndrome. The CT in Down's syndrome showed relatively small posterior fossa, small cerebellum, small brain stem and relatively large Sylvian fissures in those under one year of age. There was a high frequency of midline cava and large cisterna magna. There were no significant atrophic changes on CT except after the fifth decade comparing with controls. (orig.)

  19. Analysis of allergen immunotherapy studies shows increased clinical efficacy in highly symptomatic patients

    DEFF Research Database (Denmark)

    Howarth, P; Malling, Hans-Jørgen; Molimard, M

    2011-01-01

    them. Thus, clinical studies of AIT can neither establish baseline symptom levels nor limit the enrolment of patients to those with the most severe symptoms. Allergen immunotherapy treatment effects are therefore diluted by patients with low symptoms for a particular pollen season. The objective...... tertiles). The difference observed in the average score in each tertile in active vs placebo-treated patients was assessed. This allowed an estimation of the efficacy that could be achieved in patients from sites where symptoms were high during the pollen season. Results:  An increased treatment effect...... of this analysis was to assess the effect possible to achieve with AIT in the groups of patients presenting the most severe allergic symptoms. Methods:  Study centres were grouped into tertiles categorized according to symptom severity scores observed in the placebo patients in each centre (low, middle and high...

  20. Evaluation of reconstruction techniques in regional cerebral blood flow SPECT using trade-off plots: a Monte Carlo study.

    Science.gov (United States)

    Olsson, Anna; Arlig, Asa; Carlsson, Gudrun Alm; Gustafsson, Agnetha

    2007-09-01

    The image quality of single photon emission computed tomography (SPECT) depends on the reconstruction algorithm used. The purpose of the present study was to evaluate parameters in ordered subset expectation maximization (OSEM) and to compare systematically with filtered back-projection (FBP) for reconstruction of regional cerebral blood flow (rCBF) SPECT, incorporating attenuation and scatter correction. The evaluation was based on the trade-off between contrast recovery and statistical noise using different sizes of subsets, number of iterations and filter parameters. Monte Carlo simulated SPECT studies of a digital human brain phantom were used. The contrast recovery was calculated as measured contrast divided by true contrast. Statistical noise in the reconstructed images was calculated as the coefficient of variation in pixel values. A constant contrast level was reached above 195 equivalent maximum likelihood expectation maximization iterations. The choice of subset size was not crucial as long as there were > or = 2 projections per subset. The OSEM reconstruction was found to give 5-14% higher contrast recovery than FBP for all clinically relevant noise levels in rCBF SPECT. The Butterworth filter, power 6, achieved the highest stable contrast recovery level at all clinically relevant noise levels. The cut-off frequency should be chosen according to the noise level accepted in the image. Trade-off plots are shown to be a practical way of deciding the number of iterations and subset size for the OSEM reconstruction and can be used for other examination types in nuclear medicine.

  1. Correlation of electron transport and photocatalysis of nanocrystalline clusters studied by Monte-Carlo continuity random walking.

    Science.gov (United States)

    Liu, Baoshun; Li, Ziqiang; Zhao, Xiujian

    2015-02-21

    In this research, Monte-Carlo Continuity Random Walking (MC-RW) model was used to study the relation between electron transport and photocatalysis of nano-crystalline (nc) clusters. The effects of defect energy disorder, spatial disorder of material structure, electron density, and interfacial transfer/recombination on the electron transport and the photocatalysis were studied. Photocatalytic activity is defined as 1/τ from a statistical viewpoint with τ being the electron average lifetime. Based on the MC-RW simulation, a clear physical and chemical "picture" was given for the photocatalytic kinetic analysis of nc-clusters. It is shown that the increase of defect energy disorder and material spatial structural disorder, such as the decrease of defect trap number, the increase of crystallinity, the increase of particle size, and the increase of inter-particle connection, can enhance photocatalytic activity through increasing electron transport ability. The increase of electron density increases the electron Fermi level, which decreases the activation energy for electron de-trapping from traps to extending states, and correspondingly increases electron transport ability and photocatalytic activity. Reducing recombination of electrons and holes can increase electron transport through the increase of electron density and then increases the photocatalytic activity. In addition to the electron transport, the increase of probability for electrons to undergo photocatalysis can increase photocatalytic activity through the increase of the electron interfacial transfer speed.

  2. Physical limits to autofluorescence signals in vivo recordings in the rat olfactory bulb: a Monte Carlo study

    Science.gov (United States)

    L'Heureux, B.; Gurden, H.; Pinot, L.; Mastrippolito, R.; Lefebvre, F.; Lanièce, P.; Pain, F.

    2007-07-01

    Understanding the cellular mechanisms of energy supply to neurons following physiological activation is still challenging and has strong implications to the interpretation of clinical functional images based on metabolic signals such as Blood Oxygen Level Dependent Magnetic Resonance Imaging or 18F-Fluorodexoy-Glucose Positron Emission Tomography. Intrinsic Optical Signal Imaging provides with high spatio temporal resolution in vivo imaging in the anaesthetized rat. In that context, intrinsic signals are mainly related to changes in the optical absorption of haemoglobin depending on its oxygenation state. This technique has been validated for imaging of the rat olfactory bulb, providing with maps of the actived olfactory glomeruli, the functional modules involved in the first step of olfactory coding. A complementary approach would be autofluorescence imaging relying on the fluorescence properties of endogenous Flavin Adenine Dinucleotide (FAD) or Nicotinamide Adenine Dinucleotide (NADH) both involved in intracellular metabolic pathways. The purpose of the present study was to investigate the feasibility of in vivo autofluorescence imaging in the rat olfactory bulb. We performed standard Monte Carlo simulations of photons scattering and absorption at the excitation and emission wavelengths of FAD and NADH fluorescence. Characterization of the fluorescence distribution in the glomerulus, effect of hemoglobin absorption at the excitation and absorption wavelengths as well as the effect of the blurring due to photon scattering and the depth of focus of the optical apparatus have been studied. Finally, optimal experimental parameters are proposed to achieve in vivo validation of the technique in the rat olfactory bulb.

  3. Distribution network design under demand uncertainty using genetic algorithm and Monte Carlo simulation approach: a case study in pharmaceutical industry

    Science.gov (United States)

    Izadi, Arman; Kimiagari, Ali Mohammad

    2014-05-01

    Distribution network design as a strategic decision has long-term effect on tactical and operational supply chain management. In this research, the location-allocation problem is studied under demand uncertainty. The purposes of this study were to specify the optimal number and location of distribution centers and to determine the allocation of customer demands to distribution centers. The main feature of this research is solving the model with unknown demand function which is suitable with the real-world problems. To consider the uncertainty, a set of possible scenarios for customer demands is created based on the Monte Carlo simulation. The coefficient of variation of costs is mentioned as a measure of risk and the most stable structure for firm's distribution network is defined based on the concept of robust optimization. The best structure is identified using genetic algorithms and 14 % reduction in total supply chain costs is the outcome. Moreover, it imposes the least cost variation created by fluctuation in customer demands (such as epidemic diseases outbreak in some areas of the country) to the logistical system. It is noteworthy that this research is done in one of the largest pharmaceutical distribution firms in Iran.

  4. Monte Carlo study of the hull distribution for the q = 1 Brauer model

    NARCIS (Netherlands)

    Kager, W.; Nienhuis, B.

    2006-01-01

    We study a special case of the Brauer model in which every path of the model has weight q = 1. The model has been studied before as a solvable lattice model and can be viewed as a Lorentz lattice gas. The paths of the model are also called self-avoiding trails. We consider the model in a triangle

  5. 'Show me the money': financial incentives increase chlamydia screening rates among tertiary students: a pilot study.

    Science.gov (United States)

    Currie, Marian J; Schmidt, Matthias; Davis, Belinda K; Baynes, Anne M; O'Keefe, Elissa J; Bavinton, Tim P; McNiven, Michelle; Martin, Sarah J; Bowden, Francis J

    2010-03-01

    We hypothesise that text-messaging and financial incentives would increase tertiary student participation in chlamydia screening. A cross-sectional study was conducted over two phases on eight tertiary campuses during 2007. During Phase 1 (6 months) study activities were advertised through student organisations and media. Education and screening were offered during a range of student activities. During Phase 2 (4 days) education and screening were offered via text messages. Non-financial incentives were offered during Phase 1 and a $10 cash incentive was offered during Phase 2. Rates of specimens provided by students and the direct costs incurred during each phase were compared. 2786 students attended the 31 activities conducted in Phase 1. Of these, 627 students (22.5%) provided urine specimens for chlamydia testing. During Phase 2, the dissemination of 866 text messages resulted in urine specimens from 392 students (45.3%). Costs per test were AUD $175.11 in Phase 1 and AUD $27.13 in Phase 2. Compared with more labour intensive (and therefore more expensive) screening activities conducted over a 6-month period, offering a small financial incentive to tertiary students through text messaging over a 4-day period significantly increased participation in on-campus chlamydia screening. This model could readily be applied to other populations to increase participation in chlamydia screening.

  6. Monte Carlo simulation study of the positron contribution to displacements per atom production in YBCO superconductors

    International Nuclear Information System (INIS)

    Pinera, I.; Cruz, C.M.; Abreu, Y.; Leyva, A.

    2008-01-01

    The contribution from positrons to the displacements per atom (dpa) distribution induced by the gamma irradiation on YBCO superconducting slabs is presented. The procedure implemented previously by the authors was adapted to take into account the contribution from positrons to dpa induced by the gamma radiation. The results show that, when positrons are considered in the atom displacement process, the total dpa almost doubles at 10 MeV of incident gamma radiation. At that energy positrons contribute 7% more to the total dpa than electrons, although electrons maintain having the highest contribution up to about 8 MeV.

  7. Dosimetric impact of dual-energy CT tissue segmentation for low-energy prostate brachytherapy: a Monte Carlo study

    Science.gov (United States)

    Remy, Charlotte; Lalonde, Arthur; Béliveau-Nadeau, Dominic; Carrier, Jean-François; Bouchard, Hugo

    2018-01-01

    The purpose of this study is to evaluate the impact of a novel tissue characterization method using dual-energy over single-energy computed tomography (DECT and SECT) on Monte Carlo (MC) dose calculations for low-dose rate (LDR) prostate brachytherapy performed in a patient like geometry. A virtual patient geometry is created using contours from a real patient pelvis CT scan, where known elemental compositions and varying densities are overwritten in each voxel. A second phantom is made with additional calcifications. Both phantoms are the ground truth with which all results are compared. Simulated CT images are generated from them using attenuation coefficients taken from the XCOM database with a 100 kVp spectrum for SECT and 80 and 140Sn kVp for DECT. Tissue segmentation for Monte Carlo dose calculation is made using a stoichiometric calibration method for the simulated SECT images. For the DECT images, Bayesian eigentissue decomposition is used. A LDR prostate brachytherapy plan is defined with 125I sources and then calculated using the EGSnrc user-code Brachydose for each case. Dose distributions and dose-volume histograms (DVH) are compared to ground truth to assess the accuracy of tissue segmentation. For noiseless images, DECT-based tissue segmentation outperforms the SECT procedure with a root mean square error (RMS) on relative errors on dose distributions respectively of 2.39% versus 7.77%, and provides DVHs closest to the reference DVHs for all tissues. For a medium level of CT noise, Bayesian eigentissue decomposition still performs better on the overall dose calculation as the RMS error is found to be of 7.83% compared to 9.15% for SECT. Both methods give a similar DVH for the prostate while the DECT segmentation remains more accurate for organs at risk and in presence of calcifications, with less than 5% of RMS errors within the calcifications versus up to 154% for SECT. In a patient-like geometry, DECT-based tissue segmentation provides dose

  8. A comparison of the relative biological effectiveness of low energy electronic brachytherapy sources in breast tissue: a Monte Carlo study.

    Science.gov (United States)

    White, Shane A; Reniers, Brigitte; de Jong, Evelyn E C; Rusch, Thomas; Verhaegen, Frank

    2016-01-07

    Electronic brachytherapy sources use low energy photons to treat the tumor bed during or after breast-conserving surgery. The relative biological effectiveness of two electronic brachytherapy sources was explored to determine if spectral differences due to source design influenced radiation quality and if radiation quality decreased with distance in the breast. The RBE was calculated through the number of DNA double strand breaks (RBEDSB) using the Monte Carlo damage simulator (MCDS) in combination with other Monte Carlo electron/photon spectrum calculations. 50kVp photons from the Intrabeam (Carl Zeiss Surgical) and Axxent (Xoft) through 40-mm spherical applicators were simulated to account for applicator and tissue attenuation in a variety of breast tissue compositions. 40kVp Axxent photons were also simulated. Secondary electrons (known to be responsible for most DNA damage) spectra at different distance were inputted into MCDS to calculate the RBEDSB. All RBEDSB used a cobalt-60 reference. RBEDSB data was combined with corresponding average photon spectrum energy for the Axxent and applied to model-based average photon energy distributions to produce an RBEDSB map of an accelerated partial breast irradiation (APBI) patient. Both Axxent and Intrabeam 50kVp spectra were shown to have a comparable RBEDSB of between 1.4 and 1.6 at all distances in spite of progressive beam hardening. The Axxent 40kVp also demonstrated a similar RBEDSB at distances. Most RBEDSB variability was dependent on the tissue type as was seen in rib (RBEDSB  ≈  1.4), gland (≈1.55), adipose (≈1.59), skin (≈1.52) and lung (≈1.50). RBEDSB variability between both sources was within 2%. A correlation was shown between RBEDSB and average photon energy and used to produce an RBEDSB map of a dose distribution in an APBI patient dataset. Radiation quality is very similar between electronic brachytherapy sources studied. No significant reductions in RBEDSB were observed with

  9. Effect of Different Sampling Schedules on Results of Bioavailability and Bioequivalence Studies: Evaluation by Means of Monte Carlo Simulations.

    Science.gov (United States)

    Kano, Eunice Kazue; Chiann, Chang; Fukuda, Kazuo; Porta, Valentina

    2017-08-01

    Bioavailability and bioequivalence study is one of the most frequently performed investigations in clinical trials. Bioequivalence testing is based on the assumption that 2 drug products will be therapeutically equivalent when they are equivalent in the rate and extent to which the active drug ingredient or therapeutic moiety is absorbed and becomes available at the site of drug action. In recent years there has been a significant growth in published papers that use in silico studies based on mathematical simulations to analyze pharmacokinetic and pharmacodynamic properties of drugs, including bioavailability and bioequivalence aspects. The goal of this study is to evaluate the usefulness of in silico studies as a tool in the planning of bioequivalence, bioavailability and other pharmacokinetic assays, e.g., to determine an appropriate sampling schedule. Monte Carlo simulations were used to define adequate blood sampling schedules for a bioequivalence assay comparing 2 different formulations of cefadroxil oral suspensions. In silico bioequivalence studies comparing different formulation of cefadroxil oral suspensions using various sampling schedules were performed using models. An in vivo study was conducted to confirm in silico results. The results of in silico and in vivo bioequivalence studies demonstrated that schedules with fewer sampling times are as efficient as schedules with larger numbers of sampling times in the assessment of bioequivalence, but only if T max is included as a sampling time. It was also concluded that in silico studies are useful tools in the planning of bioequivalence, bioavailability and other pharmacokinetic in vivo assays. © Georg Thieme Verlag KG Stuttgart · New York.

  10. Feasibility Study on the Development of Index that Shows Social and Cultural Acceptance of Nuclear Power

    International Nuclear Information System (INIS)

    Cho, SeongKyung; Choi, Seungho; Yoon, Hana; Song, Jiyeon

    2015-01-01

    In this context, it is necessary to manage and develop an index that can measure the level of public acceptance by establishing the terms of social/cultural public acceptance of nuclear power in a practical manner and by identifying influential factors of public acceptance. Developing an index itself is not intended to increase the public acceptance of nuclear power. This study intends to contribute to determining energy policy acceptable to the public by estimating the level of potential social conflicts related to nuclear power policies with eligible evaluation criteria on social/cultural acceptance and by reducing relevant social costs. Key conclusions and proposal of this research are as follows. First, the influential factors of acceptance are reliability of nuclear safety, risk perception of nuclear power and beneficial perception of nuclear power. Among them, reliability of nuclear safety appears to have the most influence. In addition, benefit perception of nuclear power at the social level is significantly higher than that at the individual level. However, in relation to risk perception, a gap between experts and the public is found as nuclear industry premises that accident does not occur while the public premises that accident may occur

  11. Radiance Assimilation Shows Promise for Snowpack Characterization: A 1-D Case Study

    Science.gov (United States)

    Durand, Michael; Kim, Edward; Margulis, Steve

    2008-01-01

    We demonstrate an ensemble-based radiometric data assimilation (DA) methodology for estimating snow depth and snow grain size using ground-based passive microwave (PM) observations at 18.7 and 36.5 GHz collected during the NASA CLPX-1, March 2003, Colorado, USA. A land surface model was used to develop a prior estimate of the snowpack states, and a radiative transfer model was used to relate the modeled states to the observations. Snow depth bias was -53.3 cm prior to the assimilation, and -7.3 cm after the assimilation. Snow depth estimated by a non-DA-based retrieval algorithm using the same PM data had a bias of -18.3 cm. The sensitivity of the assimilation scheme to the grain size uncertainty was evaluated; over the range of grain size uncertainty tested, the posterior snow depth estimate bias ranges from -2.99 cm to -9.85 cm, which is uniformly better than both the prior and retrieval estimates. This study demonstrates the potential applicability of radiometric DA at larger scales.

  12. Feasibility Study on the Development of Index that Shows Social and Cultural Acceptance of Nuclear Power

    Energy Technology Data Exchange (ETDEWEB)

    Cho, SeongKyung [Bangmok College of General Education at Myongji Univ., Yongin (Korea, Republic of); Choi, Seungho; Yoon, Hana; Song, Jiyeon [Domo Brodeur, Seoul (Korea, Republic of)

    2015-05-15

    In this context, it is necessary to manage and develop an index that can measure the level of public acceptance by establishing the terms of social/cultural public acceptance of nuclear power in a practical manner and by identifying influential factors of public acceptance. Developing an index itself is not intended to increase the public acceptance of nuclear power. This study intends to contribute to determining energy policy acceptable to the public by estimating the level of potential social conflicts related to nuclear power policies with eligible evaluation criteria on social/cultural acceptance and by reducing relevant social costs. Key conclusions and proposal of this research are as follows. First, the influential factors of acceptance are reliability of nuclear safety, risk perception of nuclear power and beneficial perception of nuclear power. Among them, reliability of nuclear safety appears to have the most influence. In addition, benefit perception of nuclear power at the social level is significantly higher than that at the individual level. However, in relation to risk perception, a gap between experts and the public is found as nuclear industry premises that accident does not occur while the public premises that accident may occur.

  13. A Monte Carlo Study on Multiple Output Stochastic Frontiers: Comparison of Two Approaches

    DEFF Research Database (Denmark)

    Henningsen, Geraldine; Henningsen, Arne; Jensen, Uwe

    , dividing all other output quantities by the selected output quantity, and using these ratios as regressors (OD). Another approach is the stochastic ray production frontier (SR) which transforms the output quantities into their Euclidean distance as the dependent variable and their polar coordinates......In the estimation of multiple output technologies in a primal approach, the main question is how to handle the multiple outputs. Often an output distance function is used, where the classical approach is to exploit its homogeneity property by selecting one output quantity as the dependent variable...... of both specifications for the case of a Translog output distance function with respect to different common statistical problems as well as problems arising as a consequence of zero values in the output quantities. Although, our results partly show clear reactions to statistical misspecifications...

  14. The practical use and application of Monte-Carlo studies in physical vapour deposition technology

    International Nuclear Information System (INIS)

    Elsing, R.

    1991-01-01

    Most of the theory of physical vapour deposition processes has been well researched. There has, however, been little attempt to exploit the theoretical results of this research for practical development of these technologies. This paper develops a computer model for the magnetron sputter ion plating process, in which known physical laws are combined with geometry models of the kind used in computer-aided design technology. The model enables deposition rates and incidence angle distributions to be described for any desired substrate geometry and configuration, taking into account the dominant process parameters. Deposition rates and incidence angle distributions are computed for various film materials and process parameters and are compared with measured values, indicating excellent agreement. A final example shows the dependence of film thickness distribution at the bottom of a slot on a notched component on the geometrical nature of the workpiece itself and on its positioning in the process space. (orig.)

  15. Monte Carlo study of magnetic nanoparticles adsorbed on halloysite Al2Si2O5(OH) 4 nanotubes

    Science.gov (United States)

    Sotnikov, O. M.; Mazurenko, V. V.; Katanin, A. A.

    2017-12-01

    We study properties of magnetic nanoparticles adsorbed on the halloysite surface. For that a distinct magnetic Hamiltonian with a random distribution of spins on a cylindrical surface was solved by using a nonequilibrium Monte Carlo method. The parameters for our simulations, the anisotropy constant, nanoparticle size distribution, saturated magnetization, and geometrical characteristics of the halloysite template, were taken from recent experiments. We calculate the hysteresis loops and temperature dependence of the zero-field-cooling (ZFC) susceptibility, the maximum of which determines the blocking temperature. It is shown that the dipole-dipole interaction between nanoparticles moderately increases the blocking temperature and weakly increases the coercive force. The obtained hysteresis loops (e.g., the value of the coercive force) for Ni nanoparticles are in reasonable agreement with the experimental data. We also discuss the sensitivity of the hysteresis loops and ZFC susceptibilities to the change in anisotropy and dipole-dipole interaction, as well as the 3 d -shell occupation of the metallic nanoparticles; in particular we predict larger coercive force for Fe than for Ni nanoparticles.

  16. Study of the transport phenomena in III-V materials by the Monte Carlo method: application to INAS

    International Nuclear Information System (INIS)

    Bouazza, B.; Amer, L.; Guen-Bouazza, A.; Sayeh, C.; Chabanne-Sari, N.E.; Gontrand, C.

    2004-01-01

    Full text.The microelectronic comprehension of the phenomena which describes the behavior of the carriers in semiconductor materials requires the knowledge of energy distribution function. This distribution function is obtained by the resolution of Boltzmann equation which is very hard to solve analytically. Other methods based on modeling are actually successfully used to solve this equation. This Monte Carlo method is among of the most methods used for studying electronics components operations. It consists to follow the evolution of electron packets in real space, where each electron subjected to the electric field present in material goes interact with the crystal lattice. It is therefore an iterative process made up from a whole coasting flights stopped by acoustics interactions, polar and non polar optics, piezoelectric, inter-valley, impurity, ionization and surface. By applying this method to the III-V material: InAs. We can describe the behavior of the carriers from dynamic and energetic point of view (variation speed according to the field). The simulation is applied, taking into account variation of the carriers according to time in the non stationary mode, and the effect of temperature, and measurements doping. Results obtained are shown to be comparable to those of the theory

  17. Hydroxyethylamine derivatives as HIV-1 protease inhibitors: a predictive QSAR modelling study based on Monte Carlo optimization.

    Science.gov (United States)

    Bhargava, S; Adhikari, N; Amin, S A; Das, K; Gayen, S; Jha, T

    2017-12-01

    Application of HIV-1 protease inhibitors (as an anti-HIV regimen) may serve as an attractive strategy for anti-HIV drug development. Several investigations suggest that there is a crucial need to develop a novel protease inhibitor with higher potency and reduced toxicity. Monte Carlo optimized QSAR study was performed on 200 hydroxyethylamine derivatives with antiprotease activity. Twenty-one QSAR models with good statistical qualities were developed from three different splits with various combinations of SMILES and GRAPH based descriptors. The best models from different splits were selected on the basis of statistically validated characteristics of the test set and have the following statistical parameters: r 2 = 0.806, Q 2 = 0.788 (split 1); r 2 = 0.842, Q 2 = 0.826 (split 2); r 2 = 0.774, Q 2 = 0.755 (split 3). The structural attributes obtained from the best models were analysed to understand the structural requirements of the selected series for HIV-1 protease inhibitory activity. On the basis of obtained structural attributes, 11 new compounds were designed, out of which five compounds were found to have better activity than the best active compound in the series.

  18. Study on the tongue and groove effect of the elekta multileaf collimator using Monte Carlo simulation and film dosimetry

    Energy Technology Data Exchange (ETDEWEB)

    Haryanto, F.; Fippel, M.; Bakai, A.; Nuesslin, F. [Dept. of Medical Physics, Radiooncologic Univ. Clinic, Tuebingen (Germany)

    2004-01-01

    Background: nowadays, multileaf collimation of the treatment fields from medical linear accelerators is a common option. Due to the design of the leaf sides, the tongue and groove effect occurs for certain multileaf collimator applications such as the abutment of fields where the beam edges are defined by the sides of the leaves. Material and methods: in this study, the tongue and groove effect was measured for two pairs of irregular multileaf collimator fields that were matched along leaf sides in two steps. Measurements were made at 10 cm depth in a polystyrene phantom using Kodak EDR2 films for a photon beam energy of 6 MV on an elekta sli-plus accelerator. To verify the measurements, full Monte Carlo simulations were done. In the simulations, the design of the leaf sides was taken into account and one component module of BEAM code was modified to correctly simulate the elekta multileaf collimator. Results and conclusion: the results of measurements and simulations are in good agreement and within the tolerance of film dosimetry. (orig.)

  19. Monte Carlo simulation studies for the determination of microcalcification thickness and glandular ratio through dual-energy mammography

    Science.gov (United States)

    Del Lama, L. S.; Godeli, J.; Poletti, M. E.

    2017-08-01

    The majority of breast carcinomas can be associated to the presence of calcifications before the development of a mass. However, the overlapping tissues can obscure the visualization of microcalcification clusters due to the reduced contrast-noise ratio (CNR). In order to overcome this complication, one potential solution is the use of the dual-energy (DE) technique, in which two different images are acquired at low (LE) and high (HE) energies or kVp to highlight specific lesions or cancel out tissue background. In this work, the DE features were computationally studied considering simulated acquisitions from a modified PENELOPE Monte Carlo code. The employed irradiation geometry considered typical distances used in digital mammography, a CsI detection system and an updated breast model composed of skin, microcalcifications and glandular and adipose tissues. The breast thickness ranged from 2 to 6 cm with glandularities of 25%, 50% and 75%, where microcalcifications with dimensions from 100 up to 600 μm were positioned. In general, results pointed an efficiency index better than 87% for the microcalcification thicknesses and better than 95% for the glandular ratio. The simulations evaluated in this work can be used to optimize the elements from the DE imaging chain, in order to become a complementary tool for the conventional single-exposure images, especially for the visualization and estimation of calcification thicknesses and glandular ratios.

  20. A Monte Carlo study of the energy spectra and transmission characteristics of scattered radiation from x-ray computed tomography.

    Science.gov (United States)

    Platten, David John

    2014-06-01

    Existing data used to calculate the barrier transmission of scattered radiation from computed tomography (CT) are based on primary beam CT energy spectra. This study uses the EGSnrc Monte Carlo system and Epp user code to determine the energy spectra of CT scatter from four different primary CT beams passing through an ICRP 110 male reference phantom. Each scatter spectrum was used as a broad-beam x-ray source in transmission simulations through seventeen thicknesses of lead (0.00-3.50 mm). A fit of transmission data to lead thickness was performed to obtain α, β and γ parameters for each spectrum. The mean energy of the scatter spectra were up to 12.3 keV lower than that of the primary spectrum. For 120 kVp scatter beams the transmission through lead was at least 50% less than predicted by existing data for thicknesses of 1.5 mm and greater; at least 30% less transmission was seen for 140 kVp scatter beams. This work has shown that the mean energy and half-value layer of CT scatter spectra are lower than those of the corresponding primary beam. The transmission of CT scatter radiation through lead is lower than that calculated with currently available data. Using the data from this work will result in less lead shielding being required for CT scanner installations.

  1. Monte Carlo studies of thermalization of electron-hole pairs in spin-polarized degenerate electron gas in monolayer graphene

    Science.gov (United States)

    Borowik, Piotr; Thobel, Jean-Luc; Adamowicz, Leszek

    2018-02-01

    Monte Carlo method is applied to the study of relaxation of excited electron-hole (e-h) pairs in graphene. The presence of background of spin-polarized electrons, with high density imposing degeneracy conditions, is assumed. To such system, a number of e-h pairs with spin polarization parallel or antiparallel to the background is injected. Two stages of relaxation: thermalization and cooling are clearly distinguished when average particles energy and its standard deviation σ _E are examined. At the very beginning of thermalization phase, holes loose energy to electrons, and after this process is substantially completed, particle distributions reorganize to take a Fermi-Dirac shape. To describe the evolution of and σ _E during thermalization, we define characteristic times τ _ {th} and values at the end of thermalization E_ {th} and σ _ {th}. The dependence of these parameters on various conditions, such as temperature and background density, is presented. It is shown that among the considered parameters, only the standard deviation of electrons energy allows to distinguish between different cases of relative spin polarizations of background and excited electrons.

  2. Development of a tri dimensional Monte Carlo code for the study of the microdosimetry in boron neutron capture therapy

    International Nuclear Information System (INIS)

    Santa Cruz, G.A.

    1998-01-01

    Full text: A charged particles transport Monte Carlo code, specially designed for the boron neutron capture therapy microdosimetry study was developed. The code allows the use of real tri dimensional problem geometry, using serial microscopy slides from a biological substrate where the 10 B(n, Alpha) 7 Li, 14 N(n,p) 14 C reactions and events can occur. The spatial distribution of sources ( 10 B, 14 N concentrations), regions of interest (where the energy deposition, linear energy transfer and other parameters will be calculated) and other zones (without boron) are obtained from the images. The code is in the benchmarking stage, using geometrically simple cases and experimental data obtained from microdosimetric spectra from TEPC (Tissue Equivalent Proportional Counters) doped with 10 B. It allows to obtain LET spectra discriminated by event classes, chord-length distributions, dose and frequency mean values and visualizations of the spatial energy deposition. A similar version of the code uses bidimensional images from a tissue sample containing a great number of cellular structures. An equivalence between the microdosimetry of a bidimensional case and a tri dimensional one can be done. If the real distribution of 10 B is known, for example by high resolution alpha-track autoradiography, the code can use this information explicitly. (author) [es

  3. An ab initio chemical reaction model for the direct simulation Monte Carlo study of non-equilibrium nitrogen flows.

    Science.gov (United States)

    Mankodi, T K; Bhandarkar, U V; Puranik, B P

    2017-08-28

    A new ab initio based chemical model for a Direct Simulation Monte Carlo (DSMC) study suitable for simulating rarefied flows with a high degree of non-equilibrium is presented. To this end, Collision Induced Dissociation (CID) cross sections for N 2 +N 2 →N 2 +2N are calculated and published using a global complete active space self-consistent field-complete active space second order perturbation theory N 4 potential energy surface and quasi-classical trajectory algorithm for high energy collisions (up to 30 eV). CID cross sections are calculated for only a selected set of ro-vibrational combinations of the two nitrogen molecules, and a fitting scheme based on spectroscopic weights is presented to interpolate the CID cross section for all possible ro-vibrational combinations. The new chemical model is validated by calculating equilibrium reaction rate coefficients that can be compared well with existing shock tube and computational results. High-enthalpy hypersonic nitrogen flows around a cylinder in the transition flow regime are simulated using DSMC to compare the predictions of the current ab initio based chemical model with the prevailing phenomenological model (the total collision energy model). The differences in the predictions are discussed.

  4. Monte-Carlo method for studying the slowing down of neutrons in a thin plate of hydrogenated matter; Methode de Monte-Carlo pour l'etude du ralentissement des neutrons dans une plaque mince de matiere hydrogenee

    Energy Technology Data Exchange (ETDEWEB)

    Ribon, P; Michaudon, A [Commissariat a l' Energie Atomique, Saclay (France). Centre d' Etudes Nucleaires

    1965-07-01

    The studies of interaction of slow neutrons with atomic nuclei by means of the time of flight methods are made with a pulsed neutron source with a broad energy spectrum. The measurement accuracy needs a high intensity and an output time as short as possible and well defined. If the neutrons source is a target bombarded by the beam of a pulsed accelerator, it is usually required to slow down the neutrons to obtain a sufficient intensity at low energies. The purpose of the Monte-Carlo method which is described in this paper is to study the slowing down properties, mainly the intensity and the output time distribution of the slowed-down neutrons. The choice of the method and parameters studied is explained as well as the principles, some calculations and the program organization. A few results given as examples were obtained in the line of this program, the limits of which are principally due to simplifying physical hypotheses. (author) [French] l'etude de l'interaction des neutrons lents avec les noyaux atomiques par la methode du temps de vol s'effectue avec une source pulsee de neutrons dont le spectre en energie est assez etendu. La precision des mesures demande que la source soit intense et que la duree d'emission des neutrons soit breve et bien definie. Si la source est une cible bombardee par le faisceau de particules d'un accelerateur pulse, il est generalement indispensable de ralentir les neutrons pour avoir une intensite suffisante a basse energie. Nous presentons ici une methode de Monte-Carlo pour l'etude detaillee de ce ralentissement, notamment l'intensite et la distribution des temps de sortie des neutrons ralentis. Cette presentation comprend: la justification du choix de la methode de Monte-Carlo, les principes generaux, les differentes etapes du calcul et du programme ecrit pour le calculateur electronique IBM 7090. Nous indiquons aussi les restrictions qui sont apportees au domaine d'application de ce programme et qui proviennent surtout des

  5. Studies of light collection in depolished inorganic scintillators using Monte Carlo Simulations

    International Nuclear Information System (INIS)

    Altamirano, A.; Salinas, C. J. Solano; Wahl, D.

    2009-01-01

    Scintillators are materials which emit light when energetic particles deposit energy in their volume. It is a quasi-universal requirement that the light detected in scintillator setups be maximised. The following project aims to study how the light collection is affected by surface depolishing using the simulation programs GEANT4 and LITRANI.

  6. Monte Carlo simulation on kinetics of batch and semi-batch free radical polymerization

    KAUST Repository

    Shao, Jing; Tang, Wei; Xia, Ru; Feng, Xiaoshuang; Chen, Peng; Qian, Jiasheng; Song, Changjiang

    2015-01-01

    experimental and simulation studies, we showed the capability of our Monte Carlo scheme on representing polymerization kinetics in batch and semi-batch processes. Various kinetics information, such as instant monomer conversion, molecular weight

  7. Study of degenerate four-quark states with SU(2) lattice Monte Carlo techniques

    International Nuclear Information System (INIS)

    Green, A.M.; Lukkarinen, J.; Pennanen, P.; Michael, C.

    1996-01-01

    The energies of four-quark states are calculated for geometries in which the quarks are situated on the corners of a series of tetrahedra and also for geometries that correspond to gradually distorting these tetrahedra into a plane. The interest in tetrahedra arises because they are composed of three degenerate partitions of the four quarks into two two-quark color singlets. This is an extension of earlier work showing that geometries with two degenerate partitions (e.g., squares) experience a large binding energy. It is now found that even larger binding energies do not result, but that for the tetrahedra the ground and first excited states become degenerate in energy. The calculation is carried out using SU(2) for static quarks in the quenched approximation with Β=2.4 on a 16 3 x32 lattice. The results are analyzed using the correlation matrix between different Euclidean times and the implications of these results are discussed for a model based on two-quark potentials. copyright 1995 The American Physical Society

  8. Study of the propagation of fast neutrons in water, by Monte-Carlo methods

    International Nuclear Information System (INIS)

    Lafore, P.; Lattes, R.; Millot, J.P.

    1958-01-01

    We have studied the propagation in water of neutrons from mono-directional plane sources with energies ranging from 300 keV to 19,66 MeV, placed in an infinite water medium. The exact paths of a number of neutrons are determined, taking into account the microscopic sections, assuming that inelastic collisions of the neutrons on oxygen are absorptions, and neglecting the loss of energy by elastic collisions on oxygen. The neutron lifetimes have been made use of to study the propagation of neutrons from fission sources, Po-Be, Po-B and Ra-Be, as well as the reflection of fast neutrons on a semi-infinite water medium. We have taken complete account of the first collision in order to improve the precision of the results. The calculations were carried out by Mrs J. VASSEUR and Mr A. GUILLOU. (author) [fr

  9. Local dose enhancement in radiation therapy: Monte Carlo simulation study; Reforco local de dose em radioterapia utilizando nanoparticulas: estudo por simulacao Monte Carlo

    Energy Technology Data Exchange (ETDEWEB)

    Silva, Laura E. da; Nicolucci, Patricia, E-mail: laura.emilia.fm@gmail.com [Universidade de Sao Paulo (USP), Ribeirao Preto, SP (Brazil). Faculdade de Filosofia, Ciencias e Letras

    2014-04-15

    The development of nanotechnology has boosted the use of nanoparticles in radiation therapy in order to achieve greater therapeutic ratio between tumor and healthy tissues. Gold has been shown to be most suitable to this task due to the high biocompatibility and high atomic number, which contributes to a better in vivo distribution and for the local energy deposition. As a result, this study proposes to study, nanoparticle in the tumor cell. At a range of 11 nm from the nanoparticle surface, results have shown an absorbed dose 141 times higher for the medium with the gold nanoparticle compared to the water for an incident energy spectrum with maximum photon energy of 50 keV. It was also noted that when only scattered radiation is interacting with the gold nanoparticles, the dose was 134 times higher compared to enhanced local dose that remained significant even for scattered radiation. (author)

  10. Monte Carlo simulation using the PENELOPE code with an ant colony algorithm to study MOSFET detectors

    Energy Technology Data Exchange (ETDEWEB)

    Carvajal, M A; Palma, A J [Departamento de Electronica y Tecnologia de Computadores, Universidad de Granada, E-18071 Granada (Spain); Garcia-Pareja, S [Servicio de Radiofisica Hospitalaria, Hospital Regional Universitario ' Carlos Haya' , Avda Carlos Haya, s/n, E-29010 Malaga (Spain); Guirado, D [Servicio de RadiofIsica, Hospital Universitario ' San Cecilio' , Avda Dr Oloriz, 16, E-18012 Granada (Spain); Vilches, M [Servicio de Fisica y Proteccion Radiologica, Hospital Regional Universitario ' Virgen de las Nieves' , Avda Fuerzas Armadas, 2, E-18014 Granada (Spain); Anguiano, M; Lallena, A M [Departamento de Fisica Atomica, Molecular y Nuclear, Universidad de Granada, E-18071 Granada (Spain)], E-mail: carvajal@ugr.es, E-mail: garciapareja@gmail.com, E-mail: dguirado@ugr.es, E-mail: mvilches@ugr.es, E-mail: mangui@ugr.es, E-mail: ajpalma@ugr.es, E-mail: lallena@ugr.es

    2009-10-21

    In this work we have developed a simulation tool, based on the PENELOPE code, to study the response of MOSFET devices to irradiation with high-energy photons. The energy deposited in the extremely thin silicon dioxide layer has been calculated. To reduce the statistical uncertainties, an ant colony algorithm has been implemented to drive the application of splitting and Russian roulette as variance reduction techniques. In this way, the uncertainty has been reduced by a factor of {approx}5, while the efficiency is increased by a factor of above 20. As an application, we have studied the dependence of the response of the pMOS transistor 3N163, used as a dosimeter, with the incidence angle of the radiation for three common photons sources used in radiotherapy: a {sup 60}Co Theratron-780 and the 6 and 18 MV beams produced by a Mevatron KDS LINAC. Experimental and simulated results have been obtained for gantry angles of 0 deg., 15 deg., 30 deg., 45 deg., 60 deg. and 75 deg. The agreement obtained has permitted validation of the simulation tool. We have studied how to reduce the angular dependence of the MOSFET response by using an additional encapsulation made of brass in the case of the two LINAC qualities considered.

  11. A study of Monte Carlo methods for weak approximations of stochastic particle systems in the mean-field?

    KAUST Repository

    Haji Ali, Abdul Lateef

    2016-01-01

    I discuss using single level and multilevel Monte Carlo methods to compute quantities of interests of a stochastic particle system in the mean-field. In this context, the stochastic particles follow a coupled system of Ito stochastic differential equations (SDEs). Moreover, this stochastic particle system converges to a stochastic mean-field limit as the number of particles tends to infinity. I start by recalling the results of applying different versions of Multilevel Monte Carlo (MLMC) for particle systems, both with respect to time steps and the number of particles and using a partitioning estimator. Next, I expand on these results by proposing the use of our recent Multi-index Monte Carlo method to obtain improved convergence rates.

  12. A study of Monte Carlo methods for weak approximations of stochastic particle systems in the mean-field?

    KAUST Repository

    Haji Ali, Abdul Lateef

    2016-01-08

    I discuss using single level and multilevel Monte Carlo methods to compute quantities of interests of a stochastic particle system in the mean-field. In this context, the stochastic particles follow a coupled system of Ito stochastic differential equations (SDEs). Moreover, this stochastic particle system converges to a stochastic mean-field limit as the number of particles tends to infinity. I start by recalling the results of applying different versions of Multilevel Monte Carlo (MLMC) for particle systems, both with respect to time steps and the number of particles and using a partitioning estimator. Next, I expand on these results by proposing the use of our recent Multi-index Monte Carlo method to obtain improved convergence rates.

  13. Monte Carlo simulation study on dose enhancement by gold nanoparticles in brachytherapy

    International Nuclear Information System (INIS)

    Cho, Sungkoo; Jeong, Jonghwi; Kim, Chanhyeong; Yoon, Myonggeun

    2010-01-01

    Radiation dose enhancement by injection of a high atomic number (Z) material into tumor volumes has been studied for various radiation sources and different concentrations of gold nanoparticles. Brachytherapy employs low energy photons of less than ∼0.5 MeV, which indeed is the optimal energy range for radiation dose enhancement by introduction of high-Z material. The present study uses the MCNPX TM code to estimate the dose enhancement by gold nanoparticles for the four common brachytherapy sources ( 137 Cs, 192 Ir, 125 I, and 103 Pd). Additionally, cisplatin (H 6 Cl 2 N 2 Pt), a platinum-based chemotherapeutic drug, was used to evaluate the dose enhancement. The simulated source models were evaluated with reference to the calculated TG-43 parameter values. The dose enhancement in the tumor region due to the gold nanoparticles and cisplatin was evaluated according to the dose enhancement factor (DEF). The maximum values of the average DEFs were found to be 1.03, 1.11, 3.43, and 2.17 for the 137 Cs, 192 Ir, 125 I, and 103 Pd sources, respectively. The dose enhancement values for the low-energy sources were significantly higher than those for the high-energy sources. The dose enhancement due to cisplatin was calculated by using the same approach and was found to be comparable to that of the gold nanoparticles. The maximum value of the average DEF for cisplatin was 1.12 for the 5% concentration level in water and a 192 Ir source. We confirmed that cisplatin could be applied to cancer therapy that combines chemotherapeutic drugs with radiation therapy. The results presented herein will be used to study dose enhancement in tumor regions using various radiation modalities with high atomic number materials.

  14. Monte Carlo analysis of accelerator-driven systems studies on spallation neutron yield and energy gain

    CERN Document Server

    Hashemi-Nezhad, S R; Westmeier, W; Bamblevski, V P; Krivopustov, M I; Kulakov, B A; Sosnin, A N; Wan, J S; Odoj, R

    2001-01-01

    The neutron yield in the interaction of protons with lead and uranium targets has been studied using the LAHET code system. The dependence of the neutron multiplicity on target dimensions and proton energy has been calculated and the dependence of the energy amplification on the proton energy has been investigated in an accelerator-driven system of a given effective multiplication coefficient. Some of the results are compared with experimental findings and with similar calculations by the DCM/CEM code of Dubna and the FLUKA code system used in CERN. (14 refs).

  15. A Monte Carlo study of adsorption of random copolymers on random surfaces

    CERN Document Server

    Moghaddam, M S

    2003-01-01

    We study the adsorption problem of a random copolymer on a random surface in which a self-avoiding walk in three dimensions interacts with a plane defining a half-space to which the walk is confined. Each vertex of the walk is randomly labelled A with probability p sub p or B with probability 1 - p sub p , and only vertices labelled A are attracted to the surface plane. Each lattice site on the plane is also labelled either A with probability p sub s or B with probability 1 - p sub s , and only lattice sites labelled A interact with the walk. We study two variations of this model: in the first case the A-vertices of the walk interact only with the A-sites on the surface. In the second case the constraint of selective binding is removed; that is, any contact between the walk and the surface that involves an A-labelling, either from the surface or from the walk, is counted as a visit to the surface. The system is quenched in both cases, i.e. the labellings of the walk and of the surface are fixed as thermodynam...

  16. Modeling the impact of prostate edema on LDR brachytherapy: a Monte Carlo dosimetry study based on a 3D biphasic finite element biomechanical model

    Science.gov (United States)

    Mountris, K. A.; Bert, J.; Noailly, J.; Rodriguez Aguilera, A.; Valeri, A.; Pradier, O.; Schick, U.; Promayon, E.; Gonzalez Ballester, M. A.; Troccaz, J.; Visvikis, D.

    2017-03-01

    Prostate volume changes due to edema occurrence during transperineal permanent brachytherapy should be taken under consideration to ensure optimal dose delivery. Available edema models, based on prostate volume observations, face several limitations. Therefore, patient-specific models need to be developed to accurately account for the impact of edema. In this study we present a biomechanical model developed to reproduce edema resolution patterns documented in the literature. Using the biphasic mixture theory and finite element analysis, the proposed model takes into consideration the mechanical properties of the pubic area tissues in the evolution of prostate edema. The model’s computed deformations are incorporated in a Monte Carlo simulation to investigate their effect on post-operative dosimetry. The comparison of Day1 and Day30 dosimetry results demonstrates the capability of the proposed model for patient-specific dosimetry improvements, considering the edema dynamics. The proposed model shows excellent ability to reproduce previously described edema resolution patterns and was validated based on previous findings. According to our results, for a prostate volume increase of 10-20% the Day30 urethra D10 dose metric is higher by 4.2%-10.5% compared to the Day1 value. The introduction of the edema dynamics in Day30 dosimetry shows a significant global dose overestimation identified on the conventional static Day30 dosimetry. In conclusion, the proposed edema biomechanical model can improve the treatment planning of transperineal permanent brachytherapy accounting for post-implant dose alterations during the planning procedure.

  17. Monte Carlo study of MOSFET dosimeter dose correction factors considering energy spectrum of radiation field in a steam generator channel head

    Energy Technology Data Exchange (ETDEWEB)

    Cho, Sung Koo; Choi, Sang Hyoun; Kim, Chan Hyeong [Hanyang Univ., Seoul (Korea, Republic of)

    2006-12-15

    In Korea, a real-time effective dose measurement system is in development. The system uses 32 high-sensitivity MOSFET dosimeters to measure radiation doses at various organ locations in an anthropomorphic physical phantom. The MOSFET dosimeters are, however, mainly made of silicon and shows some degree of energy and angular dependence especially for low energy photons. This study determines the correction factors to correct for these dependences of the MOSFET dosimeters for accurate measurement of radiation doses at organ locations in the phantom. For this, first, the dose correction factors of MOSFET dosimeters were determined for the energy spectrum in the steam generator channel of the Kori Nuclear Power Plant Unit no.1 by Monte Carlo simulations. Then, the results were compared with the dose correction factors from 0.662 MeV and 1.25 MeV mono-energetic photons. The difference of the dose correction factors were found very negligible ({<=}1.5%), which in general shows that the dose corrections factors determined from 0.662 MeV and 1.25 MeV can be in a steam general channel head of a nuclear power plant. The measured effective dose was generally found to decrease by {approx}7% when we apply the dose correction factors.

  18. Monte Carlo Study of the abBA Experiment: Detector Response and Physics Analysis.

    Science.gov (United States)

    Frlež, E

    2005-01-01

    The abBA collaboration proposes to conduct a comprehensive program of precise measurements of neutron β-decay coefficients a (the correlation between the neutrino momentum and the decay electron momentum), b (the electron energy spectral distortion term), A (the correlation between the neutron spin and the decay electron momentum), and B (the correlation between the neutron spin and the decay neutrino momentum) at a cold neutron beam facility. We have used a GEANT4-based code to simulate the propagation of decay electrons and protons in the electromagnetic spectrometer and study the energy and timing response of a pair of Silicon detectors. We used these results to examine systematic effects and find the uncertainties with which the physics parameters a, b, A, and B can be extracted from an over-determined experimental data set.

  19. Mammographic Imaging Studies Using the Monte Carlo Image Simulation-Differential Sampling (MCMIS-DS) Code

    International Nuclear Information System (INIS)

    Kuruvilla Verghese

    2002-01-01

    This report summarizes the highlights of the research performed under the 1-year NEER grant from the Department of Energy. The primary goal of this study was to investigate the effects of certain design changes in the Fisher Senoscan mammography system and in the degree of breast compression on the discernability of microcalcifications in calcification clusters often observed in mammograms with tumor lesions. The most important design change that one can contemplate in a digital mammography system to improve resolution of calcifications is the reduction of pixel dimensions of the digital detector. Breast compression is painful to the patient and is though to be a deterrent to women to get routine mammographic screening. Calcification clusters often serve as markers (indicators ) of breast cancer

  20. A Monte Carlo study of atmospheric muon-neutrinos in Amanda

    Energy Technology Data Exchange (ETDEWEB)

    Dalberg, E.

    1998-01-01

    The response of AMANDA detector to atmospheric muon-neutrinos has been simulated. The neutrino flux, which has its origin from cosmic ray interactions with the atmosphere, induce muons in the vicinity of the detector. These muons will be relativistic and emit Cerenkov photons which can be detected by the optical modules buried in the deep South Pole glacier ice. The aim of the simulations is to predict the trigger rates in the existing detector, as well as in future extensions. The efficiency to detect muons with different angles and energies is also studied. Some of the simulated events have been analysed and it is discussed how the quality of this analysis can be judged. 35 refs, 30 figs.

  1. Monte Carlo Latching Studies of Prompt-Gamma Detection During Hadrontherapy

    CERN Document Server

    Chin, M P W; Ferrari, A; Ortega, P G; Sala, P R

    2014-01-01

    Proton and carbon therapies of a human brain were simulated using FLUKA, with particular emphasis on treatment monitoring using the prompt gamma method where activities of the source proton/carbon in the patient's body are to be extracted from the positional profile of exit photons. Tissue heterogeneity ranging from hydrogen to zinc was represented in a VIP-Man anthropomorphic voxel phantom. Each photon exiting the head was scored with ancestry attributes such as the particle type of its parent, the originating collision type and site. These data, not accessible via physical detectors, were analysed to characterise the escaping photons, delineating signal from noise according to the gamma origin and scatter history. Combinations of energy, geometry, time and angle filters, aided by raytracing, were studied for the optimal compromise between a sufficiently featured exit profile and a statistically adequate count. These will be put in context with ongoing research in the field; our perspective for the prompt ga...

  2. Efficiency of rejection-free methods for dynamic Monte Carlo studies of off-lattice interacting particles

    KAUST Repository

    Guerra, Marta L.; Novotny, M. A.; Watanabe, Hiroshi; Ito, Nobuyasu

    2009-01-01

    We calculate the efficiency of a rejection-free dynamic Monte Carlo method for d -dimensional off-lattice homogeneous particles interacting through a repulsive power-law potential r-p. Theoretically we find the algorithmic efficiency in the limit of low temperatures and/or high densities is asymptotically proportional to ρ (p+2) /2 T-d/2 with the particle density ρ and the temperature T. Dynamic Monte Carlo simulations are performed in one-, two-, and three-dimensional systems with different powers p, and the results agree with the theoretical predictions. © 2009 The American Physical Society.

  3. Efficiency of rejection-free methods for dynamic Monte Carlo studies of off-lattice interacting particles

    KAUST Repository

    Guerra, Marta L.

    2009-02-23

    We calculate the efficiency of a rejection-free dynamic Monte Carlo method for d -dimensional off-lattice homogeneous particles interacting through a repulsive power-law potential r-p. Theoretically we find the algorithmic efficiency in the limit of low temperatures and/or high densities is asymptotically proportional to ρ (p+2) /2 T-d/2 with the particle density ρ and the temperature T. Dynamic Monte Carlo simulations are performed in one-, two-, and three-dimensional systems with different powers p, and the results agree with the theoretical predictions. © 2009 The American Physical Society.

  4. Studying stellar binary systems with the Laser Interferometer Space Antenna using delayed rejection Markov chain Monte Carlo methods

    International Nuclear Information System (INIS)

    Trias, Miquel; Vecchio, Alberto; Veitch, John

    2009-01-01

    Bayesian analysis of Laser Interferometer Space Antenna (LISA) data sets based on Markov chain Monte Carlo methods has been shown to be a challenging problem, in part due to the complicated structure of the likelihood function consisting of several isolated local maxima that dramatically reduces the efficiency of the sampling techniques. Here we introduce a new fully Markovian algorithm, a delayed rejection Metropolis-Hastings Markov chain Monte Carlo method, to efficiently explore these kind of structures and we demonstrate its performance on selected LISA data sets containing a known number of stellar-mass binary signals embedded in Gaussian stationary noise.

  5. Experimental study and by Monte Carlo of a prototype of hodoscopic of fibre optics for high resolution applications

    International Nuclear Information System (INIS)

    Granero, D.; Blasco, J. M.; Sanchis, E.; Gonzalez, V.; Martin, J. D.; Ballester, F.; Sanchis, E.

    2013-01-01

    The purpose of this work is to test the response of a system composed of 21 scintillators radiation fibres and its electronics as proof of the validity of the System. For this it has radiated test system with a source of verification of Sr-90. In addition, performed Monte Carlo simulations of the system by comparing the results of the simulations with those obtained experimentally. Moreover taken an approximation to the behavior of a hodoscopic composed of 100 scintillators, transverse fibers between if, in proton therapy, conducting different Monte Carlo simulations. (Author)

  6. Investigation of Collimator Influential Parameter on SPECT Image Quality: a Monte Carlo Study

    Directory of Open Access Journals (Sweden)

    Banari Bahnamiri Sh

    2015-03-01

    Full Text Available Background: Obtaining high quality images in Single Photon Emission Tomography (SPECT device is the most important goal in nuclear medicine. Because if image quality is low, the possibility of making a mistake in diagnosing and treating the patient will rise. Studying effective factors in spatial resolution of imaging systems is thus deemed to be vital. One of the most important factors in SPECT imaging in nuclear medicine is the use of an appropriate collimator for a certain radiopharmaceutical feature in order to create the best image as it can be effective in the quantity of Full Width at Half Maximum (FWHM which is the main parameter in spatial resolution. Method: In this research, the simulation of the detector and collimator of SPECT imaging device, Model HD3 made by Philips Co. and the investigation of important factors on the collimator were carried out using MCNP-4c code. Results: The results of the experimental measurments and simulation calculations revealed a relative difference of less than 5% leading to the confirmation of the accuracy of conducted simulation MCNP code calculation. Conclusion: This is the first essential step in the design and modelling of new collimators used for creating high quality images in nuclear medicine

  7. Monte Carlo-based tail exponent estimator

    Science.gov (United States)

    Barunik, Jozef; Vacha, Lukas

    2010-11-01

    In this paper we propose a new approach to estimation of the tail exponent in financial stock markets. We begin the study with the finite sample behavior of the Hill estimator under α-stable distributions. Using large Monte Carlo simulations, we show that the Hill estimator overestimates the true tail exponent and can hardly be used on samples with small length. Utilizing our results, we introduce a Monte Carlo-based method of estimation for the tail exponent. Our proposed method is not sensitive to the choice of tail size and works well also on small data samples. The new estimator also gives unbiased results with symmetrical confidence intervals. Finally, we demonstrate the power of our estimator on the international world stock market indices. On the two separate periods of 2002-2005 and 2006-2009, we estimate the tail exponent.

  8. Multilevel Monte Carlo Approaches for Numerical Homogenization

    KAUST Repository

    Efendiev, Yalchin R.

    2015-10-01

    In this article, we study the application of multilevel Monte Carlo (MLMC) approaches to numerical random homogenization. Our objective is to compute the expectation of some functionals of the homogenized coefficients, or of the homogenized solutions. This is accomplished within MLMC by considering different sizes of representative volumes (RVEs). Many inexpensive computations with the smallest RVE size are combined with fewer expensive computations performed on larger RVEs. Likewise, when it comes to homogenized solutions, different levels of coarse-grid meshes are used to solve the homogenized equation. We show that, by carefully selecting the number of realizations at each level, we can achieve a speed-up in the computations in comparison to a standard Monte Carlo method. Numerical results are presented for both one-dimensional and two-dimensional test-cases that illustrate the efficiency of the approach.

  9. Photon activation therapy: a Monte Carlo study on dose enhancement by various sources and activation media

    International Nuclear Information System (INIS)

    Bakhshabadi, Mahdi; Ghorbani, Mahdi; Meigooni, Ali Soleimani

    2013-01-01

    In the present study, a number of brachytherapy sources and activation media were simulated using MCNPX code and the results were analyzed based on the dose enhancement factor values. Furthermore, two new brachytherapy sources ( 131 Cs and a hypothetical 170 Tm) were evaluated for their application in photon activation therapy (PAT). 125 I, 103 Pd, 131 Cs and hypothetical 170 Tm brachytherapy sources were simulated in water and their dose rate constant and the radial dose functions were compared with previously published data. The sources were then simulated in a soft tissue phantom which was composed of Ag, I, Pt or Au as activation media uniformly distributed in the tumour volume. These simulations were performed using the MCNPX code, and dose enhancement factor (DEF) was obtained for 7, 18 and 30 mg/ml concentrations of the activation media. Each source, activation medium and concentration was evaluated separately in a separate simulation. The calculated dose rate constant and radial dose functions were in agreement with the published data for the aforementioned sources. The maximum DEF was found to be 5.58 for a combination of the 170 Tm source with 30 mg/ml concentration of I. The DEFs for 131 Cs and 170 Tm sources for all the four activation media were higher than those for other sources and activation media. From this point of view, these two sources can be more useful in photon activation therapy with photon emitter sources. Furthermore, 131 Cs and 170 Tm brachytherapy sources can be proposed as new options for use in the field of PAT.

  10. Monte Carlo Method to Study Properties of Acceleration Factor Estimation Based on the Test Results with Varying Load

    Directory of Open Access Journals (Sweden)

    N. D. Tiannikova

    2014-01-01

    Full Text Available G.D. Kartashov has developed a technique to determine the rapid testing results scaling functions to the normal mode. Its feature is preliminary tests of products of one sample including tests using the alternating modes. Standard procedure of preliminary tests (researches is as follows: n groups of products with m elements in each start being tested in normal mode and, after a failure of one of products in the group, the remained products are tested in accelerated mode. In addition to tests in alternating mode, tests in constantly normal mode are conducted as well. The acceleration factor of rapid tests for this type of products, identical to any lots is determined using such testing results of products from the same lot. A drawback of this technique is that tests are to be conducted in alternating mode till the failure of all products. That is not always is possible. To avoid this shortcoming, the Renyi criterion is offered. It allows us to determine scaling functions using the right-censored data thus giving the opportunity to stop testing prior to all failures of products.In this work a statistical modeling of the acceleration factor estimation owing to Renyi statistics minimization is implemented by the Monte-Carlo method. Results of modeling show that the acceleration factor estimation obtained through Renyi statistics minimization is conceivable for rather large n . But for small sample volumes some systematic bias of acceleration factor estimation, which decreases with growth n is observed for both distributions (exponential and Veybull's distributions. Therefore the paper also presents calculation results of correction factors for a case of exponential distribution and Veybull's distribution.

  11. Efficiency of radiation protection equipment in interventional radiology: a systematic Monte Carlo study of eye lens and whole body doses

    International Nuclear Information System (INIS)

    Koukorava, C; Farah, J; Clairand, I; Donadille, L; Struelens, L; Vanhavere, F; Dimitriou, P

    2014-01-01

    Monte Carlo calculations were used to investigate the efficiency of radiation protection equipment in reducing eye and whole body doses during fluoroscopically guided interventional procedures. Eye lens doses were determined considering different models of eyewear with various shapes, sizes and lead thickness. The origin of scattered radiation reaching the eyes was also assessed to explain the variation in the protection efficiency of the different eyewear models with exposure conditions. The work also investigates the variation of eye and whole body doses with ceiling-suspended shields of various shapes and positioning. For all simulations, a broad spectrum of configurations typical for most interventional procedures was considered. Calculations showed that ‘wrap around’ glasses are the most efficient eyewear models reducing, on average, the dose by 74% and 21% for the left and right eyes respectively. The air gap between the glasses and the eyes was found to be the primary source of scattered radiation reaching the eyes. The ceiling-suspended screens were more efficient when positioned close to the patient’s skin and to the x-ray field. With the use of such shields, the H p (10) values recorded at the collar, chest and waist level and the H p (3) values for both eyes were reduced on average by 47%, 37%, 20% and 56% respectively. Finally, simulations proved that beam quality and lead thickness have little influence on eye dose while beam projection, the position and head orientation of the operator as well as the distance between the image detector and the patient are key parameters affecting eye and whole body doses. (paper)

  12. Systematic study of influence of growth parameters on island morphology during molecular beam epitaxy growth: A Monte Carlo study

    International Nuclear Information System (INIS)

    Shankar Prasad Shrestha; Park, C.-Y.

    2006-05-01

    We have made a systematic study of influence of diffusion flux ratio (D/F), diffusional anisotropy (DA) and sticking anisotropy (SA) on island morphology to show the influence of each growth parameter on island morphology in presence of the other growth parameters. Our results show that the influence of D/F ratio and DA on island morphology depends on the sticking anisotropy of the adatoms. At the intermediate anisotropic case, increase in D/F ratio results in transition of the island morphology from 1d nature to 2 d nature. In anisotropic diffusion case, D/F ratio can change the growth direction of the island morphology. We also find that only sticking anisotropy is not sufficient to produce elongated islands, low D/F ratio is also essential. (author)

  13. Detecting rater bias using a person-fit statistic: a Monte Carlo simulation study.

    Science.gov (United States)

    Aubin, André-Sébastien; St-Onge, Christina; Renaud, Jean-Sébastien

    2018-04-01

    With the Standards voicing concern for the appropriateness of response processes, we need to explore strategies that would allow us to identify inappropriate rater response processes. Although certain statistics can be used to help detect rater bias, their use is complicated by either a lack of data about their actual power to detect rater bias or the difficulty related to their application in the context of health professions education. This exploratory study aimed to establish the worthiness of pursuing the use of l z to detect rater bias. We conducted a Monte Carlo simulation study to investigate the power of a specific detection statistic, that is: the standardized likelihood l z person-fit statistics (PFS). Our primary outcome was the detection rate of biased raters, namely: raters whom we manipulated into being either stringent (giving lower scores) or lenient (giving higher scores), using the l z statistic while controlling for the number of biased raters in a sample (6 levels) and the rate of bias per rater (6 levels). Overall, stringent raters (M = 0.84, SD = 0.23) were easier to detect than lenient raters (M = 0.31, SD = 0.28). More biased raters were easier to detect then less biased raters (60% bias: 62, SD = 0.37; 10% bias: 43, SD = 0.36). The PFS l z seems to offer an interesting potential to identify biased raters. We observed detection rates as high as 90% for stringent raters, for whom we manipulated more than half their checklist. Although we observed very interesting results, we cannot generalize these results to the use of PFS with estimated item/station parameters or real data. Such studies should be conducted to assess the feasibility of using PFS to identify rater bias.

  14. Porphyrins as Corrosion Inhibitors for N80 Steel in 3.5% NaCl Solution: Electrochemical, Quantum Chemical, QSAR and Monte Carlo Simulations Studies

    Directory of Open Access Journals (Sweden)

    Ambrish Singh

    2015-08-01

    Full Text Available The inhibition of the corrosion of N80 steel in 3.5 wt. % NaCl solution saturated with CO2 by four porphyrins, namely 5,10,15,20-tetrakis(4-hydroxyphenyl-21H,23H-porphyrin (HPTB, 5,10,15,20-tetra(4-pyridyl-21H,23H-porphyrin (T4PP, 4,4′,4″,4‴-(porphyrin-5,10,15,20-tetrayltetrakis(benzoic acid (THP and 5,10,15,20-tetraphenyl-21H,23H-porphyrin (TPP was studied using electrochemical impedance spectroscopy (EIS, potentiodynamic polarization, scanning electrochemical microscopy (SECM and scanning electron microscopy (SEM techniques. The results showed that the inhibition efficiency, η% increases with increasing concentration of the inhibitors. The EIS results revealed that the N80 steel surface with adsorbed porphyrins exhibited non-ideal capacitive behaviour with reduced charge transfer activity. Potentiodynamic polarization measurements indicated that the studied porphyrins acted as mixed type inhibitors. The SECM results confirmed the adsorption of the porphyrins on N80 steel thereby forming a relatively insulated surface. The SEM also confirmed the formation of protective films of the porphyrins on N80 steel surface thereby protecting the surface from direct acid attack. Quantum chemical calculations, quantitative structure activity relationship (QSAR were also carried out on the studied porphyrins and the results showed that the corrosion inhibition performances of the porphyrins could be related to their EHOMO, ELUMO, ω, and μ values. Monte Carlo simulation studies showed that THP has the highest adsorption energy, while T4PP has the least adsorption energy in agreement with the values of σ from quantum chemical calculations.

  15. Nano-scale study of phase separation in ferrite of long term thermally aged Mo-bearing duplex stainless steels - Atom probe tomography and Monte Carlo simulation

    International Nuclear Information System (INIS)

    Pareige, C.; Emo, J.; Pareige, P.; Saillet, S.; Domain, C.

    2015-01-01

    Duplex stainless steels (DSS), used in primary circuit of Pressurised Water Reactor (PWR), are prone to thermal ageing at service temperature, typically between 286 and 323 C. degrees. This ageing is due to the ferrite decomposition via two kinds of phase transformations: spinodal decomposition into Fe rich α zones and Cr rich α' zones and precipitation of G-phase enriched in Ni, Si, Mn and Mo. It has been shown by atom probe tomography (APT) that the G-phase particles form at the interface between α and α' regions thereby demonstrating that α-α' decomposition and G-phase precipitation are highly dependent. The synergy between the two decomposition processes should be related to both the thermodynamics of the system and the diffusion mechanisms active during ageing. This can be studied by atomistic kinetic Monte Carlo (AKMC) with a model that can reproduce the phase transformations which take place in ferrite of duplex stainless steels. This paper presents the first simulations of the kinetics of spinodal decomposition and G-phase precipitation occurring in ferrite of duplex stainless steels. The kinetics was simulated using a simple but effective atomic kinetic Monte Carlo model in a ternary alloy. The simulations reproduced the α/α' spinodal structure with precipitates at the α/α' interface. The comparison of simulated results with experiments shows that the simulations quantitatively reproduce the kinetics of phase transformation and the synergy observed experimentally between the spinodal decomposition and G-phase precipitation: the time evolution of the wavelength of the spinodal decomposition and the radius of G-phase precipitates were quantitatively reproduced. The simulations endorse the assumption that G-phase precipitation mainly results from the rejection of G-formers from α and α' domains. By following the vacancy pathway during simulation, we show that coarsening of the G-phase precipitates must proceed via

  16. [Study of the influence of uniform transverse magnetic field on the dose distribution of high energy electron beam using Monte Carlo method].

    Science.gov (United States)

    You, Shihu; Xu, Yun; Wu, Zhangwen; Hou, Qing; Guo, Chengjun

    2014-12-01

    In the present work, Monte Carlo simulations were employed to study the characteristics of the dose distribution of high energy electron beam in the presence of uniform transverse magnetic field. The simulations carried out the transport processes of the 30 MeV electron beam in the homogeneous water phantom with different magnetic field. It was found that the dose distribution of the 30 MeV electron beam had changed significantly because of the magnetic field. The result showed that the range of the electron beam was decreased obviously and it formed a very high dose peak at the end of the range, and the ratio of maximum dose to the dose of the surface was greatly increased. The results of this study demonstrated that we could change the depth dose distribution of electron beam which is analogous to the heavy ion by modulating the energy of the electron and magnetic field. It means that using magnetic fields in conjunction with electron radiation therapy has great application prospect, but it also has brought new challenges for the research of dose algorithm.

  17. Monte Carlo Study of the Effect of Collimator Thickness on T-99m Source Response in Single Photon Emission Computed Tomography

    International Nuclear Information System (INIS)

    Islamian, Jalil Pirayesh; Toossi, Mohammad Taghi Bahreyni; Momennezhad, Mahdi; Zakavi, Seyyed Rasoul; Sadeghi, Ramin; Ljungberg, Michael

    2012-01-01

    In single photon emission computed tomography (SPECT), the collimator is a crucial element of the imaging chain and controls the noise resolution tradeoff of the collected data. The current study is an evaluation of the effects of different thicknesses of a low-energy high-resolution (LEHR) collimator on tomographic spatial resolution in SPECT. In the present study, the SIMIND Monte Carlo program was used to simulate a SPECT equipped with an LEHR collimator. A point source of 99m Tc and an acrylic cylindrical Jaszczak phantom, with cold spheres and rods, and a human anthropomorphic torso phantom (4D-NCAT phantom) were used. Simulated planar images and reconstructed tomographic images were evaluated both qualitatively and quantitatively. According to the tabulated calculated detector parameters, contribution of Compton scattering, photoelectric reactions, and also peak to Compton (P/C) area in the obtained energy spectrums (from scanning of the sources with 11 collimator thicknesses, ranging from 2.400 to 2.410 cm), we concluded the thickness of 2.405 cm as the proper LEHR parallel hole collimator thickness. The image quality analyses by structural similarity index (SSIM) algorithm and also by visual inspection showed suitable quality images obtained with a collimator thickness of 2.405 cm. There was a suitable quality and also performance parameters’ analysis results for the projections and reconstructed images prepared with a 2.405 cm LEHR collimator thickness compared with the other collimator thicknesses

  18. Effect of sample moisture and bulk density on performance of the 241Am-Be source based prompt gamma rays neutron activation analysis setup. A Monte Carlo study

    International Nuclear Information System (INIS)

    Almisned, Ghada

    2010-01-01

    Monte Carlo simulations were carried out using the dependence of gamma ray yield on the bulk density and moisture content for five different lengths of Portland cement samples in a thermal neutron capture based Prompt Gamma ray Neutron Activation Analysis (PGNAA) setup for source inside moderator geometry using an 241 Am-Be neutron source. In this study, yields of 1.94 and 6.42 MeV prompt gamma rays from calcium in the five Portland cement samples were calculated as a function of sample bulk density and moisture content. The study showed a strong dependence of the 1.94 and 6.42 MeV gamma ray yield upon the sample bulk density but a weaker dependence upon sample moisture content. For an order of magnitude increase in the sample bulk density, an order of magnitude increase in the gamma rays yield was observed, i.e., a one-to-one correspondence. In case of gamma ray yield dependence upon sample moisture content, an order of magnitude increase in the moisture content of the sample resulted in about 16-17% increase in the yield of 1.94 and 6.42 MeV gamma rays from calcium. (author)

  19. Study of cold neutron sources: Implementation and validation of a complete computation scheme for research reactor using Monte Carlo codes TRIPOLI-4.4 and McStas

    International Nuclear Information System (INIS)

    Campioni, Guillaume; Mounier, Claude

    2006-01-01

    The main goal of the thesis about studies of cold neutrons sources (CNS) in research reactors was to create a complete set of tools to design efficiently CNS. The work raises the problem to run accurate simulations of experimental devices inside reactor reflector valid for parametric studies. On one hand, deterministic codes have reasonable computation times but introduce problems for geometrical description. On the other hand, Monte Carlo codes give the possibility to compute on precise geometry, but need computation times so important that parametric studies are impossible. To decrease this computation time, several developments were made in the Monte Carlo code TRIPOLI-4.4. An uncoupling technique is used to isolate a study zone in the complete reactor geometry. By recording boundary conditions (incoming flux), further simulations can be launched for parametric studies with a computation time reduced by a factor 60 (case of the cold neutron source of the Orphee reactor). The short response time allows to lead parametric studies using Monte Carlo code. Moreover, using biasing methods, the flux can be recorded on the surface of neutrons guides entries (low solid angle) with a further gain of running time. Finally, the implementation of a coupling module between TRIPOLI- 4.4 and the Monte Carlo code McStas for research in condensed matter field gives the possibility to obtain fluxes after transmission through neutrons guides, thus to have the neutron flux received by samples studied by scientists of condensed matter. This set of developments, involving TRIPOLI-4.4 and McStas, represent a complete computation scheme for research reactors: from nuclear core, where neutrons are created, to the exit of neutrons guides, on samples of matter. This complete calculation scheme is tested against ILL4 measurements of flux in cold neutron guides. (authors)

  20. Oxygen-ordering phenomena in YBa2Cu3O6+x studied by Monte Carlo simulation

    DEFF Research Database (Denmark)

    Fiig, T.; Andersen, J.V.; Andersen, N.H.

    1993-01-01

    The oxygen order in YBa2Cu3O6+x has been investigated by Monte Carlo simulation with the two-dimensional anisotropic next-nearest-neighbor lattice gas model, the ASYNNNI model. For a specific set of interaction parameters we have calculated the structural phase diagram, the chemical potential...