A harmonic transition state theory model for defect initiation in crystals
International Nuclear Information System (INIS)
Delph, T J; Cao, P; Park, H S; Zimmerman, J A
2013-01-01
We outline here a model for the initiation of defects in crystals based upon harmonic transition state theory (hTST). This model combines a previously developed model for zero-temperature defect initiation with a multi-dimensional hTST model that is capable of accurately predicting the effects of temperature and loading rate upon defect initiation. The model has several features that set it apart from previous efforts along these lines, most notably a straightforward method of determining the energy barrier between adjacent equilibrium states that does not depend upon a priori information concerning the nature of the defect. We apply the model to two examples, triaxial stretching of a perfect fcc crystal and nanoindentation of a gold substrate. Very good agreement is found between the predictions of the model and independent molecular dynamics (MD) simulations. Among other things, the model predicts a strong dependence of the defect initiation behavior upon the loading parameter. A very attractive feature of this model is that it is valid for arbitrarily slow loading rates, in particular loading rates achievable in the laboratory, and suffers from none of the limitations in this regard inherent in MD simulations. (paper)
Second harmonic generation in Te crystal using free electron laser
Yamauchi, T; Minehara, E J
2002-01-01
The second harmonic generation signal converted from the fundamental wavelength of 22 mu m of a free electron laser was observed for the first time using a birefringent Te crystal. The experimental conversion efficiency of Te crystal for second harmonic generation is 0.53%, which is equivalent to the theoretical value within a factor of 2. The Te crystal has been incorporated into an autocorrelator system to measure the micro-pulse width of infrared free electron laser successfully. (author)
Harmonic modeling of induction motors
Energy Technology Data Exchange (ETDEWEB)
Pedra, J.; Sainz, L.; Corcoles, F. [Department of Electrical Engineering, ETSEIB-UPC, Av. Diagonal 647, 08028 Barcelona (Spain)
2006-07-15
The paper proposes an induction motor model for the study of harmonic load flow in balanced and unbalanced conditions. The parameters of this model are obtained from motor manufacturer data and the positive- and negative-sequence equivalent circuits of the single- and double-cage models. An approximate harmonic model based on motor manufacturer data only is also proposed. In addition, the paper includes manufacturer data and the calculated parameters of 36 induction motors of different rated powers. This database is used to analyze the proposed models. (author)
Probabilistic Harmonic Modeling of Wind Power Plants
DEFF Research Database (Denmark)
Guest, Emerson; Jensen, Kim H.; Rasmussen, Tonny Wederberg
2017-01-01
A probabilistic sequence domain (SD) harmonic model of a grid-connected voltage-source converter is used to estimate harmonic emissions in a wind power plant (WPP) comprised of Type-IV wind turbines. The SD representation naturally partitioned converter generated voltage harmonics into those...... with deterministic phase and those with probabilistic phase. A case study performed on a string of ten 3MW, Type-IV wind turbines implemented in PSCAD was used to verify the probabilistic SD harmonic model. The probabilistic SD harmonic model can be employed in the planning phase of WPP projects to assess harmonic...
Data harmonization and model performance
The Joint Committee on Urban Storm Drainage of the International Association for Hydraulic Research (IAHR) and International Association on Water Pollution Research and Control (IAWPRC) was formed in 1982. The current committee members are (no more than two from a country): B. C. Yen, Chairman (USA); P. Harremoes, Vice Chairman (Denmark); R. K. Price, Secretary (UK); P. J. Colyer (UK), M. Desbordes (France), W. C. Huber (USA), K. Krauth (FRG), A. Sjoberg (Sweden), and T. Sueishi (Japan).The IAHR/IAWPRC Joint Committee is forming a Task Group on Data Harmonization and Model Performance. One objective is to promote international urban drainage data harmonization for easy data and information exchange. Another objective is to publicize available models and data internationally. Comments and suggestions concerning the formation and charge of the Task Group are welcome and should be sent to: B. C. Yen, Dept. of Civil Engineering, Univ. of Illinois, 208 N. Romine St., Urbana, IL 61801.
Computer model for harmonic ultrasound imaging.
Li, Y; Zagzebski, J A
2000-01-01
Harmonic ultrasound imaging has received great attention from ultrasound scanner manufacturers and researchers. In this paper, we present a computer model that can generate realistic harmonic images. In this model, the incident ultrasound is modeled after the "KZK" equation, and the echo signal is modeled using linear propagation theory because the echo signal is much weaker than the incident pulse. Both time domain and frequency domain numerical solutions to the "KZK" equation were studied. Realistic harmonic images of spherical lesion phantoms were generated for scans by a circular transducer. This model can be a very useful tool for studying the harmonic buildup and dissipation processes in a nonlinear medium, and it can be used to investigate a wide variety of topics related to B-mode harmonic imaging.
Generation of the second harmonics of Bessel light beams in a KTP crystal
International Nuclear Information System (INIS)
Belyi, V N; Kazak, N S; Kondratyuk, N V; Khilo, N A; Shagov, A A
1998-01-01
Theoretical and experimental investigations were made of the characteristic features of doubling the frequency of Bessel light beams by the oe - e interaction in a KTP crystal. All possible and scalar interactions of plane-wave components of Bessel beams were observed experimentally. The spatial structure of the second harmonic in the far zone consisted of a central spot and a concentric ring. The diffraction divergence of the central beam was weak ( ∼ 1.7 mrad). The energy conversion efficiency was ∼ 21% for a Bessel beam, which was three times higher than the efficiency of conversion of the initial laser beam. A theoretical model was based on representation of the field of the second harmonic as a superposition of Bessel beams, which provided a correct description of the observed spatial and energy characteristics of the second harmonic. (nonlinear optical phenomena and devices)
Chemical binding effects in resonance - potential interference scattering for harmonic crystals
International Nuclear Information System (INIS)
Kuwaifi, A.; Summerfield, G.C.
1991-01-01
The neutron scattering cross section which is the quantity directly measured in experiments is given by the absolute square of the scattering amplitude. For energies near a resonance, this yields three terms: potential, resonant and interference. In this paper we deal with the interference neutron scattering cross section which is written in terms of a three-point correlation function. This function is calculated for the ideal gas and harmonic crystal models. For short collision times, the interference result for harmonic crystals is the same as the ideal gas but it has an effective temperature. This is the same effective temperature as was previously found for absorption and pure resonant processes. Therefore, the interference scattering cross section can be treated in the same way as resonant scattering and absorption are treated using an ideal gas result with the usual effective temperature. (author)
Diffractive-refractive optics: (+,-,-,+) X-ray crystal monochromator with harmonics separation.
Hrdý, Jaromír; Mikulík, Petr; Oberta, Peter
2011-03-01
A new kind of two channel-cut crystals X-ray monochromator in dispersive (+,-,-,+) position which spatially separates harmonics is proposed. The diffracting surfaces are oriented so that the diffraction is inclined. Owing to refraction the diffracted beam is sagittally deviated. The deviation depends on wavelength and is much higher for the first harmonics than for higher harmonics. This leads to spatial harmonics separation. The idea is supported by ray-tracing simulation.
Modelling the harmonized tertiary Institutions Salary Structure ...
African Journals Online (AJOL)
This paper analyses the Harmonized Tertiary Institution Salary Structure (HATISS IV) used in Nigeria. The irregularities in the structure are highlighted. A model that assumes a polynomial trend for the zero step salary, and exponential trend for the incremental rates, is suggested for the regularization of the structure.
Harmonicity in supermanifolds and sigma models
International Nuclear Information System (INIS)
Munoz-Masque, Jaime; Vallejo, Jose A.
2009-01-01
We show that given an odd metric G on a supermanifold (M, A) and its associated Laplacian Δ, it is possible to interpret harmonic superfunctions (i.e., those f is an element of A such that Δf = 0) as solutions to a variational problem describing a supersymmetric sigma model.
Overhead distribution line models for harmonics studies
Energy Technology Data Exchange (ETDEWEB)
Nagpal, M.; Xu, W.; Dommel, H.W.
1994-01-01
Carson's formulae and Maxwell's potential coefficients are used for calculating the per unit length series impedances and shunt capacitances of the overhead lines. The per unit length values are then used for building the models, nominal pi-circuit, and equivalent pi-circuit at the harmonic frequencies. This paper studies the accuracy of these models for presenting the overhead distribution lines in steady-state harmonic solutions at frequencies up to 5 kHz. The models are verified with a field test on a 25 kV distribution line and the sensitivity of the models to ground resistivity, skin effect, and multiple grounding is reported.
International Nuclear Information System (INIS)
Alnayli, R.Sh.
2010-01-01
Complete text of publication follows. A dialed theoretical studies on performances of the ideal RTP crystal for the electro optical applications as Q-switching laser operation and for nonlinear optics application as second harmonics generation are accomplished in this paper. Single or pair RTP crystal of excellent quality with dimensions 5 x 5 x 7.5 mm 3 have proposed as element model to combined Q-switching operation and frequency doublers for 1.06 μm wave length laser. In order to get and interpolate the optimum conditions to combined both of these operations by application this RTP model. The main am of this work was investigated the most influent parameters on the performance of the electro optical Q-switching laser operation such as, the voltage requirement, contrast and extinction ratios, the birefringence effective and withstand threshold on the other hand the influences of the ray walk off, thermal effective on the efficiency of the second harmonics generation as well are investigated. The results were satisfied for the goals of this paper.
Concept for power scaling second harmonic generation using a cascade of nonlinear crystals
DEFF Research Database (Denmark)
Hansen, Anders Kragh; Tawfieq, Mahmoud; Jensen, Ole Bjarlin
2015-01-01
for efficient power scaling of single-pass SHG beyond such limits using a cascade of nonlinear crystals, in which the first crystal is chosen for high nonlinear efficiency and the subsequent crystal(s) are chosen for power handling ability. Using this highly efficient singlepass concept, we generate 3.7 W...... successfully combines the high efficiency of the first stage with the good power handling properties of the subsequent stages. The concept is generally applicable and can be expanded with more stages to obtain even higher efficiency, and extends also to other combinations of nonlinear media suitable for other......Within the field of high-power second harmonic generation (SHG), power scaling is often hindered by adverse crystal effects such as thermal dephasing arising from the second harmonic (SH) light, which imposes limits on the power that can be generated in many crystals. Here we demonstrate a concept...
International Nuclear Information System (INIS)
Li Wei; Feng Guoying; Li Gang; Huang Yu; Zhang Qiuhui
2009-01-01
Second-harmonic generation (SHG) of high-intensity laser with an SHG crystal for type I angle phase matching has been studied by the use of a split-step algorithm based on the fast Fourier transform and a fourth-order Runge-Kutta (R-K) integrator. The transverse walk-off effect, diffraction, the second-order and the third-order nonlinear effects have been taken into consideration. Influences of a temperature rise distribution of the SHG crystal on the refractive indices of ordinary wave and extraordinary wave have been discussed. The rules of phase mismatching quantity, intensity distribution of output beam and frequency conversion efficiency varying with the temperature rise distribution of the SHG crystal have been analyzed quantitatively. The calculated results indicate that in a high power frequency conversion system, the temperature rise distribution of SHG crystal would result in the phase mismatching of fundamental and harmonic waves, leading to the variation of intensity distribution of the output beam and the decrease of the conversion efficiency. (authors)
Harmonic Interaction Analysis in Grid Connected Converter using Harmonic State Space (HSS) Modeling
DEFF Research Database (Denmark)
Kwon, Jun Bum; Wang, Xiongfei; Bak, Claus Leth
2015-01-01
-model, are introduced to analyze these problems. However, it is found that Linear Time Invariant (LTI) base model analysis makes it difficult to analyze these phenomenon because of time varying system operation trajectories, varying output impedance seen by grid connected systems and neglected switching component......An increasing number of power electronics based Distributed Generation (DG) systems and loads generate coupled harmonic as well as non-characteristic harmonic with each other. Several methods like impedance based analysis, which is derived from conventional small signal- and average...... during the modeling process. This paper investigates grid connected converter by means of Harmonic State Space (HSS) small signal model, which is modeled from Linear Time varying Periodically (LTP) system. Further, a grid connected converter harmonic matrix is investigated to analyze the harmonic...
Towards protein-crystal centering using second-harmonic generation (SHG) microscopy
International Nuclear Information System (INIS)
Kissick, David J.; Dettmar, Christopher M.; Becker, Michael; Mulichak, Anne M.; Cherezov, Vadim; Ginell, Stephan L.; Battaile, Kevin P.; Keefe, Lisa J.; Fischetti, Robert F.; Simpson, Garth J.
2013-01-01
The potential of second-harmonic generation (SHG) microscopy for automated crystal centering to guide synchrotron X-ray diffraction of protein crystals has been explored. The potential of second-harmonic generation (SHG) microscopy for automated crystal centering to guide synchrotron X-ray diffraction of protein crystals was explored. These studies included (i) comparison of microcrystal positions in cryoloops as determined by SHG imaging and by X-ray diffraction rastering and (ii) X-ray structure determinations of selected proteins to investigate the potential for laser-induced damage from SHG imaging. In studies using β 2 adrenergic receptor membrane-protein crystals prepared in lipidic mesophase, the crystal locations identified by SHG images obtained in transmission mode were found to correlate well with the crystal locations identified by raster scanning using an X-ray minibeam. SHG imaging was found to provide about 2 µm spatial resolution and shorter image-acquisition times. The general insensitivity of SHG images to optical scatter enabled the reliable identification of microcrystals within opaque cryocooled lipidic mesophases that were not identified by conventional bright-field imaging. The potential impact of extended exposure of protein crystals to five times a typical imaging dose from an ultrafast laser source was also assessed. Measurements of myoglobin and thaumatin crystals resulted in no statistically significant differences between structures obtained from diffraction data acquired from exposed and unexposed regions of single crystals. Practical constraints for integrating SHG imaging into an active beamline for routine automated crystal centering are discussed
Sequence Domain Harmonic Modeling of Type-IV Wind Turbines
DEFF Research Database (Denmark)
Guest, Emerson; Jensen, Kim Høj; Rasmussen, Tonny Wederberg
2017-01-01
-sampled pulsewidth modulation and an analysis of converter generated voltage harmonics due to compensated dead-time. The decoupling capabilities of the proposed the SD harmonic model are verified through a power quality (PQ) assessment of a 3MW Type-IV wind turbine. The assessment shows that the magnitude and phase...... of low-order odd converter generated voltage harmonics are dependent on the converter operating point and the phase of the fundamental component of converter current respectively. The SD harmonic model can be used to make PQ assessments of Type-IV wind turbines or incorporated into harmonic load flows...... for computation of PQ in wind power plants....
Input Harmonic Analysis on the Slim DC-Link Drive Using Harmonic State Space Model
DEFF Research Database (Denmark)
Yang, Feng; Kwon, Jun Bum; Wang, Xiongfei
2017-01-01
The harmonic performance of the slim dc-link adjustable speed drives has shown good performance in some studies but poor in some others. The contradiction indicates that a feasible theoretical analysis is still lacking to characterize the harmonic distortion for the slim dc-link drive. Considerin...... results of the slim dc-link drive, loaded up to 2.0 kW, are presented to validate the theoretical analysis....... variation according to the switching instant, the harmonics at the steady-state condition, as well as the coupling between the multiple harmonic impedances. By using this model, the impaction on the harmonics performance by the film capacitor and the grid inductance is derived. Simulation and experimental...
Harmonic Interaction Analysis in Grid-connected Converter using Harmonic State Space (HSS) Modeling
DEFF Research Database (Denmark)
Kwon, Jun Bum; Wang, Xiongfei; Blaabjerg, Frede
2017-01-01
research about the harmonic interaction. However, it is found that the Linear Time Invariant (LTI) based model analysis makes it difficult to analyze these phenomena because of the time-varying properties of the power electronic based systems. This paper investigates grid-connected converter by using......An increasing number of power electronic based Distributed Generation (DG) systems and loads generate not only characteristic harmonics but also unexpected harmonics. Several methods like impedance based analysis, which are derived from the conventional average model, are introduced to perform...
A structure and second-harmonic generation of crystals Li B3O5
International Nuclear Information System (INIS)
Burak, Ya.V.
1997-01-01
Projections of atoms of nonlinear optical crystals Li B 3 O 5 onto planes perpendicular to directions of the phase matching of type-1 and type-2 for second-harmonic generation (SHG) in a YAG:Nd laser are constructed. Analyses of the interdependence of orientations of (B 3 O 7 ) 5 -complexes and of the effectiveness of SHG are conducted
Towards protein-crystal centering using second-harmonic generation (SHG) microscopy
Energy Technology Data Exchange (ETDEWEB)
Kissick, David J.; Dettmar, Christopher M. [Purdue University, West Lafayette, IN 47907 (United States); Becker, Michael [Argonne National Laboratory, Argonne, IL 60439 (United States); Mulichak, Anne M. [Hauptman–Woodward Medical Research Institute, Argonne, IL 60439 (United States); Cherezov, Vadim [The Scripps Research Institute, La Jolla, CA 92037 (United States); Ginell, Stephan L. [Argonne National Laboratory, Argonne, IL 60439 (United States); Battaile, Kevin P.; Keefe, Lisa J. [Hauptman–Woodward Medical Research Institute, Argonne, IL 60439 (United States); Fischetti, Robert F. [Argonne National Laboratory, Argonne, IL 60439 (United States); Simpson, Garth J., E-mail: gsimpson@purdue.edu [Purdue University, West Lafayette, IN 47907 (United States)
2013-05-01
The potential of second-harmonic generation (SHG) microscopy for automated crystal centering to guide synchrotron X-ray diffraction of protein crystals has been explored. The potential of second-harmonic generation (SHG) microscopy for automated crystal centering to guide synchrotron X-ray diffraction of protein crystals was explored. These studies included (i) comparison of microcrystal positions in cryoloops as determined by SHG imaging and by X-ray diffraction rastering and (ii) X-ray structure determinations of selected proteins to investigate the potential for laser-induced damage from SHG imaging. In studies using β{sub 2} adrenergic receptor membrane-protein crystals prepared in lipidic mesophase, the crystal locations identified by SHG images obtained in transmission mode were found to correlate well with the crystal locations identified by raster scanning using an X-ray minibeam. SHG imaging was found to provide about 2 µm spatial resolution and shorter image-acquisition times. The general insensitivity of SHG images to optical scatter enabled the reliable identification of microcrystals within opaque cryocooled lipidic mesophases that were not identified by conventional bright-field imaging. The potential impact of extended exposure of protein crystals to five times a typical imaging dose from an ultrafast laser source was also assessed. Measurements of myoglobin and thaumatin crystals resulted in no statistically significant differences between structures obtained from diffraction data acquired from exposed and unexposed regions of single crystals. Practical constraints for integrating SHG imaging into an active beamline for routine automated crystal centering are discussed.
Energy Technology Data Exchange (ETDEWEB)
Trull, J.; Wang, B.; Parra, A.; Vilaseca, R.; Cojocaru, C. [Departament de Física i Enginyeria Nuclear, Universitat Politècnica Catalunya, Terrassa 08222 (Spain); Sola, I. [Grupo de Investigación en Óptica Extrema (GIOE), Departamento de Física Aplicada, Universidad de Salamanca, Plaza de la Merced s/n, 37008 Salamanca (Spain); Krolikowski, W. [Laser Physics Centre, Research School of Physics and Engineering, Australian National University, Canberra ACT 0200 (Australia); Science Program, Texas A and M University at Qatar, Doha (Qatar); Sheng, Y. [Laser Physics Centre, Research School of Physics and Engineering, Australian National University, Canberra ACT 0200 (Australia)
2015-06-01
Pulse compression in dispersive strontium barium niobate crystal with a random size and distribution of the anti-parallel orientated nonlinear domains is observed via transverse second harmonic generation. The dependence of the transverse width of the second harmonic trace along the propagation direction allows for the determination of the initial chirp and duration of pulses in the femtosecond regime. This technique permits a real-time analysis of the pulse evolution and facilitates fast in-situ correction of pulse chirp acquired in the propagation through an optical system.
International Nuclear Information System (INIS)
Trull, J.; Wang, B.; Parra, A.; Vilaseca, R.; Cojocaru, C.; Sola, I.; Krolikowski, W.; Sheng, Y.
2015-01-01
Pulse compression in dispersive strontium barium niobate crystal with a random size and distribution of the anti-parallel orientated nonlinear domains is observed via transverse second harmonic generation. The dependence of the transverse width of the second harmonic trace along the propagation direction allows for the determination of the initial chirp and duration of pulses in the femtosecond regime. This technique permits a real-time analysis of the pulse evolution and facilitates fast in-situ correction of pulse chirp acquired in the propagation through an optical system
International Nuclear Information System (INIS)
Mishina, E.D.; Morozov, A.I.; Sigov, A.S.; Sherstyuk, N.Eh.; Aktsipetrov, O.A.; Lemanov, V.V.; Rasing, Th.
2002-01-01
The surface phase transition in the SrTiO 3 crystal is studied through the method of the second optical harmonic generation. The peculiarities in the nonlinear-optical response are identified at the temperature of T* = 145 K, which by 40 K exceeds the T c temperature of the structural phase transition in the crystal volume. The phenomenon of the nonlinear critical opalescence, caused by availability of the point defects, is studied. The second harmonic field and critical opalescence intensity are calculated on the basis of the phenomenological model of the nonlinear-optical processes with application of the Landau phase transition theory [ru
Diffractive-refractive optics: (+,-,-,+) X-ray crystal monochromator with harmonics separation
Czech Academy of Sciences Publication Activity Database
Hrdý, Jaromír; Mikulík, P.; Oberta, Peter
2011-01-01
Roč. 18, č. 2 (2011), s. 299-301 ISSN 0909-0495 R&D Projects: GA MPO FR-TI1/412 Institutional research plan: CEZ:AV0Z10100522 Keywords : diffractive-refractive optics * x-ray synchrotron radiation monochromator * x-ray crystal monochromator * harmonics separation Subject RIV: BH - Optics, Masers, Lasers Impact factor: 2.726, year: 2011
Building Mathematical Models of Simple Harmonic and Damped Motion.
Edwards, Thomas
1995-01-01
By developing a sequence of mathematical models of harmonic motion, shows that mathematical models are not right or wrong, but instead are better or poorer representations of the problem situation. (MKR)
Gapontsev, Valentin P; Tyrtyshnyy, Valentin A; Vershinin, Oleg I; Davydov, Boris L; Oulianov, Dmitri A
2013-02-11
We present a method of third harmonic generation at 355 nm by frequency mixing of fundamental and second harmonic radiation of an ytterbium nanosecond pulsed all-fiber laser in a type-I phase-matched LiB(3)O(5) (LBO) crystal where originally orthogonal polarization planes of the fundamental and second harmonic beams are aligned by an optically active quartz crystal. 8 W of ultraviolet light at 355 nm were achieved with 40% conversion efficiency from 1064 nm radiation. The conversion efficiency obtained in a type-I phase-matched LBO THG crystal was 1.6 times higher than the one achieved in a type-II LBO crystal at similar experimental conditions. In comparison to half-wave plates traditionally used for polarization alignment the optically active quartz crystal has much lower temperature dependence and requires simpler optical alignment.
Intelligent harmonic load model based on neural networks
Ji, Pyeong-Shik; Lee, Dae-Jong; Lee, Jong-Pil; Park, Jae-Won; Lim, Jae-Yoon
2007-12-01
In this study, we developed a RBFNs(Radial Basis Function Networks) based load modeling method with harmonic components. The developed method implemented by using harmonic information as well as fundamental frequency and voltage which are essential input factors in conventional method. Thus, the proposed method makes it possible to effectively estimate load characteristics in power lines with harmonics. The RBFNs have certain advantage such as simple structure and rapid computation ability compared with multilayer perceptron which is extensively applied for load modeling. To show the effectiveness, the proposed method has been intensively tested with various dataset acquired under the different frequency and voltage and compared it with conventional methods such as polynominal 2nd equation method, MLP and RBF without considering harmonic components.
Modeling of large aperture third harmonic frequency conversion of high power Nd:glass laser systems
International Nuclear Information System (INIS)
Henesian, M.A.; Wegner, P.J.; Speck, D.R.; Bibeau, C.; Ehrlich, R.B.; Laumann, C.W.; Lawson, J.K.; Weiland, T.L.
1991-01-01
To provide high-energy, high-power beams at short wavelengths for inertial-confinement-fusion experiments, we routinely convert the 1.053-μm output of the Nova, Nd:phosphate-glass, laser system to its third-harmonic wavelength. We describe performance and conversion efficiency modeling of the 3 x 3 arrays potassium-dihydrogen-phosphate crystal plates used for type II/type II phase-matched harmonic conversion of Nova 0.74-m diameter beams, and an alternate type I/type II phase-matching configuration that improves the third-harmonic conversion efficiency. These arrays provide energy conversion of up to 65% and intensity conversion to 70%. 19 refs., 11 figs
Calculation of optical second-harmonic susceptibilities and optical activity for crystals
International Nuclear Information System (INIS)
Levine, Z.H.
1994-01-01
A new generation of nearly first-principles calculations predicts both the linear and second-harmonic susceptibilities for a variety of insulating crystals, including GaAs, GaP, AlAs, AlP, Se, α-quartz, and c-urea. The results are typically in agreement with experimental measurements. The calculations have been extended to optical activity, with somewhat less success to date. The theory, based on a simple self-energy correction to the local density approximation, and results are reviewed herein
DEFF Research Database (Denmark)
Bozhevolnyi, Sergey I.; Volkov, V.S.; Søndergaard, Thomas
2002-01-01
We employ a collection scanning near-field optical microscope (SNOM) to image the propagation of light at telecommunication wavelengths along straight and bent regions of silicon-on-insulator photonic crystal waveguides (PCWs) formed by removing a single row of holes in the triangular 410-nm...... the interference between a quasihomogeneous background field and Bloch harmonics of the PCW mode, we account for spatial frequency spectra of the intensity variations and determine the propagation constant of the PCW mode at 1520 nm. The possibilities and limitations of SNOM imaging for the characterization...
Atomically Phase-Matched Second-Harmonic Generation in a 2D Crystal
2016-08-26
OPEN ORIGINAL ARTICLE Atomically phase-matched second-harmonic generation in a 2D crystal Mervin Zhao1,2,*, Ziliang Ye1,2,*, Ryuji Suzuki3,4,*, Yu...photoluminescence mapping, Raman spectroscopy and atomic -force microscopy. (b) Image produced via scanning and gathering the SH light produced by the 3R-MoS2...arising from a single atomic layer, where the SH light elucidated important information such as the grain boundaries and electronic structure in these ultra
International Nuclear Information System (INIS)
Thomas, I.M.
1991-01-01
Potassium dihydrogen phosphate (KDP) crystals have been used as harmonic converters on the Nova laser at LLNL for over six years. All crystals were coated with a single layer, quarterwave AR coating of porous silica with a refractive index of 1.22. This was prepared by a sol-gel process and was applied from a colloidal suspension by spin coating at room temperature. A few crystals were also coated with a methyl silicone coating prior to the application of the AR coating for environmental protection. The initial optical performance of all crystals was very good but there has been some deterioration over the years because of environmental and laser damage degradation. The deterioration in the silicone samples was, however, much less than the others. We are now in the process of replacing all ten KDP arrays with new crystals and will apply the silicone undercoat to all samples. Recently we have been evaluating a new perfluorinated organic polymer coating which has a refractive index of 1.29. This material is soluble in fluorinated solvents and can be applied by dip coating from solution at room temperature. We hope that this can provide environmental protection when applied to KDP and also act as an AR coating at the same time. The optical performance is not as good as our porous silica because of the higher index; about 0.3% reflection per surface is obtained. 4 refs., 10 figs., 1 tab
Numerical modeling of Harmonic Imaging and Pulse Inversion fields
Humphrey, Victor F.; Duncan, Tracy M.; Duck, Francis
2003-10-01
Tissue Harmonic Imaging (THI) and Pulse Inversion (PI) Harmonic Imaging exploit the harmonics generated as a result of nonlinear propagation through tissue to improve the performance of imaging systems. A 3D finite difference model, that solves the KZK equation in the frequency domain, is used to investigate the finite amplitude fields produced by rectangular transducers driven with short pulses and their inverses, in water and homogeneous tissue. This enables the characteristic of the fields and the effective PI field to be calculated. The suppression of the fundamental field in PI is monitored, and the suppression of side lobes and a reduction in the effective beamwidth for each field are calculated. In addition, the differences between the pulse and inverse pulse spectra resulting from the use of very short pulses are noted, and the differences in the location of the fundamental and second harmonic spectral peaks observed.
Vasil'ev, M. G.
2017-02-01
A technique for measuring the crystal cross-sectional area with a weight sensor based on the difference between its readings at the extreme rod positions in the stepwise and continuous modes of modulation of the pulling rate is proposed for the low-thermal gradient Czochralski method. A change in the crystallization rate at harmonic oscillations of the pulling rate is estimated with the aim of conserving the quality of the growing crystal for this measurement method.
A simple mechanical model for the isotropic harmonic oscillator
International Nuclear Information System (INIS)
Nita, Gelu M
2010-01-01
A constrained elastic pendulum is proposed as a simple mechanical model for the isotropic harmonic oscillator. The conceptual and mathematical simplicity of this model recommends it as an effective pedagogical tool in teaching basic physics concepts at advanced high school and introductory undergraduate course levels.
Vigneshwaran, A. N.; Kalainathan, S.; Raja, C. Ramachandra
2018-03-01
Potassium pentaborate (KB5) is an excellent nonlinear optical material especially in the UV region. In this work, Li and NH4 doped KB5 crystals were grown using slow evaporation solution growth method. The incorporation of dopant has been confirmed and analysed by Energy dispersive X-ray analysis (EDAX), Inductively coupled plasma (ICP) analysis and Raman spectroscopy. The crystalline perfection of pure and doped KB5 crystals was studied by High resolution X-ray diffraction (HRXRD) analysis. Structural grain boundaries were observed in doped crystals. Second harmonic generation was confirmed for pure and doped crystals and output values revealed the enhancement of SHG efficiency in doped crystals. Resistance against laser damage was carried out using 1064 nm Nd-YAG laser of pulse width 10 ns. The laser damage threshold value is increased in Li doped crystal and decreased in NH4 doped crystal when compared to pure KB5 crystal.
Exploring harmonization between integrated assessment and capacity expansion models
Iyer, G.; Brown, M.; Cohen, S.; Macknick, J.; Patel, P.; Wise, M. A.; Horing, J.
2017-12-01
Forward-looking quantitative models of the electric sector are extensively used to provide science-based strategic decision support to national, international and private-sector entities. Given that these models are used to inform a wide-range of stakeholders and influence policy decisions, it is vital to examine how the models' underlying data and structure influence their outcomes. We conduct several experiments harmonizing key model characteristics between ReEDS—an electric sector only model, and GCAM—an integrated assessment model—to understand how different degrees of harmonization impact model outcomes. ReEDS has high spatial, temporal, and process detail but lacks electricity demand elasticity and endogenous representations of other economic sectors, while GCAM has internally consistent representations of energy (including the electric sector), agriculture, and land-use systems but relatively aggregate representations of the factors influencing electric sector investments . We vary the degree of harmonization in electricity demand, fuel prices, technology costs and performance, and variable renewable energy resource characteristics. We then identify the prominent sources of divergence in key outputs (electricity capacity, generation, and price) across the models and study how the convergence between models can be improved with permutations of harmonized characteristics. The remaining inconsistencies help to establish how differences in the models' underlying data, construction, perspective, and methodology play into each model's outcome. There are three broad contributions of this work. First, our study provides a framework to link models with similar scope but different resolutions. Second, our work provides insight into how the harmonization of assumptions contributes to a unified and robust portrayal of the US electricity sector under various potential futures. Finally, our study enhances the understanding of the influence of structural uncertainty
The Tax harmonization in open regionalism ; The European model
Directory of Open Access Journals (Sweden)
Mouloud MELIKAOUI
2014-06-01
Full Text Available This research examines the subject of alternative regionalism or open regionalism and reality within the multilateral trading system, based on growing liberalization of trade, and the problem of compatibility between them, as well as the limits of economic policy harmonization in the framework of Open regionalism, special tax harmonization, in the light of economic and tax disparities of the Member States, with an overview of the European tax harmonization and limits. The Study concluded the importance of tax harmonization as a tool by activation of the concept of open regionalism, through facilitating capitals flows and investments between member states and reduction of the négatives phenomena of tax. It recommended the need to emphasizing on the importance of gradually harmonization for tax policy, and expand the rule of tax treaties and exchange of tax information and experiences between countries, This is in light a holistic approach to other economic policies as a the exchange rate policy and monetary policy, just as is the case in the European model.
Harmonic Analyzing of the Double PWM Converter in DFIG Based on Mathematical Model
Directory of Open Access Journals (Sweden)
Jing Liu
2017-12-01
Full Text Available Harmonic pollution of double fed induction generators (DFIGs has become a vital concern for its undesirable effects on power quality issues of wind generation systems and grid-connected system, and the double pulse width modulation (PWMconverter is one of the main harmonic sources in DFIGs. Thus the harmonic analysis of the converter in DFIGs is a necessary step to evaluate their harmonic pollution of DFIGs. This paper proposes a detailed harmonic modeling method to discuss the main harmonic components in a converter. In general the harmonic modeling could be divided into the low-order harmonic part (up to 30th order and the high-order harmonic part (greater than order 30 parts in general. The low-order harmonics are produced by the circuit topology and control algorithm, and the harmonic component will be different if the control strategy changes. The high-order harmonics are produced by the modulation of the switching function to the dc variable. In this paper, the low-order harmonic modeling is established according to the directions of power flow under the vector control (VC, and the high-order harmonic modeling is established by the switching function of space vector PWM and dc currents. Meanwhile, the simulations of harmonic a components in a converter are accomplished in a real time digital simulation system. The results indicate that the proposed modeling could effectively show the harmonics distribution of the converter in DFIGs.
DEFF Research Database (Denmark)
Wiechowski, Wojciech Tomasz; Lykkegaard, Jan; Bak, Claus Leth
2007-01-01
In this paper two methods of validation of transmission network harmonic models are introduced. The methods were developed as a result of the work presented in [1]. The first method allows calculating the transfer harmonic impedance between two nodes of a network. Switching a linear, series network......, as for example a transmission line. Both methods require that harmonic measurements performed at two ends of the disconnected element are precisely synchronized....... are used for calculation of the transfer harmonic impedance between the nodes. The determined transfer harmonic impedance can be used to validate a computer model of the network. The second method is an extension of the fist one. It allows switching a series element that contains a shunt branch...
International Nuclear Information System (INIS)
Audzijonis, A.; Zigas, L.; Vinokurova, I.V.; Farberovic, O.V.; Zaltauskas, R.; Cijauskas, E.; Pauliukas, A.; Kvedaravicius, A.
2006-01-01
The force constants of SbSI crystal have been calculated by the pseudo-potential method. The frequencies and normal coordinates of SbSI vibration modes along the c (z) direction have been determined in harmonic approximation. The potential energies of SbSI normal modes dependence on normal coordinates along the c (z) direction V(z) have been determined in anharmonic approximation, taking into account the interaction between the phonons. It has been found, that in the range of 30-120 cm -1 , the vibrational spectrum is determined by a V(z) double-well normal mode, but in the range of 120-350 cm -1 , it is determined by a V(z) single-well normal mode
Directory of Open Access Journals (Sweden)
Yu-Shan Chen
2015-04-01
Full Text Available We reported that the photonic crystal fiber (PCF filled with TI:Bi2Te3 nanosheets solution could act as an effective saturable absorber (SA. Employing this TI-PCF SA device; we constructed an ytterbium-doped all-fiber laser oscillator and achieved the evanescent wave mode-locking operation. Due to the large cavity dispersion; the fundamental mode-locking pulse had the large full width at half maximum (FWHM of 2.33 ns with the repetition rate of ~1.11 MHz; and the radio frequency (RF spectrum with signal-to-noise ratio (SNR of 61 dB. In addition; the transition dynamics from a bunched state of pulses to harmonic mode-locking (HML was also observed; which was up to 26th order.
A Comprehensive and Harmonized Digital Forensic Investigation Process Model.
Valjarevic, Aleksandar; Venter, Hein S
2015-11-01
Performing a digital forensic investigation (DFI) requires a standardized and formalized process. There is currently neither an international standard nor does a global, harmonized DFI process (DFIP) exist. The authors studied existing state-of-the-art DFIP models and concluded that there are significant disparities pertaining to the number of processes, the scope, the hierarchical levels, and concepts applied. This paper proposes a comprehensive model that harmonizes existing models. An effort was made to incorporate all types of processes proposed by the existing models, including those aimed at achieving digital forensic readiness. The authors introduce a novel class of processes called concurrent processes. This is a novel contribution that should, together with the rest of the model, enable more efficient and effective DFI, while ensuring admissibility of digital evidence. Ultimately, the proposed model is intended to be used for different types of DFI and should lead to standardization. © 2015 American Academy of Forensic Sciences.
Monat, Christelle; Grillet, Christian; Corcoran, Bill; Moss, David J; Eggleton, Benjamin J; White, Thomas P; Krauss, Thomas F
2010-03-29
Using Fourier optics, we retrieve the wavevector dependence of the third-harmonic (green) light generated in a slow light silicon photonic crystal waveguide. We show that quasi-phase matching between the third-harmonic signal and the fundamental mode is provided in this geometry by coupling to the continuum of radiation modes above the light line. This process sustains third-harmonic generation with a relatively high efficiency and a substantial bandwidth limited only by the slow light window of the fundamental mode. The results give us insights into the physics of this nonlinear process in the presence of strong absorption and dispersion at visible wavelengths where bandstructure calculations are problematic. Since the characteristics (e.g. angular pattern) of the third-harmonic light primarily depend on the fundamental mode dispersion, they could be readily engineered.
Ma, Xiaohua; Fu, Limin; Zhao, Yunfeng; Ai, Xicheng; Zhang, Jianping; Han, Yu; Guo, Zhixin
2011-01-01
the moderate static first hyperpolarizabilities (β0) for both APNA [(136 Â± 5) Ã - 10-30 esu] and DPAPNA [(263 Â± 20) Ã - 10-30 esu], only APNA crystal shows a powder efficiency of second harmonic generation (SHG) of 23 times that of urea. It is shown
DEFF Research Database (Denmark)
Kwon, Jun Bum; Wang, Xiongfei; Bak, Claus Leth
2015-01-01
The increasing number of renewable energy sources at the distribution grid is becoming a major issue for utility companies, since the grid connected converters are operating at different operating points due to the probabilistic characteristics of renewable energy. Besides, typically, the harmonics...... proposes a new model of a single phase grid connected renewable energy source using the Harmonic State Space modeling approach, which is able to identify such problems and the model can be extended to be applied in the multiple connected converter analysis. The modeling results show the different harmonic...... and impedance from other renewable energy sources are not taken carefully into account in the installation and design. However, this may bring an unknown harmonic instability into the multiple power sourced system and also make the analysis difficult due to the complexity of the grid network. This paper...
A Harmonized Process Model for Digital Forensic Investigation Readiness
Valjarevic , Aleksandar; Venter , Hein
2013-01-01
Part 2: FORENSIC MODELS; International audience; Digital forensic readiness enables an organization to prepare itself to perform digital forensic investigations in an efficient and effective manner. The benefits include enhancing the admissibility of digital evidence, better utilization of resources and greater incident awareness. However, a harmonized process model for digital forensic readiness does not currently exist and, thus, there is a lack of effective and standardized implementations...
Modeling of photonic Crystal Fibres
DEFF Research Database (Denmark)
Bjarklev, Anders Overgaard; Broeng, Jes; Barkou, Stig Eigil
1999-01-01
Diferent theoretical models for analysis of photonic crystal fibres are reviewed and compaired. The methods span from simple scalar approaches to full-vectorial models using different mode-field decompositions. The specific advantages of the methods are evaluated.......Diferent theoretical models for analysis of photonic crystal fibres are reviewed and compaired. The methods span from simple scalar approaches to full-vectorial models using different mode-field decompositions. The specific advantages of the methods are evaluated....
Kinetic Modeling of Accelerated Stability Testing Enabled by Second Harmonic Generation Microscopy.
Song, Zhengtian; Sarkar, Sreya; Vogt, Andrew D; Danzer, Gerald D; Smith, Casey J; Gualtieri, Ellen J; Simpson, Garth J
2018-04-03
The low limits of detection afforded by second harmonic generation (SHG) microscopy coupled with image analysis algorithms enabled quantitative modeling of the temperature-dependent crystallization of active pharmaceutical ingredients (APIs) within amorphous solid dispersions (ASDs). ASDs, in which an API is maintained in an amorphous state within a polymer matrix, are finding increasing use to address solubility limitations of small-molecule APIs. Extensive stability testing is typically performed for ASD characterization, the time frame for which is often dictated by the earliest detectable onset of crystal formation. Here a study of accelerated stability testing on ritonavir, a human immunodeficiency virus (HIV) protease inhibitor, has been conducted. Under the condition for accelerated stability testing at 50 °C/75%RH and 40 °C/75%RH, ritonavir crystallization kinetics from amorphous solid dispersions were monitored by SHG microscopy. SHG microscopy coupled by image analysis yielded limits of detection for ritonavir crystals as low as 10 ppm, which is about 2 orders of magnitude lower than other methods currently available for crystallinity detection in ASDs. The four decade dynamic range of SHG microscopy enabled quantitative modeling with an established (JMAK) kinetic model. From the SHG images, nucleation and crystal growth rates were independently determined.
Sigma models in (4,4) harmonic superspace
International Nuclear Information System (INIS)
Ivanov, E.; Joint Inst. for Nuclear Research, Dubna; Sutulin, A.
1994-04-01
We define basics of (4,4) 2D harmonic superspace with two independent sets of SU(2) harmonic variables and apply it to construct new superfield actions of (4,4) supersymmetric two-dimensional sigma models with torsion and mutually commuting left and right complex structures, as well as of their massive deformations. We show that the generic off-shell sigma model action is the general action of constrained analytic superfields q (1,1) representing twisted N=4 multiplets in (4,4) harmonic superspace. The massive term of q (1,1) is shown to be unique; it generates a scalar potential the form of which is determined by the metric on the target bosonic manifold. We discuss in detail (4,4) supersymmetric group manifold SU(2)xU(1) WZNW sigma model and its Liouville deformation. A deep analogy of the relevant superconformally invariant analytic superfield action to that of the improved tensor N=2 4D multiplet is found. We define (4,4) duality transformation and find new off-shell dual representations of the previously constructed actions via unconstrained analytic (4,4) superfields. The main peculiarities of the (4,4) duality transformation are: (i) It preserves manifest (4,4) supersymmetry; (ii) dual actions reveal a gauge invariance needed for the onshell equivalence to the original description; (iii) in the actions dual to the massive ones 2D supersymmetry is modified off shell by SU(2) tensor central charges. The dual representation suggests some hints of how to describe (4,4) models with non-commuting complex structures in the harmonic superspace. (orig.)
Policy harmonized approach for the EU agricultural sector modelling
Directory of Open Access Journals (Sweden)
G. SALPUTRA
2008-12-01
Full Text Available Policy harmonized (PH approach allows for the quantitative assessment of the impact of various elements of EU CAP direct support schemes, where the production effects of direct payments are accounted through reaction prices formed by producer price and policy price add-ons. Using the AGMEMOD model the impacts of two possible EU agricultural policy scenarios upon beef production have been analysed full decoupling with a switch from historical to regional Single Payment scheme or alternatively with re-distribution of country direct payment envelopes via introduction of EU-wide flat area payment. The PH approach, by systematizing and harmonizing the management and use of policy data, ensures that projected differential policy impacts arising from changes in common EU policies reflect the likely actual differential impact as opposed to differences in how common policies are implemented within analytical models. In the second section of the paper the AGMEMOD models structure is explained. The policy harmonized evaluation method is presented in the third section. Results from an application of the PH approach are presented and discussed in the papers penultimate section, while section 5 concludes.;
Modeling and Identification of Harmonic Instability Problems In Wind Farms
DEFF Research Database (Denmark)
Ebrahimzadeh, Esmaeil; Blaabjerg, Frede; Wang, Xiongfei
2016-01-01
In power electronics based power systems like wind farms, the interactions between the inner control systems of the power converters and the passive components may lead to high frequency oscillations, which can be called harmonic instability. In this paper, a simple methodology is presented...... to identify harmonic instability problems in wind farms, where many wind turbines, cables, transformers, capacitor banks, shunt reactors, etc, typically are located. This methodology introduces the wind farm as a Multi-Input Multi-Outpur (MIMO) control system, where the linearized models of fast inner control....../EMTDC software environment for a 400-MW wind farm. The proposed analytical analysis method and time-domain simulation results show that both dynamics of the power electronic converter and the parameters of the passive component can effect on the wind farm stability....
Modeling liquid crystal polymeric devices
Gimenez Pinto, Vianney Karina
The main focus of this work is the theoretical and numerical study of materials that combine liquid crystal and polymer. Liquid crystal elastomers are polymeric materials that exhibit both the ordered properties of the liquid crystals and the elastic properties of rubbers. Changing the order of the liquid crystal molecules within the polymer network can induce shape change. These materials are very valuable for applications such as actuators, sensors, artificial muscles, haptic displays, etc. In this work we apply finite element elastodynamics simulations to study the temperature induced shape deformation in nematic elastomers with complex director microstructure. In another topic, we propose a novel numerical method to model the director dynamics and microstructural evolution of three dimensional nematic and cholesteric liquid crystals. Numerical studies presented in this work are in agreement with experimental observations and provide insight into the design of application devices.
A Model for Semantic Equivalence Discovery for Harmonizing Master Data
Piprani, Baba
IT projects often face the challenge of harmonizing metadata and data so as to have a "single" version of the truth. Determining equivalency of multiple data instances against the given type, or set of types, is mandatory in establishing master data legitimacy in a data set that contains multiple incarnations of instances belonging to the same semantic data record . The results of a real-life application define how measuring criteria and equivalence path determination were established via a set of "probes" in conjunction with a score-card approach. There is a need for a suite of supporting models to help determine master data equivalency towards entity resolution—including mapping models, transform models, selection models, match models, an audit and control model, a scorecard model, a rating model. An ORM schema defines the set of supporting models along with their incarnation into an attribute based model as implemented in an RDBMS.
Crystal study and econometric model
1975-01-01
An econometric model was developed that can be used to predict demand and supply figures for crystals over a time horizon roughly concurrent with that of NASA's Space Shuttle Program - that is, 1975 through 1990. The model includes an equation to predict the impact on investment in the crystal-growing industry. Actually, two models are presented. The first is a theoretical model which follows rather strictly the standard theoretical economic concepts involved in supply and demand analysis, and a modified version of the model was developed which, though not quite as theoretically sound, was testable utilizing existing data sources.
Harmonic current prediction by impedance modeling of grid-tied inverters
DEFF Research Database (Denmark)
Pereira, Heverton A.; Freijedo, Francisco D.; Silva, M. M.
2017-01-01
and harmonic voltage profiles. Results reinforce that impedance models can represent with relatively accuracy the harmonic current emitted by the PV plants at the point of common coupling (PCC). Lastly, a stress test is performed to show how a variation in the harmonic voltage phase angle impacts the PV plant...... impedance models when used in harmonic integration studies. It is aimed to estimate the harmonic current contribution as a function of the background harmonic voltages components. Time domain simulations based on detailed and average models are compared with the impedance model developed in frequency domain....... In grids with harmonic voltages, impedance models can predict the current distortion for all active power injection scenarios. Furthermore, measurements in a 1.4 MW PV plant connected in a distributed grid are used to validate the simulation based on impedance models during different power injections...
Prasanyaa, T.; Jayaramakrishnan, V.; Haris, M.
2013-03-01
In this paper, we report the successful growth of pure, Cu2+ ions and Cd2+ ions doped on ninhydrin single crystals by slow solvent evaporation technique. The presence of Cu2+ and Cd2+ ions in the specimen of ninhydrin single crystal has been determined by atomic absorption spectroscopy. The powder X-ray diffraction analysis was done to calculate the lattice parameters of the pure and doped crystals. The percentage of transmittance of the crystal was recorded using the UV-Vis Spectrophotometer. Thermal behaviors of the grown crystals have been examined by the thermal gravimetric/differential thermal analysis. The hardness of the grown crystals was assessed and the results show the minor variation in the hardness value for the pure and doped ninhydrin samples. The value of the work hardening coefficient n was found to be 2.0, 1.0 and 1.06 for pure, copper and cadmium doped ninhydrin crystals respectively. The second harmonic generation efficiency of Cd2+ and Cu2+ doped ninhydrin is 8.3 and 6.3 times greater than well known nonlinear crystal of potassium dihydrogen phosphate respectively. The antibacterial and antifungal activities of the title compound were performed by disk diffusion method against the standard bacteria Escherichia coli, Xanthomonas oryzae and against the fungus Aspergillis niger and Aspergillus flavus.
Modelling and Analysis of DFIG Wind Turbine Harmonics Generated in Grids
A.Chilambuchelvan; B.BabyPriya,
2010-01-01
In this paper an analytic technique for modelling harmonics is proposed for a DFIG wind turbine connected to the grid. An algorithm based on Hilbert transform for the analysis of harmonics in power systems isdeveloped. The simulation results prove the effectiveness of the Hilbert Transform (HT) for power harmonic analysis in DFIG wind turbine connected to a grid.
Modeling stock return distributions with a quantum harmonic oscillator
Ahn, K.; Choi, M. Y.; Dai, B.; Sohn, S.; Yang, B.
2017-11-01
We propose a quantum harmonic oscillator as a model for the market force which draws a stock return from short-run fluctuations to the long-run equilibrium. The stochastic equation governing our model is transformed into a Schrödinger equation, the solution of which features “quantized” eigenfunctions. Consequently, stock returns follow a mixed χ distribution, which describes Gaussian and non-Gaussian features. Analyzing the Financial Times Stock Exchange (FTSE) All Share Index, we demonstrate that our model outperforms traditional stochastic process models, e.g., the geometric Brownian motion and the Heston model, with smaller fitting errors and better goodness-of-fit statistics. In addition, making use of analogy, we provide an economic rationale of the physics concepts such as the eigenstate, eigenenergy, and angular frequency, which sheds light on the relationship between finance and econophysics literature.
Ma, Xiaohua
2011-03-01
Achiral nonlinear optical (NLO) chromophores 1,3-diazaazulene derivatives, 2-(4â€-aminophenyl)-6-nitro-1,3-diazaazulene (APNA) and 2-(4â€-N,N-diphenylaminophenyl)-6-nitro-1,3-diazaazulene (DPAPNA), were synthesized with high yield. Despite the moderate static first hyperpolarizabilities (β0) for both APNA [(136 Â± 5) Ã - 10-30 esu] and DPAPNA [(263 Â± 20) Ã - 10-30 esu], only APNA crystal shows a powder efficiency of second harmonic generation (SHG) of 23 times that of urea. It is shown that the APNA crystallization driven cooperatively by the strong H-bonding network and the dipolar electrostatic interactions falls into the noncentrosymmetric P2 12121 space group, and that the helical supramolecular assembly is solely responsible for the efficient SHG response. To the contrary, the DPAPNA crystal with centrosymmetric P-1 space group is packed with antiparalleling dimmers, and is therefore completely SHG-inactive. 1,3-Diazaazulene derivatives are suggested to be potent building blocks for SHG-active chiral crystals, which are advantageous in high thermal stability, excellent near-infrared transparency and high degree of designing flexibility. © 2011 Wiley Periodicals, Inc. J Polym Sci Part B: Polym Phys, 2011 Optical crystals based on 1,3-diazaazulene derivatives are reported as the first example of organic nonlinear optical crystal whose second harmonic generation activity is found to originate solely from the chirality of their helical supramolecular orientation. The strong H-bond network forming between adjacent choromophores is found to act cooperatively with dipolar electrostatic interactions in driving the chiral crystallization of this material. Copyright © 2011 Wiley Periodicals, Inc.
Precise Model Analysis for 3-phase High Power Converter using the Harmonic State Space Modeling
DEFF Research Database (Denmark)
Kwon, Jun Bum; Wang, Xiongfei; Blaabjerg, Frede
2015-01-01
This paper presents about the generalized multi-frequency modeling and analysis methodology, which can be used in control loop design and stability analysis. In terms of the switching frequency of high power converter, there can be harmonics interruption if the voltage source converter has a low...... switching frequency ratio or multi-sampling frequency. The range of the control bandwidth can include the switching component. Thus, the systems become unstable. This paper applies the Harmonic State Space (HSS) Modeling method in order to find out the transfer function for each harmonics terms...
Crystallization Kinetics within a Generic Modelling Framework
DEFF Research Database (Denmark)
Meisler, Kresten Troelstrup; von Solms, Nicolas; Gernaey, Krist
2013-01-01
An existing generic modelling framework has been expanded with tools for kinetic model analysis. The analysis of kinetics is carried out within the framework where kinetic constitutive models are collected, analysed and utilized for the simulation of crystallization operations. A modelling...... procedure is proposed to gain the information of crystallization operation kinetic model analysis and utilize this for faster evaluation of crystallization operations....
Global GPS Ionospheric Modelling Using Spherical Harmonic Expansion Approach
Directory of Open Access Journals (Sweden)
Byung-Kyu Choi
2010-12-01
Full Text Available In this study, we developed a global ionosphere model based on measurements from a worldwide network of global positioning system (GPS. The total number of the international GPS reference stations for development of ionospheric model is about 100 and the spherical harmonic expansion approach as a mathematical method was used. In order to produce the ionospheric total electron content (TEC based on grid form, we defined spatial resolution of 2.0 degree and 5.0 degree in latitude and longitude, respectively. Two-dimensional TEC maps were constructed within the interval of one hour, and have a high temporal resolution compared to global ionosphere maps which are produced by several analysis centers. As a result, we could detect the sudden increase of TEC by processing GPS observables on 29 October, 2003 when the massive solar flare took place.
Venus spherical harmonic gravity model to degree and order 60
Konopliv, Alex S.; Sjogren, William L.
1994-01-01
The Magellan and Pioneer Venus Orbiter radiometric tracking data sets have been combined to produce a 60th degree and order spherical harmonic gravity field. The Magellan data include the high-precision X-band gravity tracking from September 1992 to May 1993 and post-aerobraking data up to January 5, 1994. Gravity models are presented from the application of Kaula's power rule for Venus and an alternative a priori method using surface accelerations. Results are given as vertical gravity acceleration at the reference surface, geoid, vertical Bouguer, and vertical isostatic maps with errors for the vertical gravity and geoid maps included. Correlation of the gravity with topography for the different models is also discussed.
Modeling the isochronal crystallization kinetics
International Nuclear Information System (INIS)
Sahay, S.S.; Krishnan, Karthik
2004-01-01
The classical Johnson-Mehl-Avrami-Kolmogorov (JMAK) model, originally formulated for the isothermal condition, is often used in conjunction with additivity principle for modeling the non-isothermal crystallization kinetics. This approach at times results in significant differences between the model prediction and experimental data. In this article, a modification to this approach has been imposed via an additional functional relationship between the activation energy and heating rate. The methodology has been validated with experimental isochronal crystallization kinetic data in Se 71 Te 20 Sb 9 glass and Ge 20 Te 80 systems. It has been shown that the functional relationship between heating rate and activation energy, ascribed to the reduction in apparent activation energy due to increasing non-isothermality, provides better phenomenological description and therefore improves the prediction capability of the JMAK model under isochronal condition
Marx-Glowna, Berit; Schulze, Kai S; Uschmann, Ingo; Kämpfer, Tino; Weber, Günter; Hahn, Christoph; Wille, Hans Christian; Schlage, Kai; Röhlsberger, Ralf; Förster, Eckhart; Stöhlker, Thomas; Paulus, Gerhard G
2015-09-01
The spectrum of the undulator radiation of beamline P01 at Petra III has been measured after passing a multiple reflection channel-cut polarimeter. Odd and even harmonics up to the 15th order, as well as Compton peaks which were produced by the high harmonics in the spectrum, could been measured. These additional contributions can have a tremendous influence on the performance of the polarimeter and have to be taken into account for further polarimeter designs.
Computer modeling of liquid crystals
International Nuclear Information System (INIS)
Al-Barwani, M.S.
1999-01-01
In this thesis, we investigate several aspects of the behaviour of liquid crystal molecules near interfaces using computer simulation. We briefly discuss experiment, theoretical and computer simulation studies of some of the liquid crystal interfaces. We then describe three essentially independent research topics. The first of these concerns extensive simulations of a liquid crystal formed by long flexible molecules. We examined the bulk behaviour of the model and its structure. Studies of a film of smectic liquid crystal surrounded by vapour were also carried out. Extensive simulations were also done for a long-molecule/short-molecule mixture, studies were then carried out to investigate the liquid-vapour interface of the mixture. Next, we report the results of large scale simulations of soft-spherocylinders of two different lengths. We examined the bulk coexistence of the nematic and isotropic phases of the model. Once the bulk coexistence behaviour was known, properties of the nematic-isotropic interface were investigated. This was done by fitting order parameter and density profiles to appropriate mathematical functions and calculating the biaxial order parameter. We briefly discuss the ordering at the interfaces and make attempts to calculate the surface tension. Finally, in our third project, we study the effects of different surface topographies on creating bistable nematic liquid crystal devices. This was carried out using a model based on the discretisation of the free energy on a lattice. We use simulation to find the lowest energy states and investigate if they are degenerate in energy. We also test our model by studying the Frederiks transition and comparing with analytical and other simulation results. (author)
Deniset-Besseau, A.; De Sa Peixoto, P.; Duboisset, J.; Loison, C.; Hache, F.; Benichou, E.; Brevet, P.-F.; Mosser, G.; Schanne-Klein, M.-C.
2010-02-01
Collagen is characterized by triple helical domains and plays a central role in the formation of fibrillar and microfibrillar networks, basement membranes, as well as other structures of the connective tissue. Remarkably, fibrillar collagen exhibits efficient Second Harmonic Generation (SHG) and SHG microscopy proved to be a sensitive tool to score fibrotic pathologies. However, the nonlinear optical response of fibrillar collagen is not fully characterized yet and quantitative data are required to further process SHG images. We therefore performed Hyper-Rayleigh Scattering (HRS) experiments and measured a second order hyperpolarisability of 1.25 10-27 esu for rat-tail type I collagen. This value is surprisingly large considering that collagen presents no strong harmonophore in its amino-acid sequence. In order to get insight into the physical origin of this nonlinear process, we performed HRS measurements after denaturation of the collagen triple helix and for a collagen-like short model peptide [(Pro-Pro-Gly)10]3. It showed that the collagen large nonlinear response originates in the tight alignment of a large number of weakly efficient harmonophores, presumably the peptide bonds, resulting in a coherent amplification of the nonlinear signal along the triple helix. To illustrate this mechanism, we successfully recorded SHG images in collagen liquid solutions by achieving liquid crystalline ordering of the collagen triple helices.
Murzina, T. V.; Kim, E. M.; Kapra, R. V.; Moshnina, I. V.; Aktsipetrov, O. A.; Kurdyukov, D. A.; Kaplan, S. F.; Golubev, V. G.; Bader, M. A.; Marowsky, G.
2006-01-01
Three-dimensional magnetophotonic crystals (MPCs) based on artificial opals infiltrated by yttrium iron garnet (YIG) are fabricated and their structural, optical, and nonlinear optical properties are studied. The formation of the crystalline YIG inside the opal matrix is checked by x-ray analysis. Two templates are used for the infiltration by YIG: bare opals and those covered by a thin platinum film. Optical second-harmonic generation (SHG) technique is used to study the magnetization-induced nonlinear-optical properties of the composed MPCs. A high nonlinear magneto-optical Kerr effect in the SHG intensity is observed at the edge of the photonic band gap of the MPCs.
Modelling of photonic crystal fibres
DEFF Research Database (Denmark)
Knudsen, Erik
2003-01-01
, as well as a honeycomb bandgap fibre and the first analysis of semi-periodic layered air-hole fibres. Using the modelling framework established as a basis, we provide an analysis of microbend loss, by regarding displacement of a fibre core as a stationary stochastic process, inducing mismatch between......In the presenta ph.d. work a theoretical study of aspects of modelling photonic crystal fibres was carried out. Photonic crystal fibres form a class of optical waveguides where guidance is no longer provided by a difference in refractive index between core and cladding. Instead, guidance...... is provided by an arrangement of air-holes running along the length of the fibre. Depending on the geometry of the fibre, the guiding mechanism may be either arising from the formation of a photonic bandgap in the cladding structure (photonic bandgap fibre), or by an effect resembling total internal...
Modelling of UWB Antenna Perturbed by Human Phantom in Spherical Harmonics Space
DEFF Research Database (Denmark)
Mhedhbi, Meriem; Avrillon, Stephane; Pedersen, Troels
2014-01-01
is attractive for simulation purposes. We propose a simple model for the spherical harmonics coefficients allowing to predict the antenna behavior perturbed by a human phantom. The model is based on knowledge of the spherical harmonic coefficients of antenna in free space and the antenna-phantom distance.......In this paper we study how the antenna radiation pattern is perturbed in the presence of a human phantom in terms of changes in the coefficients of the spherical harmonic antenna representation. The spherical harmonic basis allows for a compact representation of the antenna pattern which...
Electricity prices forecasting by automatic dynamic harmonic regression models
International Nuclear Information System (INIS)
Pedregal, Diego J.; Trapero, Juan R.
2007-01-01
The changes experienced by electricity markets in recent years have created the necessity for more accurate forecast tools of electricity prices, both for producers and consumers. Many methodologies have been applied to this aim, but in the view of the authors, state space models are not yet fully exploited. The present paper proposes a univariate dynamic harmonic regression model set up in a state space framework for forecasting prices in these markets. The advantages of the approach are threefold. Firstly, a fast automatic identification and estimation procedure is proposed based on the frequency domain. Secondly, the recursive algorithms applied offer adaptive predictions that compare favourably with respect to other techniques. Finally, since the method is based on unobserved components models, explicit information about trend, seasonal and irregular behaviours of the series can be extracted. This information is of great value to the electricity companies' managers in order to improve their strategies, i.e. it provides management innovations. The good forecast performance and the rapid adaptability of the model to changes in the data are illustrated with actual prices taken from the PJM interconnection in the US and for the Spanish market for the year 2002. (author)
DEFF Research Database (Denmark)
Lowes, F.J.; Olsen, Nils
2004-01-01
Most modern spherical harmonic geomagnetic models based on satellite data include estimates of the variances of the spherical harmonic coefficients of the model; these estimates are based on the geometry of the data and the fitting functions, and on the magnitude of the residuals. However...
The Two-Capacitor Problem Revisited: A Mechanical Harmonic Oscillator Model Approach
Lee, Keeyung
2009-01-01
The well-known two-capacitor problem, in which exactly half the stored energy disappears when a charged capacitor is connected to an identical capacitor, is discussed based on the mechanical harmonic oscillator model approach. In the mechanical harmonic oscillator model, it is shown first that "exactly half" the work done by a constant applied…
Third harmonic generation of CO2 laser radiation in AgGaSe2 crystal
Indian Academy of Sciences (India)
journal of. September 2000 physics pp. 405–412. Third harmonic generation of .... cell, the short pulse is accompanied by an unavoidable background pulse of 216 ns dura- ... the long pulse laser interacts with only a small number of SF molecules. ... illuminates the discharge region and produces electrons by ionization of ...
DEFF Research Database (Denmark)
Freijedo Fernandez, Francisco Daniel; Chaudhary, Sanjay Kumar; Guerrero, Josep M.
2015-01-01
-domain. As an alternative, a power based averaged modelling is also proposed. Type IV wind turbine harmonic signature and STATCOM active harmonic mitigation are considered for the simulation case studies. Simulation results provide a good insight of the features and limitations of the proposed methodologies.......This paper approaches modelling methodologies for integration of wind turbines and STATCOM in harmonic resonance studies. Firstly, an admittance equivalent model representing the harmonic signature of grid connected voltage source converters is provided. A simplified type IV wind turbine modelling...... is then straightforward. This linear modelling is suitable to represent the wind turbine in the range of frequencies at which harmonic interactions are likely. Even the admittance method is suitable both for frequency and time domain studies, some limitations arise in practice when implementing it in the time...
Modeling of higher harmonics formation in medical ultrasound systems
DEFF Research Database (Denmark)
Taylor, Louise Kold; Schlaikjer, Malene; Jensen, Jørgen Arendt
2002-01-01
a valuable tool for simulating ultrasound harmonic imaging. An extended version of Field II is obtained by means of operator splitting. The pressure eld is calculated by propagation of the eld from the transducer through a number of planes. Every plane serves as a virtual aperture for the next plane...... of the approach is demonstrated by comparing results from simulations and measurements from a convex array transducer. The new simulation tool is capable of simulating the formation of higher harmonics in water on the acoustical axis. The generation of nonlinear higher harmonic components can be predicted...
DEFF Research Database (Denmark)
Kwon, Jun Bum; Wang, Xiongfei; Bak, Claus Leth
2015-01-01
As the number of power electronics based systems are increasing, studies about overall stability and harmonic problems are rising. In order to analyze harmonics and stability, most research is using an analysis method, which is based on the Linear Time Invariant (LTI) approach. However, this can...... be difficult in terms of complex multi-parallel connected systems, especially in the case of renewable energy, where possibilities for intermittent operation due to the weather conditions exist. Hence, it can bring many different operating points to the power converter, and the impedance characteristics can...... can demonstrate other phenomenon, which can not be found in the conventional LTI approach. The theoretical modeling and analysis are verified by means of simulations and experiments....
West Coast Swing Dancing as a Driven Harmonic Oscillator Model
Ferrara, Davon; Holzer, Marie; Kyere, Shirley
The study of physics in sports not only provides valuable insight for improved athletic performance and injury prevention, but offers undergraduate students an opportunity to engage in both short- and long-term research efforts. In this project, conducted by two non-physics majors, we hypothesized that a driven harmonic oscillator model can be used to better understand the interaction between two west coast swing dancers since the stiffness of the physical connection between dance partners is a known factor in the dynamics of the dance. The hypothesis was tested by video analysis of two dancers performing a west coast swing basic, the sugar push, while changing the stiffness of the physical connection. The difference in stiffness of the connection from the ideal was estimated by the leader; the position with time data from the video was used to measure changes in the amplitude and phase difference between the leader and follower. While several aspects of our results agree with the proposed model, some key characteristics do not, possibly due to the follower relying on visual leads. Corresponding author and principal investigator.
DEFF Research Database (Denmark)
Glasdam, Jakob Bærholm; Bak, Claus Leth; Kocewiak, Lukasz Hubert
2018-01-01
system with 201 voltage levels, without loss of accuracy compared to conventional modelling of the converter. Harmonic stability is a core concern for both existing and future offshore wind power plants (OWPPs). A harmonic stability study will be undertaken with focus on the number of wind turbine...
harmonic load modeling: a case study of 33 kv abuja steel mill feeder
African Journals Online (AJOL)
HOD
An in-depth study of the harmonic orders inherent in a power system network is required ... This paper studied the harmonic orders of the 33 kV Abuja Steel Feeder .... models for various industrial and household electrical ..... Malaysia, 2013.
A computer program for external modes in complex ionic crystals (the rigid molecular-ion model)
International Nuclear Information System (INIS)
Chaplot, S.L.
1978-01-01
A computer program DISPR has been developed to calculate the external mode phonon dispersion relation in the harmonic approximation for complex ionic crystals using the rigid molecular ion model. A description of the program, the flow diagram and the required input information are given. A sample calculation for α-KNO 3 is presented. The program can handle any type of crystal lattice with any number of atoms and molecules per unit cell with suitable changes in dimension statements. (M.G.B.)
Nonlinear propagation in ultrasonic fields: measurements, modelling and harmonic imaging.
Humphrey, V F
2000-03-01
In high amplitude ultrasonic fields, such as those used in medical ultrasound, nonlinear propagation can result in waveform distortion and the generation of harmonics of the initial frequency. In the nearfield of a transducer this process is complicated by diffraction effects associated with the source. The results of a programme to study the nonlinear propagation in the fields of circular, focused and rectangular transducers are described, and comparisons made with numerical predictions obtained using a finite difference solution to the Khokhlov-Zabolotskaya-Kuznetsov (or KZK) equation. These results are extended to consider nonlinear propagation in tissue-like media and the implications for ultrasonic measurements and ultrasonic heating are discussed. The narrower beamwidths and reduced side-lobe levels of the harmonic beams are illustrated and the use of harmonics to form diagnostic images with improved resolution is described.
Energy Technology Data Exchange (ETDEWEB)
Zhang, Jun [School of Physics, Beijing Institute of Technology and Beijing Key Laboratory of Fractional Signals and Systems, Beijing 100081 (China); College of Physics and Electronic Engineering, Henan Normal University, 453007 Xinxiang, Henan (China); Zhang, Xiangdong, E-mail: zhangxd@bit.edu.cn [School of Physics, Beijing Institute of Technology and Beijing Key Laboratory of Fractional Signals and Systems, Beijing 100081 (China)
2015-09-28
Simultaneous negative refraction for both the fundamental frequency (FF) and second-harmonic (SH) fields in two-dimensional nonlinear photonic crystals have been found through both the physical analysis and exact numerical simulation. By combining such a property with the phase-matching condition and strong second-order susceptibility, we have designed a SH lens to realize focusing for both the FF and SH fields at the same time. Good-quality non-near field images for both FF and SH fields have been observed. The physical mechanism for such SH focusing phenomena has been disclosed, which is different from the backward SH generation as has been pointed out in the previous investigations. In addition, the effect of absorption losses on the phenomena has also been discussed. Thus, potential applications of these phenomena to biphotonic microscopy technique are anticipated.
Coupled Person Orientation Estimation and Appearance Modeling using Spherical Harmonics
Liem, M.C.; Gavrila, D.M.
2014-01-01
We present a novel approach for the estimation of a person's overall body orientation, 3D shape and texture, from overlapping cameras. A distinguishing aspect of our approach is the use of spherical harmonics for 3D shape- and texture-representation; it offers a compact, low-dimensional
DEFF Research Database (Denmark)
Kwon, Jun Bum; Wang, Xiongfei; Blaabjerg, Frede
2017-01-01
For the efficiency and simplicity of electric systems, the dc power electronic systems are widely used in a variety of applications such as electric vehicles, ships, aircraft and also in homes. In these systems, there could be a number of dynamic interactions and frequency coupling between network...... with different switching frequency or harmonics from ac-dc converters makes that harmonics and frequency coupling are both problems of ac system and challenges of dc system. This paper presents a modeling and simulation method for a large dc power electronic system by using Harmonic State Space (HSS) modeling...
Direct Observation of Bloch Harmonics and Negative Phase Velocity in Photonic Crystal Waveguides
Gersen, H.; Karle, T.J.; Engelen, R.J.P.; Engelen, R.J.P.; Bogaerts, W.; Korterik, Jeroen P.; van Hulst, N.F.; Krauss, T.F.; Kuipers, L.
2005-01-01
The eigenfield distribution and the band structure of a photonic crystal waveguide have been measured with a phase-sensitive near-field scanning optical microscope. Bloch modes, which consist of more than one spatial frequency, are visualized in the waveguide. In the band structure, multiple
Pion-cloud corrections to the relativistic S + V harmonic potential model
International Nuclear Information System (INIS)
Palladino, B.E.; Ferreira, P.L.
1988-01-01
Pionic corrections to the mass spectrum of low-lying s-wave baryons are incorporated in a relativistic independent quark model with equally mixed Lorentz scalar and vector harmonic potentials. (M.W.O.) [pt
Sprangers, R.L.J.; Gysen, B.L.J.; Paulides, J.J.H.; Waarma, J.; Lomonova, E.A.
2014-01-01
Recently, strong improvements have been made in the applicability of harmonic modeling techniques for electrical machines with slotted structures. Various implementations for permanent magnet motors and actuators have been investigated and applied in design and optimization tools. For the slotted
International Nuclear Information System (INIS)
Yang Tao; Chen Zheng; Zhang Jing; Wang Yongxin; Lu Yanli
2016-01-01
By employing the phase-field-crystal models, the atomic crystallization process of hexagonal and square crystals is investigated with the emphasis on the growth mechanism and morphological change. A unified regime describing the crystallization behavior of both crystals is obtained with the thermodynamic driving force varying. By increasing the driving force, both crystals (in the steady-state) transform from a faceted polygon to an apex-bulged polygon, and then into a symmetric dendrite. For the faceted polygon, the interface advances by a layer-by-layer (LL) mode while for the apex-bulged polygonal and the dendritic crystals, it first adopts the LL mode and then transits into the multi-layer (ML) mode in the later stage. In particular, a shift of the nucleation sites from the face center to the area around the crystal tips is detected in the early growth stage of both crystals and is rationalized in terms of the relation between the crystal size and the driving force distribution. Finally, a parameter characterizing the complex shape change of square crystal is introduced. (paper)
Computational-Model-Based Analysis of Context Effects on Harmonic Expectancy.
Morimoto, Satoshi; Remijn, Gerard B; Nakajima, Yoshitaka
2016-01-01
Expectancy for an upcoming musical chord, harmonic expectancy, is supposedly based on automatic activation of tonal knowledge. Since previous studies implicitly relied on interpretations based on Western music theory, the underlying computational processes involved in harmonic expectancy and how it relates to tonality need further clarification. In particular, short chord sequences which cannot lead to unique keys are difficult to interpret in music theory. In this study, we examined effects of preceding chords on harmonic expectancy from a computational perspective, using stochastic modeling. We conducted a behavioral experiment, in which participants listened to short chord sequences and evaluated the subjective relatedness of the last chord to the preceding ones. Based on these judgments, we built stochastic models of the computational process underlying harmonic expectancy. Following this, we compared the explanatory power of the models. Our results imply that, even when listening to short chord sequences, internally constructed and updated tonal assumptions determine the expectancy of the upcoming chord.
Crystallization Kinetics within a Generic Modeling Framework
DEFF Research Database (Denmark)
Meisler, Kresten Troelstrup; von Solms, Nicolas; Gernaey, Krist V.
2014-01-01
of employing a well-structured model library for storage, use/reuse, and analysis of the kinetic models are highlighted. Examples illustrating the application of the modeling framework for kinetic model discrimination related to simulation of specific crystallization scenarios and for kinetic model parameter......A new and extended version of a generic modeling framework for analysis and design of crystallization operations is presented. The new features of this framework are described, with focus on development, implementation, identification, and analysis of crystallization kinetic models. Issues related...... to the modeling of various kinetic phenomena like nucleation, growth, agglomeration, and breakage are discussed in terms of model forms, model parameters, their availability and/or estimation, and their selection and application for specific crystallization operational scenarios under study. The advantages...
Plastic crystal phases of simple water models
International Nuclear Information System (INIS)
Aragones, J. L.; Vega, C.
2009-01-01
We report the appearance of two plastic crystal phases of water at high pressure and temperature using computer simulations. In one of them the oxygen atoms form a body centered cubic structure (bcc) and in the other they form a face centered cubic structure (fcc). In both cases the water molecules were able to rotate almost freely. We have found that the bcc plastic crystal transformed into a fcc plastic crystal via a Martensitic phase transition when heated at constant pressure. We have performed the characterization and localization in the phase diagram of these plastic crystal phases for the SPC/E, TIP4P, and TIP4P/2005 water potential models. For TIP4P/2005 model free energy calculations were carried out for the bcc plastic crystal and fcc plastic crystal using a new method (which is a slight variation of the Einstein crystal method) proposed for these types of solid. The initial coexistence points for the SPC/E and TIP4P models were obtained using Hamiltonian Gibbs–Duhem integration. For all of these models these two plastic crystal phases appear in the high pressure and temperature region of the phase diagram. It would be of interest to study if such plastic crystal phases do indeed exist for real water. This would shed some light on the question of whether these models can describe satisfactorily the high pressure part of the phase diagram of water, and if not, where and why they fail.
Vector model for polarized second-harmonic generation microscopy under high numerical aperture
International Nuclear Information System (INIS)
Wang, Xiang-Hui; Chang, Sheng-Jiang; Lin, Lie; Wang, Lin-Rui; Huo, Bing-Zhong; Hao, Shu-Jian
2010-01-01
Based on the vector diffraction theory and the generalized Jones matrix formalism, a vector model for polarized second-harmonic generation (SHG) microscopy is developed, which includes the roles of the axial component P z , the weight factor and the cross-effect between the lateral components. The numerical results show that as the relative magnitude of P z increases, the polarization response of the second-harmonic signal will vary from linear polarization to elliptical polarization and the polarization orientation of the second-harmonic signal is different from that under the paraxial approximation. In addition, it is interesting that the polarization response of the detected second-harmonic signal can change with the value of the collimator lens NA. Therefore, it is more advantageous to adopt the vector model to investigate the property of polarized SHG microscopy for a variety of cases
Andreh, Angga Muhamad; Subiyanto, Sunardiyo, Said
2017-01-01
Development of non-linear loading in the application of industry and distribution system and also harmonic compensation becomes important. Harmonic pollution is an urgent problem in increasing power quality. The main contribution of the study is the modeling approach used to design a shunt active filter and the application of the cascade multilevel inverter topology to improve the power quality of electrical energy. In this study, shunt active filter was aimed to eliminate dominant harmonic component by injecting opposite currents with the harmonic component system. The active filter was designed by shunt configuration with cascaded multilevel inverter method controlled by PID controller and SPWM. With this shunt active filter, the harmonic current can be reduced so that the current wave pattern of the source is approximately sinusoidal. Design and simulation were conducted by using Power Simulator (PSIM) software. Shunt active filter performance experiment was conducted on the IEEE four bus test system. The result of shunt active filter installation on the system (IEEE four bus) could reduce THD current from 28.68% to 3.09%. With this result, the active filter can be applied as an effective method to reduce harmonics.
Shapes of nuclear configurations in a cranked harmonic oscillator model
International Nuclear Information System (INIS)
Troudet, T.; Arvieu, R.
1980-05-01
The shapes of nuclear configurations are calculated using Slater determinants built with cranked harmonic oscillator single particle states. The nuclear forces role is played by a volume conservation condition (of the potential or of the density) in a first part. In a second part, we have used the finite range, density dependent interaction of Cogny. A very simple classification of configurations emerges in the first part, the relevant parameter being the equatorial eccentricity of the nuclear density. A critical equatorial eccentricity is obtained which governs the accession to the case for which the nucleus is oblate and symmetric around its axis of rotation. Nuclear configurations calculated in the second part observe remarkably well these behaviors
Improved dq-axes Model of PMSM Considering Airgap Flux Harmonics and Saturation
DEFF Research Database (Denmark)
Fasil, Muhammed; Antaloae, Ciprian; Mijatovic, Nenad
-saturation on constant torque curves of PMSM. Two interior permanent magnet motor with two different rotor topologies and different specifications are designed to evaluate the effect of saturation on synchronous and harmonic inductances, and operating points of the machines.......The classical dq-axes model of permanent magnet synchronous machines (PMSM) uses linear approximation. This was not an issue in earlier versions of PMSM drives because they mostly used surface magnet motors. With the arrival of interior permanent magnet (IPM) machines, which use reluctance torque...... along with magnet torque, the accuracy of linear models are found to be insufficient. In this work, the effect of air gap flux harmonics is included in the classical model of PMSM using d and q-axes harmonic inductances. Further, a method has been presented to assess the effect of saturation and cross...
About the functions of the Wigner distribution for the q-deformed harmonic oscillator model
International Nuclear Information System (INIS)
Atakishiev, N.M.; Nagiev, S.M.; Djafarov, E.I.; Imanov, R.M.
2005-01-01
Full text : A q-deformed model of the linear harmonic oscillator in the Wigner phase-space is studied. It was derived an explicit expression for the Wigner probability distribution function, as well as the Wigner distribution function of a thermodynamic equilibrium for this model
Magnetic saturation in semi-analytical harmonic modeling for electric machine analysis
Sprangers, R.L.J.; Paulides, J.J.H.; Gysen, B.L.J.; Lomonova, E.
2016-01-01
A semi-analytical method based on the harmonic modeling (HM) technique is presented for the analysis of the magneto-static field distribution in the slotted structure of rotating electric machines. In contrast to the existing literature, the proposed model does not require the assumption of infinite
Time-dependent Hartree approximation and time-dependent harmonic oscillator model
International Nuclear Information System (INIS)
Blaizot, J.P.
1982-01-01
We present an analytically soluble model for studying nuclear collective motion within the framework of the time-dependent Hartree (TDH) approximation. The model reduces the TDH equations to the Schroedinger equation of a time-dependent harmonic oscillator. Using canonical transformations and coherent states we derive a few properties of the time-dependent harmonic oscillator which are relevant for applications. We analyse the role of the normal modes in the time evolution of a system governed by TDH equations. We show how these modes couple together due to the anharmonic terms generated by the non-linearity of the theory. (orig.)
Improved dq-Axes Model of PMSM Considering Airgap Flux Harmonics and Saturation
DEFF Research Database (Denmark)
Fasil, Muhammed; Antaloae, Ciprian; Mijatovic, Nenad
2016-01-01
In this work, the classical linear model of a permanent magnet synchronous motor (PMSM) is modified by adding d and q-axes harmonic inductances so that the modified model can consider non-linearities present in an interior permanent magnet (IPM) motor. Further, a method has been presented to assess...... the effect of saturation and cross-saturation on constant torque curves of PMSM. Two IPM motors with two different rotor topologies and different specifications are designed to evaluate the effect of saturation on synchronous and harmonic inductances, and on operating points of the machines...
Digital model for harmonic interactions in AC/DC/AC systems
Energy Technology Data Exchange (ETDEWEB)
Guarini, A P; Rangel, R D; Pilotto, L A.S.; Pinto, R J; Passos, Junior, R [Centro de Pesquisas de Energia Eletrica (CEPEL), Rio de Janeiro, RJ (Brazil)
1994-12-31
The main purpose of this paper is to present a model for calculation of HVdc converter harmonics taking into account the influence of the harmonic interactions between the ac systems in dc link transmissions. The ideas and methodologies used in the model development take into account the dc current ripple and ac voltage distortion in the ac systems. The theory of switching functions is applied to contemplate for the frequency conversions between the ac and dc sides, in an iterative process. It is possible then to obtain, even in balanced situations, non-characteristic harmonics that are produced by frequencies originated in the other terminal, which can be significant in a strongly coupled system, such as back-to-back configuration. (author) 9 refs., 3 figs.
International Nuclear Information System (INIS)
Obe, Emeka S.; Binder, A.
2011-01-01
A detailed model in direct-phase variables of a synchronous reluctance motor operating at mains voltage and frequency is presented. The model includes the stator and rotor slot openings, the actual winding layout and the reluctance rotor geometry. Hence, all mmf and permeance harmonics are taken into account. It is seen that non-negligible harmonics introduced by slots are present in the inductances computed by the winding function procedure. These harmonics are usually ignored in d-q models. The machine performance is simulated in the stator reference frame to depict the difference between this new direct-phase model including all harmonics and the conventional rotor reference frame d-q model. Saturation is included by using a polynomial fitting the variation of d-axis inductance with stator current obtained by finite-element software FEMAG DC (registered) . The detailed phase-variable model can yield torque pulsations comparable to those obtained from finite elements while the d-q model cannot.
López-Ruiz, F. F.; Guerrero, J.; Aldaya, V.; Cossío, F.
2012-08-01
Using a quantum version of the Arnold transformation of classical mechanics, all quantum dynamical systems whose classical equations of motion are non-homogeneous linear second-order ordinary differential equations (LSODE), including systems with friction linear in velocity such as the damped harmonic oscillator, can be related to the quantum free-particle dynamical system. This implies that symmetries and simple computations in the free particle can be exported to the LSODE-system. The quantum Arnold transformation is given explicitly for the damped harmonic oscillator, and an algebraic connection between the Caldirola-Kanai model for the damped harmonic oscillator and the Bateman system will be sketched out.
International Nuclear Information System (INIS)
López-Ruiz, F F; Guerrero, J; Aldaya, V; Cossío, F
2012-01-01
Using a quantum version of the Arnold transformation of classical mechanics, all quantum dynamical systems whose classical equations of motion are non-homogeneous linear second-order ordinary differential equations (LSODE), including systems with friction linear in velocity such as the damped harmonic oscillator, can be related to the quantum free-particle dynamical system. This implies that symmetries and simple computations in the free particle can be exported to the LSODE-system. The quantum Arnold transformation is given explicitly for the damped harmonic oscillator, and an algebraic connection between the Caldirola-Kanai model for the damped harmonic oscillator and the Bateman system will be sketched out.
Novel Harmonic Regularization Approach for Variable Selection in Cox’s Proportional Hazards Model
Directory of Open Access Journals (Sweden)
Ge-Jin Chu
2014-01-01
Full Text Available Variable selection is an important issue in regression and a number of variable selection methods have been proposed involving nonconvex penalty functions. In this paper, we investigate a novel harmonic regularization method, which can approximate nonconvex Lq (1/2model using microarray gene expression data. The harmonic regularization method can be efficiently solved using our proposed direct path seeking approach, which can produce solutions that closely approximate those for the convex loss function and the nonconvex regularization. Simulation results based on the artificial datasets and four real microarray gene expression datasets, such as real diffuse large B-cell lymphoma (DCBCL, the lung cancer, and the AML datasets, show that the harmonic regularization method can be more accurate for variable selection than existing Lasso series methods.
Directory of Open Access Journals (Sweden)
Wenzhou Lu
2016-01-01
Full Text Available This paper analyzes the general properties of IMP-based controller and presents an internal-model-principle-based (IMP-based specific harmonics repetitive control (SHRC scheme. The proposed SHRC is effective for specific nk±m order harmonics, with n>m≥0 and k=0,1,2,…. Using the properties of exponential function, SHRC can also be rewritten into the format of multiple resonant controllers in parallel, where the control gain of SHRC is n/2 multiple of that of conventional RC (CRC. Therefore, including SHRC in a stable closed-loop feedback control system, asymptotic disturbance eliminating, or reference tracking for any periodic signal only including these specific harmonic components at n/2 times faster error convergence rate compared with CRC can be achieved. Application examples of SHRC controlled three-phase/single-phase grid-connected PWM inverters demonstrate the effectiveness and advantages of the proposed SHRC scheme.
Sifi, A.; Klein, R. S.; Maillard, A.; Kugel, G. E.; Péter, A.; Polgár, K.
2003-10-01
We present absolute measurements of the effective non-linear optical coefficients deff of cesium lithium borate crystals (CsLiB 6O 10, CLBO) by second harmonic generation using a continuous Nd-YAG laser source. The experiments were carried out at room temperature, on crystals cut perpendicular to type I or type II phase matching directions, with two different crystal lengths along the propagation direction. The d36 and d14 non-linear coefficients involved in deff developments are deduced and are shown to be equal as it is predicted by the Kleinman symmetry. Two different compositions prepared by the Czochralski technique from melt with compositions of 1:1:6 and 1:1:5.5 molar ratios of Cs 2O, Li 2O and B 2O 3 are comparatively studied.
harmonic load modeling: a case study of 33 kv abuja steel mill feeder
African Journals Online (AJOL)
HOD
techniques are adopted. This paper studied the harmonic orders of the 33 kV Abuja Steel Feeder modeled as a ... (ETAP) software package was deployed to perform Discrete Fast Transform (DFT) while the input ... and documented in research and development articles ... network with 33kV Abuja Steel feeder as case study.
Harmonization of future needs for dermal exposure assessment and modeling : a workshop report
Marquart, H.; Maidment, S.; Mcclaflin, J.L.; Fehrenbacher, M.C.
2001-01-01
Dermal exposure assessment and modeling is still in early phases of development. This article presents the results of a workshop organized to harmonize the future needs in this field. Methods for dermal exposure assessment either assess the mass of contaminant that is transferred to the skin, or the
International Nuclear Information System (INIS)
Soomro, M.A.; Helepoto, I.A.
2014-01-01
The recent development of semiconductor technology and wide spread use of power electronic devices in power system have open the era of the power system harmonics due to increasing penetration of non-linear loads. Harmonics are widely admitted as most important issues of power quality which must be eliminated to maintain power system reliability. The tolerable THD (Total Harmonic Distortion) values must be bounded in well-defined limits recognized by IEEE-519 standard. In this work, in order to eliminate the current harmonics produced by non-linear loads, six pulse multiplication converter technique in conjunction with STSSHPE (Single Tuned Shunt Harmonic Passive Filter) is proposed. The proposed model has the capacity of harmonic cancellation of the dominant 3rd order harmonics. Besides that, the 5th and 7th order harmonics are also reduced to a diminishing level. The hardware model has been experimentally tested by PQA (Power Quality Analyzer) and simulation model is designed using MATLAB software. The acquired results have been measured by considering THD values in terms of current and voltage. Furthermore, they have been compared against IEEE-519 performance standards. The prosed model, successfully bounds the total harmonic distortion under defined limits by IEEE-519 standard. (author)
Directory of Open Access Journals (Sweden)
Zhang Chao
2015-12-01
Full Text Available Harmonic drives have various distinctive advantages and are widely used in space drive mechanisms. Accelerated life test (ALT is commonly conducted to shorten test time and reduce associated costs. An appropriate ALT model is needed to predict the lifetime of harmonic drives with ALT data. However, harmonic drives which are used in space usually work under a segmental stress history, and traditional ALT models can hardly be used in this situation. This paper proposes a dedicated ALT model for harmonic drives applied in space systems. A comprehensive ALT model is established and genetic algorithm (GA is adopted to obtain optimal parameters in the model using the Manson fatigue damage rule to describe the fatigue failure process and a cumulative damage method to calculate and accumulate the damage caused by each segment in the stress history. An ALT of harmonic drives was carried out and experimental results show that this model is acceptable and effective.
Quantitative modeling of the third harmonic emission spectrum of plasmonic nanoantennas.
Hentschel, Mario; Utikal, Tobias; Giessen, Harald; Lippitz, Markus
2012-07-11
Plasmonic dimer nanoantennas are characterized by a strong enhancement of the optical field, leading to large nonlinear effects. The third harmonic emission spectrum thus depends strongly on the antenna shape and size as well as on its gap size. Despite the complex shape of the nanostructure, we find that for a large range of different geometries the nonlinear spectral properties are fully determined by the linear response of the antenna. We find excellent agreement between the measured spectra and predictions from a simple nonlinear oscillator model. We extract the oscillator parameters from the linear spectrum and use the amplitude of the nonlinear perturbation only as scaling parameter of the third harmonic spectra. Deviations from the model only occur for gap sizes below 20 nm, indicating that only for these small distances the antenna hot spot contributes noticeable to the third harmonic generation. Because of its simplicity and intuitiveness, our model allows for the rational design of efficient plasmonic nonlinear light sources and is thus crucial for the design of future plasmonic devices that give substantial enhancement of nonlinear processes such as higher harmonics generation as well as difference frequency mixing for plasmonically enhanced terahertz generation.
An aggregated approach to harmonic modelling of loads in power distribution networks
Energy Technology Data Exchange (ETDEWEB)
Moellerstedt, E.
1998-06-01
The use of power electronics have given possibilities for more sophisticated control of power networks. This creates new demands on power network modelling. The models must not only allow for efficient and accurate simulation, but also be suitable for analysis and control design. The Harmonic Norton Equivalent presented in this thesis addresses two problems that are central in control theory, namely model reduction and system identification. It is essential to have simple representations of large systems, and there must be a way to obtain these simple models experimentally, as detailed modelling most often is too complicated. The Harmonic Norton Equivalent has its roots in the method of harmonic balance. It is a frequency domain description of loads in electric networks and describes a linear relation between the current spectrum and the voltage spectrum. The linearization implies that aggregation of loads for model reduction is a straightforward, non-iterative procedure. The models can be obtained through analytical calculations, measurements or time domain simulations. A procedure for experimental estimation of model parameters is presented. The procedure is used to estimate the parameters of a dimmer model from measurements on a real dimmer. The obtained model shows a very good agreement with validation data 24 refs, 24 figs
Modeling of VSC-Based Power Systems in The Extended Harmonic Domain
DEFF Research Database (Denmark)
Esparza, Miguel; Segundo-Ramirez, Juan; Kwon, Jun Bum
2017-01-01
Averaged modeling is a commonly used approach used to obtain mathematical representations of VSC-based systems. However, essential characteristics mainly related to the modulation process and the harmonic distortion of the signals are not able to be accurately captured and analyzed. The extended ...... on simulations and experimental case studies. The obtained results show that the resulting EHD models are accurate and reliable, while the memory and computation time are improved with the proposed model order reductions....
International Nuclear Information System (INIS)
Fathabadi, Hassan
2015-01-01
Highlights: • Novel technique to completely eliminate the harmful harmonics of fuel cell system. • Presenting a novel high accurate detailed electrochemical dynamic model of fuel cells. • Back-up battery system to compensate the slow dynamic response of fuel cell system. • Exact analysis of real electrochemical reactions occurring inside fuel cells. - Abstract: In this study, a novel dynamic model of fuel cells is presented. High accurate static and dynamic responses of the proposed model are experimentally validated by comparing simulated results with real experimental data. The obtained model together with theoretical results shows that a fuel cell or a fuel cell stack has very slow dynamic response, so that, it cannot adapt itself to the fast variations in load demand. It is shown that for adapting well a fuel cell stack to the load demand, the stack should be equipped with a proposed back-up battery system which compensates the slow dynamic response of the stack by providing a bidirectional path to transmit/absorb the extra instant power. It is proved that the conventional switching waveforms used in the converters of the stacks and back-up systems produce an enormous amount of harmful harmonics. Then, a novel technique is proposed to completely eliminate main harmful harmonics. It is worthwhile to note that all the other techniques only reduce the harmful harmonics. Simulated results verify that the back-up battery system together with applying the proposed technique provide a fast dynamic response for the fuel cell/back-up battery system, and also completely eliminate the main harmful harmonics
Energy Technology Data Exchange (ETDEWEB)
Atkinson-Hope, Gary; Stemmet, W.C. [Cape Peninsula University of Technology, Cape Town Campus, Cape Town (South Africa)
2006-07-01
The purpose of this paper is to assess the DlgSILENT PowerFactory software power definitions (indices) in terms of phase and sequence components for balanced and unbalanced networks when harmonic distortion is present and to compare its results to hand calculations done, following recommendation made by the IEEE Working Group on this topic. This paper also includes the development of a flowchart for calculating power indices in balanced and unbalanced three-phase networks when non-sinusoidal voltages and currents are present. A further purpose is to determine how two industrial grade harmonic analysis software packages (DlgSILENT and ERACS) model three-phase harmonic sources used for current penetration studies and to compare their results when applied to a network. From the investigations, another objective was to develop a methodology for modelling harmonic current sources based on a spectrum obtained from measurements. Three case studies were conducted and the assessment and developed methodologies were shown to be effective. (Author)
International Nuclear Information System (INIS)
Erba, A.; Dovesi, R.; Shahrokhi, M.; Moradian, R.
2015-01-01
Harmonic and quasi-harmonic thermal properties of two isostructural simple oxides (periclase, MgO, and lime, CaO) are computed with ab initio periodic simulations based on the density-functional-theory (DFT). The more polarizable character of calcium with respect to magnesium cations is found to dramatically affect the validity domain of the quasi-harmonic approximation that, for thermal structural properties (such as temperature dependence of volume, V(T), bulk modulus, K(T), and thermal expansion coefficient, α(T)), reduces from [0 K-1000 K] for MgO to just [0 K-100 K] for CaO. On the contrary, thermodynamic properties (such as entropy, S(T), and constant-volume specific heat, C V (T)) are described reliably at least up to 2000 K and quasi-harmonic constant-pressure specific heat, C P (T), up to about 1000 K in both cases. The effect of the adopted approximation to the exchange-correlation functional of the DFT is here explicitly investigated by considering five different expressions of three different classes (local-density approximation, generalized-gradient approximation, and hybrids). Computed harmonic thermodynamic properties are found to be almost independent of the adopted functional, whereas quasi-harmonic structural properties are more affected by the choice of the functional, with differences that increase as the system becomes softer
Directory of Open Access Journals (Sweden)
Wenge Christoph
2017-12-01
Full Text Available Electric vehicles (EVs can be utilized as mobile storages in a power system. The use of battery chargers can cause current harmonics in the supplied AC system. In order to analyze the impact of different EVs with regardto their number and their emission of current harmonics, a generic harmonic current model of EV types was built and implemented in the power system simulation tool PSS®NETOMAC. Based on the measurement data for different types of EVs three standardized harmonic EV models were developed and parametrized. Further, the identified harmonic models are used by the computation of load flow in a modeled, German power distribution system. As a benchmark, a case scenario was studied regarding a high market penetration of EVs in the year 2030 for Germany. The impact of the EV charging on the power distribution system was analyzed and evaluated with valid power quality standards.
Modelling soil erosion at European scale: towards harmonization and reproducibility
Bosco, C.; de Rigo, D.; Dewitte, O.; Poesen, J.; Panagos, P.
2015-02-01
Soil erosion by water is one of the most widespread forms of soil degradation. The loss of soil as a result of erosion can lead to decline in organic matter and nutrient contents, breakdown of soil structure and reduction of the water-holding capacity. Measuring soil loss across the whole landscape is impractical and thus research is needed to improve methods of estimating soil erosion with computational modelling, upon which integrated assessment and mitigation strategies may be based. Despite the efforts, the prediction value of existing models is still limited, especially at regional and continental scale, because a systematic knowledge of local climatological and soil parameters is often unavailable. A new approach for modelling soil erosion at regional scale is here proposed. It is based on the joint use of low-data-demanding models and innovative techniques for better estimating model inputs. The proposed modelling architecture has at its basis the semantic array programming paradigm and a strong effort towards computational reproducibility. An extended version of the Revised Universal Soil Loss Equation (RUSLE) has been implemented merging different empirical rainfall-erosivity equations within a climatic ensemble model and adding a new factor for a better consideration of soil stoniness within the model. Pan-European soil erosion rates by water have been estimated through the use of publicly available data sets and locally reliable empirical relationships. The accuracy of the results is corroborated by a visual plausibility check (63% of a random sample of grid cells are accurate, 83% at least moderately accurate, bootstrap p ≤ 0.05). A comparison with country-level statistics of pre-existing European soil erosion maps is also provided.
Monitoring and modeling of ultrasonic wave propagation in crystallizing mixtures
Marshall, T.; Challis, R. E.; Tebbutt, J. S.
2002-05-01
The utility of ultrasonic compression wave techniques for monitoring crystallization processes is investigated in a study of the seeded crystallization of copper II sulfate pentahydrate from aqueous solution. Simple models are applied to predict crystal yield, crystal size distribution and the changing nature of the continuous phase. A scattering model is used to predict the ultrasonic attenuation as crystallization proceeds. Experiments confirm that modeled attenuation is in agreement with measured results.
Person Appearance Modeling and Orientation Estimation using Spherical Harmonics
Liem, M.C.; Gavrila, D.M.
2013-01-01
We present a novel approach for the joint estimation of a person's overall body orientation, 3D shape and texture, from overlapping cameras. Overall body orientation (i.e. rotation around torso major axis) is estimated by minimizing the difference between a learned texture model in a canonical
Kral, C.; Haumer, A.; Bogomolov, M.D.; Lomonova, E.
2012-01-01
This paper proposes a multi domain physical model of permanent magnet synchronous machines, considering electrical, magnetic, thermal and mechanical effects. For each component of the model, the main wave as well as lower and higher harmonic wave components of the magnetic flux and the magnetic
Modelling of BLDCM with a double 3-phase stator winding and back EMF harmonics
Directory of Open Access Journals (Sweden)
Drozdowski Piotr
2015-03-01
Full Text Available In this paper the mathematical model of the brushless DC motor (BLDCM with a double 3-phase stator winding is analysed. Both the 3-phase windings are mutually displaced by 30 electrical degree. Special care has been sacrificed to influence of higher harmonics of induced electromotive forces (EMF on electromagnetic torque and zero sequence voltages that may be used for sensorless control. The mathematical model has been presented in natural variables and, after transformation to symmetrical components, in a vector form. This allows, from one side, for formulating the equivalent circuit suitable for circuit oriented simulators (e.g.: Spice, SimPowerSystems of Simulink and, from the other point of view, for analysis of higher harmonics influence on control possibilities. These considerations have been illustrated with some results of four quadrant operation obtainded due to simulation at automatic control.
Directory of Open Access Journals (Sweden)
Bangcheng Han
2013-01-01
Full Text Available The double-gimbal control moment gyro (DGCMG demands that the gimbal servosystem should have fast response and small overshoot. But due to the low and nonlinear torsional stiffness of harmonic drive, the gimbal servo-system has poor dynamic performance with large overshoot and low bandwidth. In order to improve the dynamic performance of gimbal servo-system, a model reference adaptive control (MRAC law is introduced in this paper. The model of DGCMG gimbal servo-system with harmonic drive is established, and the adaptive control law based on POPOV super stable theory is designed. The MATLAB simulation results are provided to verify the effectiveness of the proposed control algorithm. The experimental results indicate that the MRAC could increase the bandwidth of gimbal servo-system to 3 Hz and improve the dynamic performance with small overshoot.
International Nuclear Information System (INIS)
Galperin, A.; Ivanov, E.; Ogievetsky, V.; Sokatchev, E.
1985-01-01
This paper completes a descrption of the quantization procedure in the harmonic superspace approach. The Feynman rules for N=2 matter and Yang-Mills theories are derived and the various examples of harmonic supergraph calculations are given. Calculations appear to be not more difficult than those in the N=1 case. The integration over harmonic variables does not lead to any troubles, a non-locality in these disappears on-shell. The important property is that the quantum corrections are always writen as integrals over the full harmonic superspace even though the initial action is an integral over the analytic subspace. As a by-product our results imply a very simple proof of finiteness of a wide class of the N=4, d=2 non-linear Σ-models. The most general self-couplings of hypermultiplets including those with broken SU(2) are considered.The duality relations among the N=2 linear multiplet and both kinds of hypermultiplet are established
A relativistic gauge model describing N particles bound by harmonic forces
International Nuclear Information System (INIS)
Filippov, A.T.
1987-01-01
Application of the principle of gauging to linear canonical symmetries of simplest/rudimentary/bilinear lagrangians is shown to produce a relativistic version of the Lagrangian describing N particles bound by harmonic forces. For pairwise coupled identical particles the gauge group is T 1 xU 1 , xSU N-1 . A model for the relativistic discrete string (a chain of N particles) is also discussed. All these gauge theoried of particles can be quantized by standard methods
Serebryannikov, Evgenii E; von der Linde, Dietrich; Zheltikov, Aleksei M
2008-05-01
Hollow-core photonic-crystal fibers are shown to enable dynamically phase-matched high-order harmonic generation by a gigawatt soliton pump field. With a careful design of the waveguide structure and an appropriate choice of input-pulse and gas parameters, a remarkably broadband phase matching can be achieved for a soliton pump field and a large group of optical harmonics in the soft-x-ray-extreme-ultraviolet spectral range.
DEFF Research Database (Denmark)
Bak, Claus Leth; Bak-Jensen, Birgitte; Wiechowski, Wojciech
2008-01-01
This paper demonstrates the results of implementation and verification of an already existing algorithm that allows for calculating saturation characteristics of singlephase power transformers. The algorithm was described for the first time in 1993. Now this algorithm has been implemented using...... the DIgSILENT Programming Language (DPL) as an external script in the harmonic domain calculations of a power system analysis tool PowerFactory [10]. The algorithm is verified by harmonic measurements on a single-phase power transformer. A theoretical analysis of the core nonlinearities phenomena...... in single and three-phase transformers is also presented. This analysis leads to the conclusion that the method can be applied for modelling nonlinearities of three-phase autotransformers....
Frictional-faulting model for harmonic tremor before Redoubt Volcano eruptions
Dmitrieva, Ksenia; Hotovec-Ellis, Alicia J.; Prejean, Stephanie G.; Dunham, Eric M.
2013-01-01
Seismic unrest, indicative of subsurface magma transport and pressure changes within fluid-filled cracks and conduits, often precedes volcanic eruptions. An intriguing form of volcano seismicity is harmonic tremor, that is, sustained vibrations in the range of 0.5–5 Hz. Many source processes can generate harmonic tremor. Harmonic tremor in the 2009 eruption of Redoubt Volcano, Alaska, has been linked to repeating earthquakes of magnitudes around 0.5–1.5 that occur a few kilometres beneath the vent. Before many explosions in that eruption, these small earthquakes occurred in such rapid succession—up to 30 events per second—that distinct seismic wave arrivals blurred into continuous, high-frequency tremor. Tremor abruptly ceased about 30 s before the explosions. Here we introduce a frictional-faulting model to evaluate the credibility and implications of this tremor mechanism. We find that the fault stressing rates rise to values ten orders of magnitude higher than in typical tectonic settings. At that point, inertial effects stabilize fault sliding and the earthquakes cease. Our model of the Redoubt Volcano observations implies that the onset of volcanic explosions is preceded by active deformation and extreme stressing within a localized region of the volcano conduit, at a depth of several kilometres.
Wilson, Barry T.; Knight, Joseph F.; McRoberts, Ronald E.
2018-03-01
Imagery from the Landsat Program has been used frequently as a source of auxiliary data for modeling land cover, as well as a variety of attributes associated with tree cover. With ready access to all scenes in the archive since 2008 due to the USGS Landsat Data Policy, new approaches to deriving such auxiliary data from dense Landsat time series are required. Several methods have previously been developed for use with finer temporal resolution imagery (e.g. AVHRR and MODIS), including image compositing and harmonic regression using Fourier series. The manuscript presents a study, using Minnesota, USA during the years 2009-2013 as the study area and timeframe. The study examined the relative predictive power of land cover models, in particular those related to tree cover, using predictor variables based solely on composite imagery versus those using estimated harmonic regression coefficients. The study used two common non-parametric modeling approaches (i.e. k-nearest neighbors and random forests) for fitting classification and regression models of multiple attributes measured on USFS Forest Inventory and Analysis plots using all available Landsat imagery for the study area and timeframe. The estimated Fourier coefficients developed by harmonic regression of tasseled cap transformation time series data were shown to be correlated with land cover, including tree cover. Regression models using estimated Fourier coefficients as predictor variables showed a two- to threefold increase in explained variance for a small set of continuous response variables, relative to comparable models using monthly image composites. Similarly, the overall accuracies of classification models using the estimated Fourier coefficients were approximately 10-20 percentage points higher than the models using the image composites, with corresponding individual class accuracies between six and 45 percentage points higher.
DEFF Research Database (Denmark)
Wang, Yanbo; Wang, Xiongfei; Blaabjerg, Frede
2017-01-01
parameters on the harmonic instability of the power system. Moreover, the harmonic-frequency oscillation modes are identified, where participation analysis is presented to evaluate the contributions of different states to these modes and to further reveal how the system gives rise to harmonic instability......This paper presents a harmonic instability analysis method using state-space modeling and participation analysis in the inverter-fed ac power systems. A full-order state-space model for the droop-controlled Distributed Generation (DG) inverter is built first, including the time delay of the digital...... control system, inner current and voltage control loops, and outer droop-based power control loop. Based on the DG inverter model, an overall state-space model of a two-inverter-fed system is established. The eigenvalue-based stability analysis is then presented to assess the influence of controller...
DEFF Research Database (Denmark)
Chaaban, Joussef Hussein; Dam-Johansen, Kim; Skovby, Tommy
2014-01-01
A mathematical model describing the separation of enantiomers by simultaneous preferential crystallization in a coupled crystallizer configuration is developed. The model was validated against experimental data for a chemical model compound, the conglomerate forming system of asparagine monohydrate....... The racemic compound and the pure enantiomer can be separated simultaneously in each crystallizer, having sufficient enrichment of the pure enantiomer in the feed solution. The model can also be extended to represent a fully continuous separation process taking into account the continuous supply...
Towards an Open Modelling Interface (OpenMI the HarmonIT project
Directory of Open Access Journals (Sweden)
M. Blind
2005-01-01
Full Text Available The Water Framework Directive (WFD poses an immense challenge to water management in Europe. Aiming at a "good ecological status" of surface waters in 2015, integrated river basin management plans need to be in place by 2009, and broadly supported by stakeholders. Information & Communication Technology (ICT tools, such as computational models, are very helpful in designing river basin management plans (rbmp-s. However, many scientists believe that a single integrated modelling system to support the WFD cannot be developed, and integrated systems need to be quite tailored to the local situation and evolve during a collaborative planning process. As a consequence there is an urgent need to increase the flexibility of modelling systems, such that dedicated model systems can be developed from available building blocks. In the recent past a number of initiatives have been started to develop an IT framework for modelling to meet the required flexibility. In Europe the international project HarmonIT, which is sponsored by the European Commission, is developing and implementing a standard interface for modelling components and other relevant tools: The Open Modelling Interface (OpenMI. This paper describes the HarmonIT project and objectives in general. The current progress is described. It describes the roles for different types of stakeholders in modelling, varying from software coders to non-specialized users of decision support systems. It will provide insight in the requirements imposed when using the OpenMI.
DEFF Research Database (Denmark)
Schneider, M.; Johnson, T.; Dumont, R.
2016-01-01
Recent JET experiments have been dedicated to the studies of fusion reactions between deuterium (D) and Helium-3 (3He) ions using neutral beam injection (NBI) in synergy with third harmonic ion cyclotron radio-frequency heating (ICRH) of the beam. This scenario generates a fast ion deuterium tail...... enhancing DD and D3He fusion reactions. Modelling and measuring the fast deuterium tail accurately is essential for quantifying the fusion products. This paper presents the modelling of the D distribution function resulting from the NBI+ICRF heating scheme, reinforced by a comparison with dedicated JET fast...
Directory of Open Access Journals (Sweden)
Gonzalo Abad
2018-05-01
Full Text Available This paper presents an analytical model, oriented to study harmonic mitigation aspects in AC grids. As it is well known, the presence of non-desired harmonics in AC grids can be palliated in several manners. However, in this paper, a power electronic-based active impedance at selective frequencies (ACISEF is used, due to its already proven flexibility and adaptability to the changing characteristics of AC grids. Hence, the proposed analytical model approach is specially conceived to globally consider both the model of the AC grid itself with its electric equivalent impedances, together with the power electronic-based ACISEF, including its control loops. In addition, the proposed analytical model presents practical and useful properties, as it is simple to understand and simple to use, it has low computational cost and simple adaptability to different scenarios of AC grids, and it provides an accurate enough representation of the reality. The benefits of using the proposed analytical model are shown in this paper through some examples of its usefulness, including an analysis of stability and the identification of sources of instability for a robust design, an analysis of effectiveness in harmonic mitigation, an analysis to assist in the choice of the most suitable active impedance under a given state of the AC grid, an analysis of the interaction between different compensators, and so on. To conclude, experimental validation of a 2.15 kA ACISEF in a real 33 kV AC grid is provided, in which real users (household and industry loads and crucial elements such as wind parks and HVDC systems are near inter-connected.
Rapid automated superposition of shapes and macromolecular models using spherical harmonics.
Konarev, Petr V; Petoukhov, Maxim V; Svergun, Dmitri I
2016-06-01
A rapid algorithm to superimpose macromolecular models in Fourier space is proposed and implemented ( SUPALM ). The method uses a normalized integrated cross-term of the scattering amplitudes as a proximity measure between two three-dimensional objects. The reciprocal-space algorithm allows for direct matching of heterogeneous objects including high- and low-resolution models represented by atomic coordinates, beads or dummy residue chains as well as electron microscopy density maps and inhomogeneous multi-phase models ( e.g. of protein-nucleic acid complexes). Using spherical harmonics for the computation of the amplitudes, the method is up to an order of magnitude faster than the real-space algorithm implemented in SUPCOMB by Kozin & Svergun [ J. Appl. Cryst. (2001 ▸), 34 , 33-41]. The utility of the new method is demonstrated in a number of test cases and compared with the results of SUPCOMB . The spherical harmonics algorithm is best suited for low-resolution shape models, e.g . those provided by solution scattering experiments, but also facilitates a rapid cross-validation against structural models obtained by other methods.
Lehar, Steven
2003-01-01
Visual illusions and perceptual grouping phenomena offer an invaluable tool for probing the computational mechanism of low-level visual processing. Some illusions, like the Kanizsa figure, reveal illusory contours that form edges collinear with the inducing stimulus. This kind of illusory contour has been modeled by neural network models by way of cells equipped with elongated spatial receptive fields designed to detect and complete the collinear alignment. There are, however, other illusory groupings which are not so easy to account for in neural network terms. The Ehrenstein illusion exhibits an illusory contour that forms a contour orthogonal to the stimulus instead of collinear with it. Other perceptual grouping effects reveal illusory contours that exhibit a sharp corner or vertex, and still others take the form of vertices defined by the intersection of three, four, or more illusory contours that meet at a point. A direct extension of the collinear completion models to account for these phenomena tends towards a combinatorial explosion, because it would suggest cells with specialized receptive fields configured to perform each of those completion types, each of which would have to be replicated at every location and every orientation across the visual field. These phenomena therefore challenge the adequacy of the neural network approach to account for these diverse perceptual phenomena. I have proposed elsewhere an alternative paradigm of neurocomputation in the harmonic resonance theory (Lehar 1999, see website), whereby pattern recognition and completion are performed by spatial standing waves across the neural substrate. The standing waves perform a computational function analogous to that of the spatial receptive fields of the neural network approach, except that, unlike that paradigm, a single resonance mechanism performs a function equivalent to a whole array of spatial receptive fields of different spatial configurations and of different orientations
From the harmonic oscillator to the A-D-E classification of conformal models
International Nuclear Information System (INIS)
Itzykson, C.
1988-01-01
Arithmetical aspects of the solution of systems involving dimensional statistical models and conformal field theory. From this perspective, the analysis of the harmonic oscillator, the free particle in a box, the rational billards is effectuated. Moreover, the description of the classification of minimal conformal models and Weiss-Lumino-Witten models, based on the simplest affine algebra is also given. Attempts to interpret and justify the appearance of A-D-E classification of algebra in W-Z-W model are made. Extensions of W-Z-W model, based on SU(N) level one, and the ways to deal with rank two Lie groups, using the arithmetics of quadratic intergers, are described
The two-capacitor problem revisited: a mechanical harmonic oscillator model approach
International Nuclear Information System (INIS)
Lee, Keeyung
2009-01-01
The well-known two-capacitor problem, in which exactly half the stored energy disappears when a charged capacitor is connected to an identical capacitor, is discussed based on the mechanical harmonic oscillator model approach. In the mechanical harmonic oscillator model, it is shown first that exactly half the work done by a constant applied force is dissipated irrespective of the form of dissipation mechanism when the system comes to a new equilibrium after a constant force is abruptly applied. This model is then applied to the energy loss mechanism in the capacitor charging problem or the two-capacitor problem. This approach allows a simple explanation of the energy dissipation mechanism in these problems and shows that the dissipated energy should always be exactly half the supplied energy whether that is caused by the Joule heat or by the radiation. This paper, which provides a simple treatment of the energy dissipation mechanism in the two-capacitor problem, is suitable for all undergraduate levels
An ice crystal model for jupiter's moon Europa
DEFF Research Database (Denmark)
Dahl-Jensen, Dorthe; schmidt, Karen Guldbae
2003-01-01
A simple model for crystal growth in the ice shell of Europa has been made in order to estimate the size of ice crystals at Europa's surface. If mass is lost from the surface of Europa due to sputtering processes, and the ice thickness is constant in time, ice crystals will be transported upwards...
Systematic identification of crystallization kinetics within a generic modelling framework
DEFF Research Database (Denmark)
Abdul Samad, Noor Asma Fazli Bin; Meisler, Kresten Troelstrup; Gernaey, Krist
2012-01-01
A systematic development of constitutive models within a generic modelling framework has been developed for use in design, analysis and simulation of crystallization operations. The framework contains a tool for model identification connected with a generic crystallizer modelling tool-box, a tool...
Liu, Yanqing; Wang, Zhengping; Yu, Fapeng; Qi, Hongwei; Yang, Xiuqin; Yu, Xiaoqiang; Zhao, Xian; Xu, Xinguang
2017-05-15
For the first time, the angular non-critical phase-matching (A-NCPM) second-harmonic-generation (SHG) characteristics of a family of monoclinic oxoborate crystals, RECa 4 O(BO 3 ) 3 (RECOB, RE = Tm, Y, Gd, Sm, Nd and La), were comprehensively investigated. For all of the realizable A-NCPM SHG styles, the feature parameters including PM wavelength, angular, wavelength and temperature acceptance bandwidths, have been derived from the theory and verified by the experiments. We discovered that the closer the ion radius between RE 3+ and Ca 2+ , the smaller the birefringence, and the better the A-NCPM SHG properties. As a result, for the Type-I SHG on Y-axis which has the largest effective nonlinear optical coefficient (d eff ) among the three realizable A-NCPM styles, NdCOB crystal presents the longest PM wavelength (927 nm), the largest angular acceptance bandwidth (Δθ⋅l 1/2 = 84.3 mrad·cm 1/2 , Δϕ⋅l 1/2 = 58.8 mrad·cm 1/2 ), and the broadest wavelength acceptance bandwidth (8.7 nm). This discovery will contribute to the design of new NCPM materials, at the same time the parameter formula will be helpful for the theoretical prediction of NCPM performance.
Directory of Open Access Journals (Sweden)
Yang Wen-Huan
2014-11-01
Full Text Available Aiming at the problem that the distribution network voltage will fluctuate because of the inter-harmonic currents injected into the network by double PWM speed control system when regulating the speed of the asynchronous motor, we established the inter-harmonic current math model of double PWM speed control system according to switching function based on a real bridge crane. The distribution law of the inter-harmonic is got by calculating the grid-side currents and their spectrum while letting the motor run at different quadrants and frequencies. The result which is verified by simulation and experiment shows that the content of the inter harmonic currents is more than that of harmonic currents in double PWM speed control system, the frequency of the inter harmonics of the grid-side current mainly focus on the scope lower than the fundamental frequency, and when the motor runs at low frequencies, the THD of the grid-side current is high. The result has verified the reason why the voltage of a bridge crane distribution system of a deepwater port in Shanghai flickers.
Lyu, Dandan; Li, Shaofan
2017-10-01
Crystal defects have microstructure, and this microstructure should be related to the microstructure of the original crystal. Hence each type of crystals may have similar defects due to the same failure mechanism originated from the same microstructure, if they are under the same loading conditions. In this work, we propose a multiscale crystal defect dynamics (MCDD) model that models defects by considering its intrinsic microstructure derived from the microstructure or material genome of the original perfect crystal. The main novelties of present work are: (1) the discrete exterior calculus and algebraic topology theory are used to construct a scale-up (coarse-grained) dual lattice model for crystal defects, which may represent all possible defect modes inside a crystal; (2) a higher order Cauchy-Born rule (up to the fourth order) is adopted to construct atomistic-informed constitutive relations for various defect process zones, and (3) an hierarchical strain gradient theory based finite element formulation is developed to support an hierarchical multiscale cohesive (process) zone model for various defects in a unified formulation. The efficiency of MCDD computational algorithm allows us to simulate dynamic defect evolution at large scale while taking into account atomistic interaction. The MCDD model has been validated by comparing of the results of MCDD simulations with that of molecular dynamics (MD) in the cases of nanoindentation and uniaxial tension. Numerical simulations have shown that MCDD model can predict dislocation nucleation induced instability and inelastic deformation, and thus it may provide an alternative solution to study crystal plasticity.
Integrated Intelligent Modeling, Design and Control of Crystal Growth Processes
National Research Council Canada - National Science Library
Prasad, V
2000-01-01
.... This MURI program took an integrated approach towards modeling, design and control of crystal growth processes and in conjunction with growth and characterization experiments developed much better...
Modeling and Simulation of DC Power Electronics Systems Using Harmonic State Space (HSS) Method
DEFF Research Database (Denmark)
Kwon, Jun Bum; Wang, Xiongfei; Bak, Claus Leth
2015-01-01
based on the state-space averaging and generalized averaging, these also have limitations to show the same results as with the non-linear time domain simulations. This paper presents a modeling and simulation method for a large dc power electronic system by using Harmonic State Space (HSS) modeling......For the efficiency and simplicity of electric systems, the dc based power electronics systems are widely used in variety applications such as electric vehicles, ships, aircrafts and also in homes. In these systems, there could be a number of dynamic interactions between loads and other dc-dc....... Through this method, the required computation time and CPU memory for large dc power electronics systems can be reduced. Besides, the achieved results show the same results as with the non-linear time domain simulation, but with the faster simulation time which is beneficial in a large network....
International Nuclear Information System (INIS)
Zhao, H; Aluru, N R
2007-01-01
This paper presents a semi-local quasi-harmonic model with local phonon density of states (LPDOS) to compute the thermodynamic and mechanical properties of silicon nanostructures at finite temperature. In contrast to an earlier approach (Tang and Aluru 2006 Phys. Rev. B 74 235441), where a quasi-harmonic model with LPDOS computed by a Green's function technique (QHMG) was developed considering many layers of atoms, the semi-local approach considers only two layers of atoms to compute the LPDOS. We show that the semi-local approach combines the accuracy of the QHMG approach and the computational efficiency of the local quasi-harmonic model. We present results for several silicon nanostructures to address the accuracy and efficiency of the semi-local approach
A Review of Flood Loss Models as Basis for Harmonization and Benchmarking.
Directory of Open Access Journals (Sweden)
Tina Gerl
exemplarily presents an approach for a quantitative comparison of disparate models via the reduction to the joint input variables of all models. Harmonization of models for benchmarking and comparison requires profound insight into the model structures, mechanisms and underlying assumptions. Possibilities and challenges are discussed that exist in model harmonization and the application of the inventory in a benchmarking framework.
A Review of Flood Loss Models as Basis for Harmonization and Benchmarking.
Gerl, Tina; Kreibich, Heidi; Franco, Guillermo; Marechal, David; Schröter, Kai
2016-01-01
an approach for a quantitative comparison of disparate models via the reduction to the joint input variables of all models. Harmonization of models for benchmarking and comparison requires profound insight into the model structures, mechanisms and underlying assumptions. Possibilities and challenges are discussed that exist in model harmonization and the application of the inventory in a benchmarking framework.
A Review of Flood Loss Models as Basis for Harmonization and Benchmarking
Kreibich, Heidi; Franco, Guillermo; Marechal, David
2016-01-01
presents an approach for a quantitative comparison of disparate models via the reduction to the joint input variables of all models. Harmonization of models for benchmarking and comparison requires profound insight into the model structures, mechanisms and underlying assumptions. Possibilities and challenges are discussed that exist in model harmonization and the application of the inventory in a benchmarking framework. PMID:27454604
Modeling of ultrafast THz interactions in molecular crystals
DEFF Research Database (Denmark)
Pedersen, Pernille Klarskov; Clark, Stewart J.; Jepsen, Peter Uhd
2014-01-01
In this paper we present a numerical study of terahertz pulses interacting with crystals of cesium iodide. We model the molecular dynamics of the cesium iodide crystals with the Density Functional Theory software CASTEP, where ultrafast terahertz pulses are implemented to the CASTEP software...... to interact with molecular crystals. We investigate the molecular dynamics of cesium iodide crystals when interacting with realistic terahertz pulses of field strengths from 0 to 50 MV/cm. We find nonlinearities in the response of the CsI crystals at field strengths higher than 10 MV/cm....
Liu, Sen; Gang, Tieqiang
2018-03-01
Harmonic drives are widely used in aerospace and industrial robots. Flexibility, friction and parameter uncertainty will result in transmission performance degradation. In this paper, an adaptive back-stepping method with friction compensation is proposed to improve the tracking performance of the harmonic drive system. The nonlinear friction is described by LuGre model and compensated with a friction observer, and the uncertainty of model parameters is resolved by adaptive parameter estimation method. By using Lyapunov stability theory, it is proved that all the errors of the closed-loop system are uniformly ultimately bounded. Simulations illustrate the effectiveness of our friction compensation method.
Event-plane dependent di-hadron correlations with harmonic vn subtraction in a hydrodynamic model
Castilho, Wagner M.; Qian, Wei-Liang; Hama, Yogiro; Kodama, Takeshi
2018-02-01
In this work, a hydrodynamic study of the di-hadron azimuthal correlations for the Au+Au collisions at 200 GeV is carried out. The correlations are evaluated using the ZYAM method for the centrality windows as well as the transverse momentum range in accordance with the existing data. Event-plane dependence of the correlation is obtained after the subtraction of contributions from the most dominant harmonic coefficients. In particular, the contribution from the triangular flow, v3, is removed from the proper correlations following the procedure implemented by the STAR collaboration. The resultant structure observed in the correlations was sometimes attributed to the mini-jet dynamics, but the present calculations show that a pure hydrodynamic model gives a reasonable agreement with the main feature of the published data. A brief discussion on the physical content of the present findings is presented.
Modeling of monolayer charge-stabilized colloidal crystals with static hexagonal crystal lattice
Nagatkin, A. N.; Dyshlovenko, P. E.
2018-01-01
The mathematical model of monolayer colloidal crystals of charged hard spheres in liquid electrolyte is proposed. The particles in the monolayer are arranged into the two-dimensional hexagonal crystal lattice. The model enables finding elastic constants of the crystals from the stress-strain dependencies. The model is based on the nonlinear Poisson-Boltzmann differential equation. The Poisson-Boltzmann equation is solved numerically by the finite element method for any spatial configuration. The model has five geometrical and electrical parameters. The model is used to study the crystal with particles comparable in size with the Debye length of the electrolyte. The first- and second-order elastic constants are found for a broad range of densities. The model crystal turns out to be stable relative to small uniform stretching and shearing. It is also demonstrated that the Cauchy relation is not fulfilled in the crystal. This means that the pair effective interaction of any kind is not sufficient to proper model the elasticity of colloids within the one-component approach.
Philosophical Presentation in Ptolemy’s Harmonics: The Timaeus as a Model for Organization
Directory of Open Access Journals (Sweden)
Cristian Tolsa
2015-08-01
Full Text Available Ptolemy’s self-representation as philosopher is conventional in the Almagest but not so in Harmonics, which emulates Plato’s Timaeus and makes philosophy the result of understanding harmonics rather than the premise.
Intermittent dislocation density fluctuations in crystal plasticity from a phase-field crystal model
DEFF Research Database (Denmark)
Tarp, Jens M.; Angheluta, Luiza; Mathiesen, Joachim
2014-01-01
Plastic deformation mediated by collective dislocation dynamics is investigated in the two-dimensional phase-field crystal model of sheared single crystals. We find that intermittent fluctuations in the dislocation population number accompany bursts in the plastic strain-rate fluctuations...... propose a simple stochastic model of dislocation reaction kinetics that is able to capture these statistical properties of the dislocation density fluctuations as a function of shear rate....
Kersemans, Mathias; Martens, Arvid; Van Den Abeele, Koen; Degrieck, Joris; Pyl, Lincy; Zastavnik, Filip; Sol, Hugo; Van Paepegem, Wim
2015-04-01
Conventionally, the ultrasonic polar scan (UPS) records the amplitude or time-of-flight in transmission using short ultrasonic pulses for a wide range of incidence angles, resulting in a fingerprint of the critical bulk wave angles of the material at the insonified spot. Here, we investigate the use of quasi-harmonic ultrasound (bursts) in a polar scan experiment, both experimentally and numerically. It is shown that the nature of the fingerprint drastically changes, and reveals the positions of the leaky Lamb angles. To compare with experiments, both plane wave and bounded beam simulations have been performed based on the recursive stiffness matrix method. Whereas the plane wave computations yield a pure Lamb wave angle fingerprint, this is no longer valid for the more realistic case of a bounded beam. The experimental recordings are fully supported by the bounded beam simulations. To complement the traditional amplitude measurement, experimental and numerical investigations have been performed to record, predict and analyze the phase of the transmitted ultrasonic beam. This results in the conceptual introduction of the 'phase polar scan', exposing even more intriguing and detailed patterns. In fact, the combination of the amplitude and the phase polar scan provides the complete knowledge about the complex transmission coefficient for every possible angle of incidence. This comprehensive information will be very valuable for inverse modeling of the local elasticity tensor based on a single UPS experiment. Finally, the UPS method has been applied for the detection of an artificial delamination. Compared to the pulsed UPS, the quasi-harmonic UPS (both the amplitude and phase recording) shows a superior sensitivity to the presence of a delamination. Copyright © 2015 Elsevier B.V. All rights reserved.
Li, Mingliang; Deng, Mingxi; Gao, Guangjian; Xiang, Yanxun
2018-05-01
This paper investigated modeling of second-harmonic generation (SHG) of circumferential guided wave (CGW) propagation in a composite circular tube, and then analyzed the influences of interfacial properties on the SHG effect of primary CGW. Here the effect of SHG of primary CGW propagation is treated as a second-order perturbation to its linear wave response. Due to the convective nonlinearity and the inherent elastic nonlinearity of material, there are second-order bulk driving forces and surface/interface driving stresses in the interior and at the surface/interface of a composite circular tube, when a primary CGW mode propagates along its circumference. Based on the approach of modal expansion analysis for waveguide excitation, the said second-order driving forces/stresses are regarded as the excitation sources to generate a series of double-frequency CGW modes that constitute the second-harmonic field of the primary CGW propagation. It is found that the modal expansion coefficient of each double-frequency CGW mode is closely related to the interfacial stiffness constants that are used to describe the interfacial properties between the inner and outer circular parts of the composite tube. Furthermore, changes in the interfacial stiffness constants essentially influence the dispersion relation of CGW propagation. This will remarkably affect the efficiency of cumulative SHG of primary CGW propagation. Some finite element simulations have been implemented of response characteristics of cumulative SHG to the interfacial properties. Both the theoretical analyses and numerical simulations indicate that the effect of cumulative SHG is found to be much more sensitive to changes in the interfacial properties than primary CGW propagation. The potential of using the effect of cumulative SHG by primary CGW propagation to characterize a minor change in the interfacial properties is considered.
DEFF Research Database (Denmark)
Kwon, JunBum; Wang, Xiongfei; Bak, Claus Leth
2014-01-01
This paper addresses the harmonic compensation error problem existing with parallel connected inverter in the same grid interface conditions by means of impedance-based analysis and modeling. Unlike the single grid connected inverter, it is found that multiple parallel connected inverters and grid...... impedance can make influence to each other if they each have a harmonic compensation function. The analysis method proposed in this paper is based on the relationship between the overall output impedance and input impedance of parallel connected inverter, where controller gain design method, which can...
Optical third-harmonic generation using ultrashort laser pulses
International Nuclear Information System (INIS)
Stoker, D.; Keto, J.W.; Becker, M.F.
2005-01-01
To better predict optical third-harmonic generation (THG) in transparent dielectrics, we model a typical ultrashort pulsed Gaussian beam, including both group velocity mismatch and phase mismatch of the fundamental and harmonic fields. We find that competition between the group velocity mismatch and phase mismatch leads to third-harmonic generation that is sensitive only to interfaces. In this case, the spatial resolution is determined by the group velocity walk-off length. THG of modern femtosecond lasers in optical solids is a bulk process, without a surface susceptibility, but bears the signature of a surface enhancement effect in z-scan measurements. We demonstrate the accuracy of the model, by showing the agreement between the predicted spectral intensity and the measured third-harmonic spectrum from a thin sapphire crystal
Directory of Open Access Journals (Sweden)
Guohong Zou
2016-04-01
Full Text Available Crystals of congruently melting noncentrosymmetric (NCS mixed alkali metal nitrate, Rb2Na(NO33, have been grown through solid state reactions. The material possesses layers with NaO8 hexagonal bipyramids and NO3 triangular units. Rb+ cations are residing in the interlayer space. Each NaO8 hexagonal bipyramid shares its corners and edges with two and three NO3 units, respectively, in order to fulfill a highly dense stacking in the unit cell. The NaO8 groups share their six oxygen atoms in equatorial positions with three different NO3 groups to generate a NaO6-NO3 layer with a parallel alignment. The optimized arrangement of the NO3 groups and their high density in the structure together produce a strong second-harmonic generation (SHG response. Powder SHG measurements indicate that Rb2Na(NO33 has a strong SHG efficiency of five times that of KH2PO4 (KDP and is type I phase-matchable. The calculated average nonlinear optical (NLO susceptibility of Rb2Na(NO33 turns out to be the largest value among the NLO materials composed of only [NO3]− anion. In addition, Rb2Na(NO33 exhibits a wide transparency region ranging from UV to near IR, which suggests that the compound is a promising NLO material.
Model-driven harmonic parameterization of the cortical surface: HIP-HOP.
Auzias, G; Lefèvre, J; Le Troter, A; Fischer, C; Perrot, M; Régis, J; Coulon, O
2013-05-01
In the context of inter subject brain surface matching, we present a parameterization of the cortical surface constrained by a model of cortical organization. The parameterization is defined via an harmonic mapping of each hemisphere surface to a rectangular planar domain that integrates a representation of the model. As opposed to previous landmark-based registration methods we do not match folds between individuals but instead optimize the fit between cortical sulci and specific iso-coordinate axis in the model. This strategy overcomes some limitation to sulcus-based registration techniques such as topological variability in sulcal landmarks across subjects. Experiments on 62 subjects with manually traced sulci are presented and compared with the result of the Freesurfer software. The evaluation involves a measure of dispersion of sulci with both angular and area distortions. We show that the model-based strategy can lead to a natural, efficient and very fast (less than 5 min per hemisphere) method for defining inter subjects correspondences. We discuss how this approach also reduces the problems inherent to anatomically defined landmarks and open the way to the investigation of cortical organization through the notion of orientation and alignment of structures across the cortex.
International Nuclear Information System (INIS)
Looser, H.; Gunter, P.; Wu, X.; Arend, H.
1987-01-01
KNbO/sub 3/ is especially well suited for second harmonic generation of dye and Ga/sub 1-x/Al/sub x/As lasers with wavelength λ ≅ 860 nm. Using its high nonlinear optical coefficient, d/sub 32/ = 20.3 pm/V, noncritical type l phase matching is possible for fundamental wavelengths of 840-990 nm with crystal temperatures between -40 and 210 0 C. With a pulsed laser diode the authors previously reported 0.35-mW second harmonic peak power from 0.8-W fundamental frequency distributed among eight modes. In this paper, this work is extended to high-power monomode cw laser diodes. Other device parameters such as temperature stability and influence of the crystal homogeneity on the efficiency are discussed
Application of the spherical harmonic gravity model in high precision inertial navigation systems
International Nuclear Information System (INIS)
Wang, Jing; Yang, Gongliu; Zhou, Xiao; Li, Xiangyun
2016-01-01
The spherical harmonic gravity model (SHM) may, in general, be considered as a suitable alternative to the normal gravity model (NGM), because it represents the Earth’s gravitational field more accurately. However, the high-resolution SHM has never been used in current inertial navigation systems (INSs) due to its extremely complex expression. In this paper, the feasibility and accuracy of a truncated SHM are discussed for application in a real-time free-INS with a precision demand better than 0.8 nm h −1 . In particular, the time and space complexity are analyzed mathematically to verify the feasibility of the SHM. Also, a test on a typical navigation computer shows a storable range of cut-off degrees. To further evaluate the appropriate degree and accuracy of the truncated SHM, analyses of covariance and truncation error are proposed. Finally, a SHM of degree 12 is demonstrated to be the appropriate model for routine INSs in the precision range of 0.4–0.75 nm h −1 . Flight simulations and road tests show its outstanding performance over the traditional NGM. (paper)
Wanser, K. H.
1981-01-01
Silicon has interesting harmonic and anharmonic properties such as the low lying transverse acoustic modes at the X and L points of the Brillouin zone, negative Gruneisen parameters, negative thermal expansion and anomalous acoustic attenuation. In an attempt to understand these properties, a lattice dynamical model employing long range, nonlocal, dipole-dipole interactions was developed. Analytic expression for the Gruneisen parameters of several modes are presented. These expressions explain how the negative Gruneisen parameters arise. This model is applied to the calculation of the thermal expansion of silicon from 5K to 1700K. The thermoelastic contribution to the acoustic attenuation of silicon is computed from 1 to 300 K. Strong attenuation anomalies associated with negative thermal expansion are found in the vicinity of 17K and 125K.
Harmonic excitations in quasicrystals
International Nuclear Information System (INIS)
Luck, J.M.
1986-03-01
The harmonic excitations (phonons) of quasicrystals are studied in a simple one-dimensional model. The spectrum is a Cantor set, which exhibits selfsimilarity properties. The eigenstates are generically ''critical'', i.e. neither extended nor localized
Thermodynamic properties of a quasi-harmonic model for ferroelectric transitions
International Nuclear Information System (INIS)
Mkam Tchouobiap, S E; Mashiyama, H
2011-01-01
Within a framework of a quasi-harmonic model for quantum particles in a local potential of the double Morse type and within the mean-field approximation for interactions between particles, we investigate the thermodynamic properties of ferroelectric materials. A quantum thermodynamic treatment gives analytic expressions for the internal energy, the entropy, the specific heat, and the static susceptibility. The calculated thermodynamic characteristics are studied as a function of temperature and energy barrier, where it is shown that at the proper choice of the theory parameters, particularly the energy barrier, the model system exhibits characteristic features of either second-order tricritical or first-order phase transitions. Our results indicate that the barrier energy seems to be an important criterion for the character of the structural phase transition. The influence of quantum fluctuations manifested on zero-point energy on the phase transition and thermodynamic properties is analyzed and discussed. This leads to several quantum effects, including the existence of a saturation regime at low temperatures, where the order parameter saturates giving thermodynamic saturation of the calculated thermodynamic quantities. It is found that both quantum effects and energy barrier magnitude have an important influence on the thermodynamic properties of the ferroelectric materials and on driving the phase transition at low temperatures. Also, the analytical parameters' effect on the transition temperature is discussed, which seems to give a general insight into the structural phase transition and its nature.
International Nuclear Information System (INIS)
Irwin, J.S.
1992-01-01
A Round Table discussion was held at the 19th NATO/CCMS Conference on Atmospheric Dispersion with participation of approximately 50 scientists involved with various aspects of air quality assessment from over 15 countries. The premise of discussion was there is a need within the European Countries to provide a basis for developing an approach towards harmonization of air quality modeling. The term ''harmonization'' was used mostly in the sense that for the same input a simulation model would compute the same output. Concern was expressed that this usage was overly simplistic, prohibitively restrictive and counterproductive. The main benefits of achieving harmonization were 1) proper use of available meteorological data and 2) consistent treatment of source impacts throughout the European Community. The challenge before the European Community is to resolve in a realistic manner the problem of assessing environmental impacts in a manner that is fair throughout the European Community and proper within the scientific community. The resolution will involve compromises between 'being fair' and 'being state-of-the-science'. Accuracy and realism may be willingly sacrificed in order to achieve fairness. Developing consensus on how and what is to be achieved in the process of harmonization will involve difficult value judgments. But the consensus process should be encouraged given the significant and worthwhile benefits. (au)
The evolution of applied harmonic analysis models of the real world
Prestini, Elena
2016-01-01
A sweeping exploration of the development and far-reaching applications of harmonic analysis such as signal processing, digital music, optics, radio astronomy, crystallography, medical imaging, spectroscopy, and more. Featuring a wealth of illustrations, examples, and material not found in other harmonic analysis books, this unique monograph skillfully blends together historical narrative with scientific exposition to create a comprehensive yet accessible work. While only an understanding of calculus is required to appreciate it, there are more technical sections that will charm even specialists in harmonic analysis. From undergraduates to professional scientists, engineers, and mathematicians, there is something for everyone here. The second edition of The Evolution of Applied Harmonic Analysis contains a new chapter on atmospheric physics and climate change, making it more relevant for today’s audience. Praise for the first edition: "…can be thoroughly recommended to any reader who is curious about the ...
Bansal, Dipanshu; Aref, Amjad; Dargush, Gary; Delaire, Olivier
2016-09-01
Based on thermodynamic principles, we derive expressions quantifying the non-harmonic vibrational behavior of materials, which are rigorous yet easily evaluated from experimentally available data for the thermal expansion coefficient and the phonon density of states. These experimentally-derived quantities are valuable to benchmark first-principles theoretical predictions of harmonic and non-harmonic thermal behaviors using perturbation theory, ab initio molecular-dynamics, or Monte-Carlo simulations. We illustrate this analysis by computing the harmonic, dilational, and anharmonic contributions to the entropy, internal energy, and free energy of elemental aluminum and the ordered compound \\text{FeSi} over a wide range of temperature. Results agree well with previous data in the literature and provide an efficient approach to estimate anharmonic effects in materials.
Computational-Model-Based Analysis of Context Effects on Harmonic Expectancy
Morimoto, Satoshi; Remijn, Gerard B.; Nakajima, Yoshitaka
2016-01-01
Expectancy for an upcoming musical chord, harmonic expectancy, is supposedly based on automatic activation of tonal knowledge. Since previous studies implicitly relied on interpretations based on Western music theory, the underlying computational processes involved in harmonic expectancy and how it relates to tonality need further clarification. In particular, short chord sequences which cannot lead to unique keys are difficult to interpret in music theory. In this study, we examined effects ...
Bak, Claus Leth; Bak-Jensen, Birgitte; Wiechowski, Wojciech
2008-01-01
This paper demonstrates the results of implementation and verification of an already existing algorithm that allows for calculating saturation characteristics of singlephase power transformers. The algorithm was described for the first time in 1993. Now this algorithm has been implemented using the DIgSILENT Programming Language (DPL) as an external script in the harmonic domain calculations of a power system analysis tool PowerFactory [10]. The algorithm is verified by harmonic measurements ...
Energy Technology Data Exchange (ETDEWEB)
Davis, R.; Fishman, D.; Frank, E. D.; Wigmosta, M. S.; Aden, A.; Coleman, A. M.; Pienkos, P. T.; Skaggs, R. J.; Venteris, E. R.; Wang, M. Q.
2012-06-01
The U.S. Department of Energy's Biomass Program has begun an initiative to obtain consistent quantitative metrics for algal biofuel production to establish an 'integrated baseline' by harmonizing and combining the Program's national resource assessment (RA), techno-economic analysis (TEA), and life-cycle analysis (LCA) models. The baseline attempts to represent a plausible near-term production scenario with freshwater microalgae growth, extraction of lipids, and conversion via hydroprocessing to produce a renewable diesel (RD) blendstock. Differences in the prior TEA and LCA models were reconciled (harmonized) and the RA model was used to prioritize and select the most favorable consortium of sites that supports production of 5 billion gallons per year of RD. Aligning the TEA and LCA models produced slightly higher costs and emissions compared to the pre-harmonized results. However, after then applying the productivities predicted by the RA model (13 g/m2/d on annual average vs. 25 g/m2/d in the original models), the integrated baseline resulted in markedly higher costs and emissions. The relationship between performance (cost and emissions) and either productivity or lipid fraction was found to be non-linear, and important implications on the TEA and LCA results were observed after introducing seasonal variability from the RA model. Increasing productivity and lipid fraction alone was insufficient to achieve cost and emission targets; however, combined with lower energy, less expensive alternative technology scenarios, emissions and costs were substantially reduced.
Energy Technology Data Exchange (ETDEWEB)
Eliazar, Iddo, E-mail: eliazar@post.tau.ac.il
2017-05-15
The exponential, the normal, and the Poisson statistical laws are of major importance due to their universality. Harmonic statistics are as universal as the three aforementioned laws, but yet they fall short in their ‘public relations’ for the following reason: the full scope of harmonic statistics cannot be described in terms of a statistical law. In this paper we describe harmonic statistics, in their full scope, via an object termed harmonic Poisson process: a Poisson process, over the positive half-line, with a harmonic intensity. The paper reviews the harmonic Poisson process, investigates its properties, and presents the connections of this object to an assortment of topics: uniform statistics, scale invariance, random multiplicative perturbations, Pareto and inverse-Pareto statistics, exponential growth and exponential decay, power-law renormalization, convergence and domains of attraction, the Langevin equation, diffusions, Benford’s law, and 1/f noise. - Highlights: • Harmonic statistics are described and reviewed in detail. • Connections to various statistical laws are established. • Connections to perturbation, renormalization and dynamics are established.
International Nuclear Information System (INIS)
Eliazar, Iddo
2017-01-01
The exponential, the normal, and the Poisson statistical laws are of major importance due to their universality. Harmonic statistics are as universal as the three aforementioned laws, but yet they fall short in their ‘public relations’ for the following reason: the full scope of harmonic statistics cannot be described in terms of a statistical law. In this paper we describe harmonic statistics, in their full scope, via an object termed harmonic Poisson process: a Poisson process, over the positive half-line, with a harmonic intensity. The paper reviews the harmonic Poisson process, investigates its properties, and presents the connections of this object to an assortment of topics: uniform statistics, scale invariance, random multiplicative perturbations, Pareto and inverse-Pareto statistics, exponential growth and exponential decay, power-law renormalization, convergence and domains of attraction, the Langevin equation, diffusions, Benford’s law, and 1/f noise. - Highlights: • Harmonic statistics are described and reviewed in detail. • Connections to various statistical laws are established. • Connections to perturbation, renormalization and dynamics are established.
Multi-dimensional population balance models of crystallization processes
DEFF Research Database (Denmark)
Meisler, Kresten Troelstrup; von Solms, Nicolas
A generic and model-based framework for batch cooling crystallization operations has been extended to incorporate continuous and fed-batch processes. Modules for the framework have been developed, including a module for reactions, allowing the study of reactive crystallization within the framework....... A kinetic model library together with an ontology for knowledge representation has been developed, in which kinetic models and relations from the literature are stored along with the references and data. The model library connects to the generic modelling framework as well, as models can be retrieved......, analyzed, used for simulation and stored again. The model library facilitates comparison of expressions for kinetic phenomena and is tightly integrated with the model analysis tools of the framework.Through the framework, a model for a crystallization operation may be systematically generated...
Comprehensive FDTD modelling of photonic crystal waveguide components
DEFF Research Database (Denmark)
Lavrinenko, Andrei; Borel, Peter Ingo; Frandsen, Lars Hagedorn
2004-01-01
Planar photonic crystal waveguide structures have been modelled using the finite-difference-time-domain method and perfectly matched layers have been employed as boundary conditions. Comprehensive numerical calculations have been performed and compared to experimentally obtained transmission...
Zhou, Jianlong; Takatsuka, Masahiro
2009-01-01
Transfer functions facilitate the volumetric data visualization by assigning optical properties to various data features and scalar values. Automation of transfer function specifications still remains a challenge in volume rendering. This paper presents an approach for automating transfer function generations by utilizing topological attributes derived from the contour tree of a volume. The contour tree acts as a visual index to volume segments, and captures associated topological attributes involved in volumetric data. A residue flow model based on Darcy's Law is employed to control distributions of opacity between branches of the contour tree. Topological attributes are also used to control color selection in a perceptual color space and create harmonic color transfer functions. The generated transfer functions can depict inclusion relationship between structures and maximize opacity and color differences between them. The proposed approach allows efficient automation of transfer function generations, and exploration on the data to be carried out based on controlling of opacity residue flow rate instead of complex low-level transfer function parameter adjustments. Experiments on various data sets demonstrate the practical use of our approach in transfer function generations.
Directory of Open Access Journals (Sweden)
Niancheng Zhou
2014-08-01
Full Text Available The influence of electric vehicle charging stations on power grid harmonics is becoming increasingly significant as their presence continues to grow. This paper studies the operational principles of the charging current in the continuous and discontinuous modes for a three-phase uncontrolled rectification charger with a passive power factor correction link, which is affected by the charging power. A parameter estimation method is proposed for the equivalent circuit of the charger by using the measured characteristic AC (Alternating Current voltage and current data combined with the charging circuit constraints in the conduction process, and this method is verified using an experimental platform. The sensitivity of the current harmonics to the changes in the parameters is analyzed. An analytical harmonic model of the charging station is created by separating the chargers into groups by type. Then, the harmonic current amplification caused by the shunt active power filter is researched, and the analytical formula for the overload factor is derived to further correct the capacity of the shunt active power filter. Finally, this method is validated through a field test of a charging station.
Frequency Doubling Broadband Light in Multiple Crystals
International Nuclear Information System (INIS)
Alford, William J.; Smith, Arlee V.
2000-01-01
The authors compare frequency doubling of broadband light in a single nonlinear crystal with doubling in five crystals with intercrystal temporal walk off compensation, and with doubling in five crystals adjusted for offset phase matching frequencies. Using a plane-wave, dispersive numerical model of frequency doubling they study the bandwidth of the second harmonic and the conversion efficiency as functions of crystal length and fundamental irradiance. For low irradiance the offset phase matching arrangement has lower efficiency than a single crystal of the same total length but gives a broader second harmonic bandwidth. The walk off compensated arrangement gives both higher conversion efficiency and broader bandwidth than a single crystal. At high irradiance, both multicrystal arrangements improve on the single crystal efficiency while maintaining broad bandwidth
Numerical modeling in photonic crystals integrated technology: the COPERNICUS Project
DEFF Research Database (Denmark)
Malaguti, Stefania; Armaroli, Andrea; Bellanca, Gaetano
2011-01-01
Photonic crystals will play a fundamental role in the future of optical communications. The relevance of the numerical modeling for the success of this technology is assessed by using some examples concerning the experience of the COPERNICUS Project.......Photonic crystals will play a fundamental role in the future of optical communications. The relevance of the numerical modeling for the success of this technology is assessed by using some examples concerning the experience of the COPERNICUS Project....
Monte Carlo Modeling of Crystal Channeling at High Energies
Schoofs, Philippe; Cerutti, Francesco
Charged particles entering a crystal close to some preferred direction can be trapped in the electromagnetic potential well existing between consecutive planes or strings of atoms. This channeling effect can be used to extract beam particles if the crystal is bent beforehand. Crystal channeling is becoming a reliable and efficient technique for collimating beams and removing halo particles. At CERN, the installation of silicon crystals in the LHC is under scrutiny by the UA9 collaboration with the goal of investigating if they are a viable option for the collimation system upgrade. This thesis describes a new Monte Carlo model of planar channeling which has been developed from scratch in order to be implemented in the FLUKA code simulating particle transport and interactions. Crystal channels are described through the concept of continuous potential taking into account thermal motion of the lattice atoms and using Moliere screening function. The energy of the particle transverse motion determines whether or n...
Modeling and simulation of Si crystal growth from melt
Energy Technology Data Exchange (ETDEWEB)
Liu, Lijun; Liu, Xin; Li, Zaoyang [National Engineering Research Center for Fluid Machinery and Compressors, School of Energy and Power Engineering, Xi' an Jiaotong University, Xi' an, Shaanxi 710049 (China); Miyazawa, Hiroaki; Nakano, Satoshi; Kakimoto, Koichi [Research Institute for Applied Mechanics, Kyushu University, Kasuga 816-8580 (Japan)
2009-07-01
A numerical simulator was developed with a global model of heat transfer for any crystal growth taking place at high temperature. Convective, conductive and radiative heat transfers in the furnace are solved together in a conjugated way by a finite volume method. A three-dimensional (3D) global model was especially developed for simulation of heat transfer in any crystal growth with 3D features. The model enables 3D global simulation be conducted with moderate requirement of computer resources. The application of this numerical simulator to a CZ growth and a directional solidification process for Si crystals, the two major production methods for crystalline Si for solar cells, was introduced. Some typical results were presented, showing the importance and effectiveness of numerical simulation in analyzing and improving these kinds of Si crystal growth processes from melt. (copyright 2009 WILEY-VCH Verlag GmbH and Co. KGaA, Weinheim) (orig.)
DEFF Research Database (Denmark)
Kwon, Jun Bum; Wang, Xiongfei; Bak, Claus Leth
2015-01-01
As the increasing of power electronics based systems, not only the component-based analysis but also a systematic interaction analysis with each other systems are being important. Especially studies about the stability and the harmonics interaction are critical in order to establish the required ...
Theoretical modeling of zircon's crystal morphology according to data of atomistic calculations
Gromalova, Natalia; Nikishaeva, Nadezhda; Eremin, Nikolay
2017-04-01
Zircon is an essential mineral that is used in the U-Pb dating. Moreover, zircon is highly resistant to radioactive exposure. It is of great interest in solving both fundamental and applied problems associated with the isolation of high-level radioactive waste. There is significant progress in forecasting of the most energetically favorable crystal structures at the present time. Unfortunately, the theoretical forecast of crystal morphology at high technological level is under-explored nowadays, though the estimation of crystal equilibrium habit is extremely important in studying the physical and chemical properties of new materials. For the first time, the thesis about relation of the equilibrium shape of a crystal with its crystal structure was put forward in the works by O.Brave. According to it, the idealized habit is determined in the simplest case by a correspondence with the reticular densities Rhkl of individual faces. This approach, along with all subsequent corrections, does not take into account the nature of atoms and the specific features of the chemical bond in crystals. The atomistic calculations of crystal surfaces are commonly performed using the energetic characteristics of faces, namely, the surface energy (Esurf), which is a measure of the thermodynamic stability of the crystal face. The stable crystal faces are characterized by small positive values of Esurf. As we know from our previous research (Gromalova et al.,2015) one of the constitutive factors affecting the value of the surface energy in calculations is a choice of potentials model. In this regard, we studied several sets of parameters of atomistic interatomic potentials optimized previously. As the first test model («Zircon 1») were used sets of interatomic potentials of interaction Zr-O, Si-O and O-O in the form of Buckingham potentials. To improve playback properties of zircon additionally used Morse potential for a couple of Zr-Si, as well as the three-particle angular harmonic
Data Assimilation and Adjusted Spherical Harmonic Model of VTEC Map over Thailand
Klinngam, Somjai; Maruyama, Takashi; Tsugawa, Takuya; Ishii, Mamoru; Supnithi, Pornchai; Chiablaem, Athiwat
2016-07-01
The global navigation satellite system (GNSS) and high frequency (HF) communication are vulnerable to the ionospheric irregularities, especially when the signal travels through the low-latitude region and around the magnetic equator known as equatorial ionization anomaly (EIA) region. In order to study the ionospheric effects to the communications performance in this region, the regional map of the observed total electron content (TEC) can show the characteristic and irregularities of the ionosphere. In this work, we develop the two-dimensional (2D) map of vertical TEC (VTEC) over Thailand using the adjusted spherical harmonic model (ASHM) and the data assimilation technique. We calculate the VTEC from the receiver independent exchange (RINEX) files recorded by the dual-frequency global positioning system (GPS) receivers on July 8th, 2012 (quiet day) at 12 stations around Thailand: 0° to 25°E and 95°N to 110°N. These stations are managed by Department of Public Works and Town & Country Planning (DPT), Thailand, and the South East Asia Low-latitude ionospheric Network (SEALION) project operated by National Institute of Information and Communications Technology (NICT), Japan, and King Mongkut's Institute of Technology Ladkrabang (KMITL). We compute the median observed VTEC (OBS-VTEC) in the grids with the spatial resolution of 2.5°x5° in latitude and longitude and time resolution of 2 hours. We assimilate the OBS-VTEC with the estimated VTEC from the International Reference Ionosphere model (IRI-VTEC) as well as the ionosphere map exchange (IONEX) files provided by the International GNSS Service (IGS-VTEC). The results show that the estimation of the 15-degree ASHM can be improved when both of IRI-VTEC and IGS-VTEC are weighted by the latitude-dependent factors before assimilating with the OBS-VTEC. However, the IRI-VTEC assimilation can improve the ASHM estimation more than the IGS-VTEC assimilation. Acknowledgment: This work is partially funded by the
Comment on 'Modelling of surface energies of elemental crystals'
International Nuclear Information System (INIS)
Li Jinping; Luo Xiaoguang; Hu Ping; Dong Shanliang
2009-01-01
Jiang et al (2004 J. Phys.: Condens. Matter 16 521) present a model based on the traditional broken-bond model for predicting surface energies of elemental crystals. It is found that bias errors can be produced in calculating the coordination numbers of surface atoms, especially in the prediction of high-Miller-index surface energies. (comment)
Understanding fifth-harmonic generation in CLBO
Patankar, S.; Yang, S. T.; Moody, J. D.; Bayramian, A. J.; Swadling, G. F.; Barker, D.; Datte, P.; Mennerat, G.; Norton, M.; Carr, C. W.; Begishev, I. A.; Bromage, J.; Ross, J. S.
2018-02-01
We report on results of fifth harmonic generation in Cesium Lithium Borate (CLBO) using a three-crystal cascaded frequency conversion scheme designed to study the energy balance of the final sum frequency generation stage. The experimental setup independently combines the first and fourth harmonic of a Nd:Glass laser in a 5mm thick CLBO crystal. Energy balance between the incoming and output energy is close to unity when the CLBO is out of phase matching and approximately 80% when the crystal is in phase matching. A detailed analysis of the residual fundamental and fourth harmonic energy indicates 5th harmonic light is being generated but only 26% is unaccounted for. We attribute the missing light to linear transmission loss in the CLBO oven. The ratio of the output to input energy is unity when the missing 5th harmonic is incorporated into the calculations. Two-dimensional plane wave mixing simulations show agreement with the results at lower intensities.
Siva Sesha Reddy, A.; Jedryka, J.; Ozga, K.; Ravi Kumar, V.; Purnachand, N.; Kityk, I. V.; Veeraiah, N.
2018-02-01
In this study zinc borate glasses doped with different concentrations Ta2O5 were synthesized and were crystallized by heat treatment for prolonged times. The samples were characterized by XRD, SEM, IR and Raman spectroscopy techniques. The SEM images of the crystallized samples have indicated that the samples contain randomly distributed crystal grains with size ∼1 μm entrenched in the residual amorphous phase. XRD studies have exhibited diffraction peaks identified as being due to the reflections from (1 1 1) planes of monoclinic Zn3Ta2O8 crystal phase that contains intertwined tetrahedral zinc and octahedral tantalate structural units. The concentration of such crystal phases in the bulk samples is observed to increase with increase of Ta2O5 up to 3.0 mol%. The IR and Raman spectroscopy studies have confirmed the presence of ZnO4 and TaO6 structural units in the glass network in addition to the conventional borate structural units. For measuring third harmonic generation (THG) in the samples, the samples were irradiated with 532 nm laser beam and the intensity of THG of probing beam (Nd:YAG λ = 1064 nm 20 ns pulsed laser (ω)) is measured as a function of fundamental beam power varying up to 200 J/m2. The intensity of THG is found to be increasing with increase of fundamental beam power and found to be the maximal for the glass crystallized with 3.0 mol% of Ta2O5. The intensity of THG of the ceramicized samples is found to be nearly 5 times higher with respect to that of pre-crystallized samples. The generation of 3ω is attributed to the perturbation/interaction between Zn3Ta2O8 anisotropic crystal grains and the incident probing beam.
Directory of Open Access Journals (Sweden)
Yang Yu
2013-01-01
Full Text Available Based on a brief review on current harmonics generation mechanism for grid-connected inverter under distorted grid voltage, the harmonic disturbances and uncertain items are immersed into the original state-space differential equation of grid-connected inverter. A new algorithm of global current harmonic rejection based on nonlinear backstepping control with multivariable internal model principle is proposed for grid-connected inverter with exogenous disturbances and uncertainties. A type of multivariable internal model for a class of nonlinear harmonic disturbances is constructed. Based on application of backstepping control law of the nominal system, a multivariable adaptive state feedback controller combined with multivariable internal model and adaptive control law is designed to guarantee the closed-loop system globally uniformly bounded, which is proved by a constructed Lyapunov function. The presented algorithm extends rejection of nonlinear single-input systems to multivariable globally defined normal form, the correctness and effectiveness of which are verified by the simulation results.
Tarumi, Moto; Nakai, Hiromi
2018-05-01
This letter proposes an approximate treatment of the harmonic solvation model (HSM) assuming the solute to be a rigid body (RB-HSM). The HSM method can appropriately estimate the Gibbs free energy for condensed phases even where an ideal gas model used by standard quantum chemical programs fails. The RB-HSM method eliminates calculations for intra-molecular vibrations in order to reduce the computational costs. Numerical assessments indicated that the RB-HSM method can evaluate entropies and internal energies with the same accuracy as the HSM method but with lower calculation costs.
International Nuclear Information System (INIS)
Grekov, D.; Kasilov, S.; Kernbichler, W.
2016-01-01
A two dimensional numerical code for computation of the electromagnetic field of a fast magnetosonic wave in a tokamak at high harmonics of the ion cyclotron frequency has been developed. The code computes the finite difference solution of Maxwell equations for separate toroidal harmonics making use of the toroidal symmetry of tokamak plasmas. The proper boundary conditions are prescribed at the realistic tokamak vessel. The currents in the RF antenna are specified externally and then used in Ampere law. The main poloidal tokamak magnetic field and the ''kinetic'' part of the dielectric permeability tensor are treated iteratively. The code has been verified against known analytical solutions and first calculations of current drive in the spherical torus are presented.
Modeling and analysis of harmonic resonance in a power electronics based AC power system
DEFF Research Database (Denmark)
Wang, Xiongfei; Blaabjerg, Frede; Chen, Zhe
2013-01-01
The dynamic interactions among the interconnected power converters may bring in harmonic resonance in a power electronics based power system. This paper addresses this issue in a power system dominated by multiple current- and voltage-controlled inverters with LCL- and LC-filters. The impedance...... stability criterion. To validate the theoretical analysis, the time domain simulations and experimental tests on a three-inverter-based system are presented....
Directory of Open Access Journals (Sweden)
Kalamatiev Todor
2014-01-01
Full Text Available The European integration process accompanied by the harmonization of the EU member states' legislation will inevitably lead to the establishment of a European social model which has a 'sui generis' legal nature. European social model forms a part of the common legal heritage of the European countries and it can be defined as a system of values that include democracy and individual rights, free collective bargaining, market economy, equal opportunities for all, and social protection and solidarity. Subject of analysis in this paper are both, the essential components of the European social model such as: the social 'acquis communautaire' and the European industrial relations. The social 'acquis communautaire' is an integral part of the general 'acquis communautaire' and it encompasses the regulations arising from the primary and secondary labour law legislation of the EU, decisions of the European Court of Justice and other legal measures of the European Union with a binding or non-binding legal nature. European industrial relations encompass the key features of the European trade union models as well as the types of social dialogue in different EU member states. This paper pays attention to a profound elaboration of the harmonization of two EU labour law directives with the Macedonian employment legislation. The first Directive (Directive 91/533/EEC of 14 October 1991 on an employers' obligation to inform employees of the conditions applicable to the contract or employment relationship may be classified in the field of individual employment relations, while the second one (Directive 2002/14/EC of 11 March 2002 establishing a general framework for informing and consulting employees in the European Community can be subsumed within the field of collective employment relations. Finally, the authors illustrate the advantages and disadvantages of the Macedonian labour legislation in the process of harmonization with the relevant EU directives
Pruitt, Kathryn Ringler
2012-01-01
This dissertation proposes a model of word stress in a derivational version of Optimality Theory (OT) called Harmonic Serialism (HS; Prince and Smolensky 1993/2004, McCarthy 2000, 2006, 2010a). In this model, the metrical structure of a word is derived through a series of optimizations in which the "best" metrical foot is chosen…
Convergence of surface diffusion parameters with model crystal size
Cohen, Jennifer M.; Voter, Arthur F.
1994-07-01
A study of the variation in the calculated quantities for adatom diffusion with respect to the size of the model crystal is presented. The reported quantities include surface diffusion barrier heights, pre-exponential factors, and dynamical correction factors. Embedded atom method (EAM) potentials were used throughout this effort. Both the layer size and the depth of the crystal were found to influence the values of the Arrhenius factors significantly. In particular, exchange type mechanisms required a significantly larger model than standard hopping mechanisms to determine adatom diffusion barriers of equivalent accuracy. The dynamical events that govern the corrections to transition state theory (TST) did not appear to be as sensitive to crystal depth. Suitable criteria for the convergence of the diffusion parameters with regard to the rate properties are illustrated.
Lastre, Arlys; Torriente, Ives; Méndez, Erik F.; Cordovés, Alexis
2017-06-01
In the present investigation, the authors propose a conceptual model for the analysis and the decision making of the corrective models to use in the mitigation of the harmonic distortion. The authors considered the setting of conventional models, and such adaptive models like the filters incorporation to networks neuronal artificial (RNA's) for the mitigating effect. In addition to the present work is a showing of the experimental model that learns by means of a flowchart denoting the need to use artificial intelligence skills for the exposition of the proposed model. The other aspect considered and analyzed are the adaptability and usage of the same, considering a local reference of the laws and lineaments of energy quality that demands the Department of Electricity and Energy Renewable (MEER) of Equator.
Yu, Yi; Huang, Yisheng; Zhang, Lizhen; Lin, Zhoubin; Sun, Shijia; Wang, Guofu
2014-07-01
A Nd3+:Na2La4(WO4)7 crystal with dimensions of ϕ 17 × 30 mm3 was grown by the Czochralski method. The thermal expansion coefficients of Nd3+:Na2La4(WO4)7 crystal are 1.32 × 10-5 K-1 along c-axis and 1.23 × 10-5 K-1 along a-axis, respectively. The spectroscopic characteristics of Nd3+:Na2La4(WO4)7 crystal were investigated. The Judd-Ofelt theory was applied to calculate the spectral parameters. The absorption cross sections at 805 nm are 2.17 × 10-20 cm2 with a full width at half maximum (FWHM) of 15 nm for π-polarization, and 2.29 × 10-20 cm2 with a FWHM of 14 nm for σ-polarization. The emission cross sections are 3.19 × 10-20 cm2 for σ-polarization and 2.67 × 10-20 cm2 for π-polarization at 1,064 nm. The fluorescence quantum efficiency is 67 %. The quasi-cw laser of Nd3+:Na2La4(WO4)7 crystal was performed. The maximum output power is 80 mW. The slope efficiency is 7.12 %. The results suggest Nd3+:Na2La4(WO4)7 crystal as a promising laser crystal fit for laser diode pumping.
Eck, Simon; Wörz, Stefan; Müller-Ott, Katharina; Hahn, Matthias; Biesdorf, Andreas; Schotta, Gunnar; Rippe, Karsten; Rohr, Karl
2016-08-01
The genome is partitioned into regions of euchromatin and heterochromatin. The organization of heterochromatin is important for the regulation of cellular processes such as chromosome segregation and gene silencing, and their misregulation is linked to cancer and other diseases. We present a model-based approach for automatic 3D segmentation and 3D shape analysis of heterochromatin foci from 3D confocal light microscopy images. Our approach employs a novel 3D intensity model based on spherical harmonics, which analytically describes the shape and intensities of the foci. The model parameters are determined by fitting the model to the image intensities using least-squares minimization. To characterize the 3D shape of the foci, we exploit the computed spherical harmonics coefficients and determine a shape descriptor. We applied our approach to 3D synthetic image data as well as real 3D static and real 3D time-lapse microscopy images, and compared the performance with that of previous approaches. It turned out that our approach yields accurate 3D segmentation results and performs better than previous approaches. We also show that our approach can be used for quantifying 3D shape differences of heterochromatin foci. Copyright © 2016 Elsevier B.V. All rights reserved.
A model of the two-dimensional quantum harmonic oscillator in an AdS{sub 3} background
Energy Technology Data Exchange (ETDEWEB)
Frick, R. [Universitaet zu Koeln, Institut fuer Theoretische Physik, Cologne (Germany)
2016-10-15
In this paper we study a model of the two-dimensional quantum harmonic oscillator in a three-dimensional anti-de Sitter background. We use a generalized Schroedinger picture in which the analogs of the Schroedinger operators of the particle are independent of both the time and the space coordinates in different representations. The spacetime independent operators of the particle induce the Lie algebra of Killing vector fields of the AdS{sub 3} spacetime. In this picture, we have a metamorphosis of the Heisenberg uncertainty relations. (orig.)
Bennett, Charles L [Livermore, CA
2009-10-20
A high efficiency harmonic engine based on a resonantly reciprocating piston expander that extracts work from heat and pressurizes working fluid in a reciprocating piston compressor. The engine preferably includes harmonic oscillator valves capable of oscillating at a resonant frequency for controlling the flow of working fluid into and out of the expander, and also preferably includes a shunt line connecting an expansion chamber of the expander to a buffer chamber of the expander for minimizing pressure variations in the fluidic circuit of the engine. The engine is especially designed to operate with very high temperature input to the expander and very low temperature input to the compressor, to produce very high thermal conversion efficiency.
Discrete dislocation plasticity modeling of short cracks in single crystals
Deshpande, VS; Needleman, A; Van der Giessen, E
2003-01-01
The mode-I crack growth behavior of geometrically similar edge-cracked single crystal specimens of varying size subject to both monotonic and cyclic axial loading is analyzed using discrete dislocation dynamics. Plastic deformation is modeled through the motion of edge dislocations in an elastic
International Nuclear Information System (INIS)
Gover, A.; Friedman, A.; Luccio, A.
1986-09-01
A full 3-D Analysis of super-radiant (bunched electron) free electron harmonic radiation is presented. A generalized form of the FEL pendulum equation was derived and numerically solved. Both spectral and phasor formulation were developed to treat the radiation in the time domain. In space the radiation field is expanded in terms of either a set of free space discrete modes or plane waves. The numerical solutions reveal some new distinctly 3-D effects to which we provide a physical explanation. 12 refs., 9 figs., 5 tabs
Clean Floquet Time Crystals: Models and Realizations in Cold Atoms
Huang, Biao; Wu, Ying-Hai; Liu, W. Vincent
2018-03-01
Time crystals, a phase showing spontaneous breaking of time-translation symmetry, has been an intriguing subject for systems far away from equilibrium. Recent experiments found such a phase in both the presence and the absence of localization, while in theories localization by disorder is usually assumed a priori. In this work, we point out that time crystals can generally exist in systems without disorder. A series of clean quasi-one-dimensional models under Floquet driving are proposed to demonstrate this unexpected result in principle. Robust time crystalline orders are found in the strongly interacting regime along with the emergent integrals of motion in the dynamical system, which can be characterized by level statistics and the out-of-time-ordered correlators. We propose two cold atom experimental schemes to realize the clean Floquet time crystals, one by making use of dipolar gases and another by synthetic dimensions.
Lumped model for rotational modes in phononic crystals
Peng, Pai
2012-10-16
We present a lumped model for the rotational modes induced by the rotational motion of individual scatterers in two-dimensional phononic crystals comprised of square arrays of solid cylindrical scatterers in solid hosts. The model provides a physical interpretation of the origin of the rotational modes, reveals the important role played by the rotational motion in determining the band structure, and reproduces the dispersion relations in a certain range. The model increases the possibilities of manipulating wave propagation in phononic crystals. In particular, expressions derived from the model for eigenfrequencies at high symmetry points unambiguously predict the presence of a new type of Dirac-like cone at the Brillouin center, which is found to be the result of accidental degeneracy of the rotational and dipolar modes.
Lumped model for rotational modes in phononic crystals
Peng, Pai; Mei, Jun; Wu, Ying
2012-01-01
We present a lumped model for the rotational modes induced by the rotational motion of individual scatterers in two-dimensional phononic crystals comprised of square arrays of solid cylindrical scatterers in solid hosts. The model provides a physical interpretation of the origin of the rotational modes, reveals the important role played by the rotational motion in determining the band structure, and reproduces the dispersion relations in a certain range. The model increases the possibilities of manipulating wave propagation in phononic crystals. In particular, expressions derived from the model for eigenfrequencies at high symmetry points unambiguously predict the presence of a new type of Dirac-like cone at the Brillouin center, which is found to be the result of accidental degeneracy of the rotational and dipolar modes.
Crystal structure representations for machine learning models of formation energies
Energy Technology Data Exchange (ETDEWEB)
Faber, Felix [Department of Chemistry, Institute of Physical Chemistry and National Center for Computational Design and Discovery of Novel Materials, University of Basel Switzerland; Lindmaa, Alexander [Department of Physics, Chemistry and Biology, Linköping University, SE-581 83 Linköping Sweden; von Lilienfeld, O. Anatole [Department of Chemistry, Institute of Physical Chemistry and National Center for Computational Design and Discovery of Novel Materials, University of Basel Switzerland; Argonne Leadership Computing Facility, Argonne National Laboratory, 9700 S. Cass Avenue Lemont Illinois 60439; Armiento, Rickard [Department of Physics, Chemistry and Biology, Linköping University, SE-581 83 Linköping Sweden
2015-04-20
We introduce and evaluate a set of feature vector representations of crystal structures for machine learning (ML) models of formation energies of solids. ML models of atomization energies of organic molecules have been successful using a Coulomb matrix representation of the molecule. We consider three ways to generalize such representations to periodic systems: (i) a matrix where each element is related to the Ewald sum of the electrostatic interaction between two different atoms in the unit cell repeated over the lattice; (ii) an extended Coulomb-like matrix that takes into account a number of neighboring unit cells; and (iii) an ansatz that mimics the periodicity and the basic features of the elements in the Ewald sum matrix using a sine function of the crystal coordinates of the atoms. The representations are compared for a Laplacian kernel with Manhattan norm, trained to reproduce formation energies using a dataset of 3938 crystal structures obtained from the Materials Project. For training sets consisting of 3000 crystals, the generalization error in predicting formation energies of new structures corresponds to (i) 0.49, (ii) 0.64, and (iii) 0.37eV/atom for the respective representations.
A hybrid model of primary radiation damage in crystals
International Nuclear Information System (INIS)
Samarin, S.I.; Dremov, V.V.
2009-01-01
The paper offers a hybrid model which combines molecular dynamics and Monte Carlo (MD+MC) methods to describe primary radiation damage in crystals, caused by particles whose energies are no higher than several tens of keV. The particles are tracked in accord with equations of motion with account for pair interaction. The model also considers particle interaction with the mean-field potential (MFP) of the crystal. Only particles involved in cascading are tracked. Equations of motion for these particles include dissipative forces which describe energy exchange between cascade particles and electrons. New particles - the atoms of the crystal in the cascade region - have stochastic parameters (phase coordinates); they are sampled by the Monte Carlo method from the distribution that describes the classic canonical ensemble of non-interacting particles subjected to the external MFP. The introduction of particle interaction with the MFP helps avoid difficulties related to crystal stability and the choice of an adequate interparticle interaction potential in the traditional MD methods. Our technique is many times as fast as the traditional MD methods because we consider only particles which are involved in cascading and apply special methods to speedup the calculation of forces by accounting for the short-range pair potential used
Jiang, FY; Lu, WX; Zhai, JP; Ye, JT; Wong, GKL; Han, Xueyao; Tang, ZK
2006-01-01
Disperse red 1 (DR1) molecules have been successfully incorporated into the one-dimensional channels of AlPO4-5 single crystals by means of vapor-phase diffusion. Polarizing microscope and SHG results indicate that the DR1 molecules are well aligned in a preferred direction along the crystal
Ikuma, Takeshi; Kunduk, Melda; McWhorter, Andrew J.
2014-01-01
Purpose: The model-based quantitative analysis of high-speed videoendoscopy (HSV) data at a low frame rate of 2,000 frames per second was assessed for its clinical adequacy. Stepwise regression was employed to evaluate the HSV parameters using harmonic models and their relationships to the Voice Handicap Index (VHI). Also, the model-based HSV…
A Method for Harmonic Sources Detection based on Harmonic Distortion Power Rate
Lin, Ruixing; Xu, Lin; Zheng, Xian
2018-03-01
Harmonic sources detection at the point of common coupling is an essential step for harmonic contribution determination and harmonic mitigation. The harmonic distortion power rate index is proposed for harmonic source location based on IEEE Std 1459-2010 in the paper. The method only based on harmonic distortion power is not suitable when the background harmonic is large. To solve this problem, a threshold is determined by the prior information, when the harmonic distortion power is larger than the threshold, the customer side is considered as the main harmonic source, otherwise, the utility side is. A simple model of public power system was built in MATLAB/Simulink and field test results of typical harmonic loads verified the effectiveness of proposed method.
Cluster models of light nuclei and the method of hyperspherical harmonics: Successes and challenges
International Nuclear Information System (INIS)
Danilin, B. V.; Shul'gina, N. B.; Ershov, S. N.; Vaagen, J. S.
2009-01-01
Hyperspherical-harmonics method to investigate the lightest nuclei having three-cluster structure is discussed together with recent experiments. Properties of bound states and methods to explore three-body continuum are presented. The challenges created by large neutron excess and halo phenomena are highlighted. Astrophysical aspects of the 7 Li + n → 8 Li + γ reaction and the solar-boron-neutrinos problem are analyzed. Three-cluster structure of highly excited states in 8 Be is shown to be responsible for extreme isospin mixing. Progress in studies of 6 He- and 11 Li-induced inclusive and exclusive nuclear reactions is demonstrated, providing information on the nature of continuum structures of Borromean nuclei.
Models of protein-ligand crystal structures: trust, but verify.
Deller, Marc C; Rupp, Bernhard
2015-09-01
X-ray crystallography provides the most accurate models of protein-ligand structures. These models serve as the foundation of many computational methods including structure prediction, molecular modelling, and structure-based drug design. The success of these computational methods ultimately depends on the quality of the underlying protein-ligand models. X-ray crystallography offers the unparalleled advantage of a clear mathematical formalism relating the experimental data to the protein-ligand model. In the case of X-ray crystallography, the primary experimental evidence is the electron density of the molecules forming the crystal. The first step in the generation of an accurate and precise crystallographic model is the interpretation of the electron density of the crystal, typically carried out by construction of an atomic model. The atomic model must then be validated for fit to the experimental electron density and also for agreement with prior expectations of stereochemistry. Stringent validation of protein-ligand models has become possible as a result of the mandatory deposition of primary diffraction data, and many computational tools are now available to aid in the validation process. Validation of protein-ligand complexes has revealed some instances of overenthusiastic interpretation of ligand density. Fundamental concepts and metrics of protein-ligand quality validation are discussed and we highlight software tools to assist in this process. It is essential that end users select high quality protein-ligand models for their computational and biological studies, and we provide an overview of how this can be achieved.
Wang, Cheng; He, Yue; Lu, Bin; Jiang, Jun; Miao, Li; Deng, Xian-Jin; Xiong, Yong-zhong; Zhang, Jian
2017-11-01
This paper presents a sub-harmonic mixer at 340 GHz based on anti-parallel Schottky diodes (SBDs). Intrinsic resonances in low-pass hammer-head filter have been adopted to enhance the isolation for different harmonic components, while greatly minimizing the transmission loss. The application of new DC grounding structure, impedance matching structure, and suspended micro-strip mitigates the negative influences of fabrication errors from metal cavity, quartz substrate, and micro-assembly. An improved lumped element equivalent circuit model of SBDs guarantees the accuracy of simulation, which takes current-voltage (I/V) behavior, capacitance-voltage (C/V) behavior, carrier velocity saturation, DC series resistor, plasma resonance, skin effect, and four kinds of noise generation mechanisms into consideration thoroughly. The measurement indicates that with local oscillating signal of 2 mW, the lowest double sideband conversion loss is 5.5 dB at 339 GHz; the corresponding DSB noise temperature is 757 K. The 3 dB bandwidth of conversion loss is 50 GHz from 317 to 367 GHz.
Mathematical modeling and numerical simulation of Czochralski Crystal Growth
Energy Technology Data Exchange (ETDEWEB)
Jaervinen, J.; Nieminen, R. [Center for Scientific Computing, Espoo (Finland)
1996-12-31
A detailed mathematical model and numerical simulation tools based on the SUPG Finite Element Method for the Czochralski crystal growth has been developed. In this presentation the mathematical modeling and numerical simulation of the melt flow and the temperature distribution in a rotationally symmetric crystal growth environment is investigated. The temperature distribution and the position of the free boundary between the solid and liquid phases are solved by using the Enthalpy method. Heat inside of the Czochralski furnace is transferred by radiation, conduction and convection. The melt flow is governed by the incompressible Navier-Stokes equations coupled with the enthalpy equation. The melt flow is numerically demonstrated and the temperature distribution in the whole Czochralski furnace. (author)
Mathematical modeling and numerical simulation of Czochralski Crystal Growth
Energy Technology Data Exchange (ETDEWEB)
Jaervinen, J; Nieminen, R [Center for Scientific Computing, Espoo (Finland)
1997-12-31
A detailed mathematical model and numerical simulation tools based on the SUPG Finite Element Method for the Czochralski crystal growth has been developed. In this presentation the mathematical modeling and numerical simulation of the melt flow and the temperature distribution in a rotationally symmetric crystal growth environment is investigated. The temperature distribution and the position of the free boundary between the solid and liquid phases are solved by using the Enthalpy method. Heat inside of the Czochralski furnace is transferred by radiation, conduction and convection. The melt flow is governed by the incompressible Navier-Stokes equations coupled with the enthalpy equation. The melt flow is numerically demonstrated and the temperature distribution in the whole Czochralski furnace. (author)
Cheng, Rendy P.; Tischler, Mark B.; Celi, Roberto
2006-01-01
This research describes a new methodology for the extraction of a high-order, linear time invariant model, which allows the periodicity of the helicopter response to be accurately captured. This model provides the needed level of dynamic fidelity to permit an analysis and optimization of the AFCS and HHC algorithms. The key results of this study indicate that the closed-loop HHC system has little influence on the AFCS or on the vehicle handling qualities, which indicates that the AFCS does not need modification to work with the HHC system. However, the results show that the vibration response to maneuvers must be considered during the HHC design process, and this leads to much higher required HHC loop crossover frequencies. This research also demonstrates that the transient vibration responses during maneuvers can be reduced by optimizing the closed-loop higher harmonic control algorithm using conventional control system analyses.
Jacobian elliptic wave solutions in an anharmonic molecular crystal model
International Nuclear Information System (INIS)
Teh, C.G.R.; Lee, B.S.; Koo, W.K.
1997-07-01
Explicit Jacobian elliptic wave solutions are found in the anharmonic molecular crystal model for both the continuum limit and discrete modes. This class of wave solutions include the famous pulse-like and kink-like solitary modes. We would also like to report on the existence of some highly discrete staggered solitary wave modes not found in the continuum limit. (author). 9 refs, 1 fig
Numerical methods for modeling photonic-crystal VCSELs
DEFF Research Database (Denmark)
Dems, Maciej; Chung, Il-Sug; Nyakas, Peter
2010-01-01
We show comparison of four different numerical methods for simulating Photonic-Crystal (PC) VCSELs. We present the theoretical basis behind each method and analyze the differences by studying a benchmark VCSEL structure, where the PC structure penetrates all VCSEL layers, the entire top-mirror DBR...... to the effective index method. The simulation results elucidate the strength and weaknesses of the analyzed methods; and outline the limits of applicability of the different models....
A macroscopic model for magnetic shape-memory single crystals
Czech Academy of Sciences Publication Activity Database
Bessoud, A. L.; Kružík, Martin; Stefanelli, U.
2013-01-01
Roč. 64, č. 2 (2013), s. 343-359 ISSN 0044-2275 R&D Projects: GA AV ČR IAA100750802; GA ČR GAP201/10/0357 Institutional support: RVO:67985556 Keywords : magnetostriction * evolution Subject RIV: BA - General Mathematics Impact factor: 1.214, year: 2013 http://library.utia.cas.cz/separaty/2012/MTR/kruzik-a macroscopic model for magnetic shape- memory single crystals.pdf
Icosahedral symmetry described by an incommensurately modulated crystal structure model
DEFF Research Database (Denmark)
Wolny, Janusz; Lebech, Bente
1986-01-01
A crystal structure model of an incommensurately modulated structure is presented. Although six different reciprocal vectors are used to describe the model, all calculations are done in three dimensions making calculation of the real-space structure trivial. Using this model, it is shown that both...... the positions of the bragg reflections and information about the relative intensities of these reflections are in full accordance with the diffraction patterns reported for microcrystals of the rapidly quenched Al86Mn14 alloy. It is also shown that at least the local structure possesses full icosahedral...
One dimension harmonic oscillator
International Nuclear Information System (INIS)
Cohen-Tannoudji, Claude; Diu, Bernard; Laloe, Franck.
1977-01-01
The importance of harmonic oscillator in classical and quantum physics, eigenvalues and eigenstates of hamiltonian operator are discussed. In complement are presented: study of some physical examples of harmonic oscillators; study of stationnary states in the /x> representation; Hermite polynomials; resolution of eigenvalue equation of harmonic oscillator by polynomial method; isotope harmonic oscillator with three dimensions; charged harmonic oscillator in uniform electric field; quasi classical coherent states of harmonic oscillator; eigenmodes of vibration of two coupled harmonic oscillators; vibration modus of a continuous physical system (application to radiation: photons); vibration modus of indefinite linear chain of coupled harmonic oscillators (phonons); one-dimensional harmonic oscillator in thermodynamic equilibrium at temperature T [fr
A Proposed Model for Protein Crystal Nucleation and Growth
Pusey, Marc; Curreri, Peter A. (Technical Monitor)
2002-01-01
How does one take a molecule, strongly asymmetric in both shape and charge distribution, and assemble it into a crystal? We propose a model for the nucleation and crystal growth process for tetragonal lysozyme, based upon fluorescence, light, neutron, and X-ray scattering data, size exclusion chromatography experiments, dialysis kinetics, AFM, and modeling of growth rate data, from this and other laboratories. The first species formed is postulated to be a 'head to side' dimer. Through repeating associations involving the same intermolecular interactions this grows to a 4(sub 3) helix structure, that in turn serves as the basic unit for nucleation and subsequent crystal growth. High salt attenuates surface charges while promoting hydrophobic interactions. Symmetry facilitates subsequent helix-helix self-association. Assembly stability is enhanced when a four helix structure is obtained, with each bound to two neighbors. Only two unique interactions are required. The first are those for helix formation, where the dominant interaction is the intermolecular bridging anion. The second is the anti-parallel side-by-side helix-helix interaction, guided by alternating pairs of symmetry related salt bridges along each side. At this stage all eight unique positions of the P4(sub3)2(sub 1),2(sub 1) unit cell are filled. The process is one of a) attenuating the most strongly interacting groups, such that b) the molecules begin to self-associate in defined patterns, so that c) symmetry is obtained, which d) propagates as a growing crystal. Simple and conceptually obvious in hindsight, this tells much about what we are empirically doing when we crystallize macromolecules. By adjusting the growth parameters we are empirically balancing the intermolecular interactions, preferentially attenuating the dominant strong (for lysozyme the charged groups) while strengthening the lesser strong (hydrophobic) interactions. In the general case for proteins the lack of a singularly defined
Energy Technology Data Exchange (ETDEWEB)
Park, Byung Heung [Korea National University of Transportation, Chungju (Korea, Republic of); Jeong, Seong-Uk [Korea Institute of Energy Research, Daejeon (Korea, Republic of); Kang, Jeong Won [Korea University, Seoul (Korea, Republic of)
2014-12-15
SI process is a thermochemical process producing hydrogen by decomposing water while recycling sulfur and iodine. Various technologies have been developed to improve the efficiency on Section III of SI process, where iodine is separated and recycled. EED(electro-electrodialysis) could increase the efficiency of Section III without additional chemical compounds but a substantial amount of I{sub 2} from a process stream is loaded on EED. In order to reduce the load, a crystallization technology prior to EED is considered as an I{sub 2} removal process. In this work, I{sub 2} particle sinking behavior was modeled to secure basic data for designing an I{sub 2} crystallizer applied to I{sub 2}-saturated HI{sub x} solutions. The composition of HI{sub x} solution was determined by thermodynamic UVa model and correlation equations and pure properties were used to evaluate the solution properties. A multiphysics computational tool was utilized to calculate particle sinking velocity changes with respect to I{sub 2} particle radius and temperature. The terminal velocity of an I{sub 2} particle was estimated around 0.5 m/s under considered radius (1.0 to 2.5 mm) and temperature (10 to 50 .deg. C) ranges and it was analyzed that the velocity is more dependent on the solution density than the solution viscosity.
M. Pavlovsky; A. Shimansky; Z. Fialkovsky
2004-01-01
The paper considers a power system model of a plant with one capacitor bank and with one current source of higher harmonics for higher power factor. The laboratory research results of this system and practical application of the proposed model are given in the paper.
Directory of Open Access Journals (Sweden)
M. Pavlovsky
2004-01-01
Full Text Available The paper considers a power system model of a plant with one capacitor bank and with one current source of higher harmonics for higher power factor. The laboratory research results of this system and practical application of the proposed model are given in the paper.
International Nuclear Information System (INIS)
Horowitz, Marvin J.; Bertoldi, Paolo
2015-01-01
This study is an impact analysis of European Union (EU) energy efficiency policy that employs both top-down energy consumption data and bottom-up energy efficiency statistics or indicators. As such, it may be considered a contribution to the effort called for in the EU's 2006 Energy Services Directive (ESD) to develop a harmonized calculation model. Although this study does not estimate the realized savings from individual policy measures, it does provide estimates of realized energy savings for energy efficiency policy measures in aggregate. Using fixed effects panel models, the annual cumulative savings in 2011 of combined household and manufacturing sector electricity and natural gas usage attributed to EU energy efficiency policies since 2000 is estimated to be 1136 PJ; the savings attributed to energy efficiency policies since 2006 is estimated to be 807 PJ, or the equivalent of 5.6% of 2011 EU energy consumption. As well as its contribution to energy efficiency policy analysis, this study adds to the development of methods that can improve the quality of information provided by standardized energy efficiency and sustainable resource indexes. - Highlights: • Impact analysis of European Union energy efficiency policy. • Harmonization of top-down energy consumption and bottom-up energy efficiency indicators. • Fixed effects models for Member States for household and manufacturing sectors and combined electricity and natural gas usage. • EU energy efficiency policies since 2000 are estimated to have saved 1136 Petajoules. • Energy savings attributed to energy efficiency policies since 2006 are 5.6 percent of 2011 combined electricity and natural gas usage.
Helson, Henry
2010-01-01
This second edition has been enlarged and considerably rewritten. Among the new topics are infinite product spaces with applications to probability, disintegration of measures on product spaces, positive definite functions on the line, and additional information about Weyl's theorems on equidistribution. Topics that have continued from the first edition include Minkowski's theorem, measures with bounded powers, idempotent measures, spectral sets of bounded functions and a theorem of Szego, and the Wiener Tauberian theorem. Readers of the book should have studied the Lebesgue integral, the elementary theory of analytic and harmonic functions, and the basic theory of Banach spaces. The treatment is classical and as simple as possible. This is an instructional book, not a treatise. Mathematics students interested in analysis will find here what they need to know about Fourier analysis. Physicists and others can use the book as a reference for more advanced topics.
Kaminski, Adam
2017-08-22
A method and apparatus to generate harmonically related laser wavelengths includes a pair of lenses at opposing faces of a non-linear optical material. The lenses are configured to promote incoming and outgoing beams to be normal to each outer lens surface over a range of acceptance angles of the incoming laser beam. This reduces reflection loss for higher efficiency operation. Additionally, the lenses allow a wider range of wavelengths for lasers for more universal application. Examples of the lenses include plano-cylindrical and plano-spherical form factors.
Modeling texture transitions in cholesteric liquid crystal droplets
Selinger, Robin; Gimenez-Pinto, Vianney; Lu, Shin-Ying; Selinger, Jonathan; Konya, Andrew
2012-02-01
Cholesteric liquid crystals can be switched reversibly between planar and focal-conic textures, a property enabling their application in bistable displays, liquid crystal writing tablets, e-books, and color switching ``e-skins.'' To explore voltage-pulse induced switching in cholesteric droplets, we perform simulation studies of director dynamics in three dimensions. Electrostatics calculations are solved at each time step using an iterative relaxation method. We demonstrate that as expected, a low amplitude pulse drives the transition from planar to focal conic, while a high amplitude pulse drives the transition from focal conic back to the planar state. We use the model to explore the effects of droplet shape, aspect ratio, and anchoring conditions, with the goal of minimizing both response time and energy consumption.
Directory of Open Access Journals (Sweden)
Wei Li
2012-01-01
Full Text Available An extended finite element method (XFEM for the forward model of 3D optical molecular imaging is developed with simplified spherical harmonics approximation (SPN. In XFEM scheme of SPN equations, the signed distance function is employed to accurately represent the internal tissue boundary, and then it is used to construct the enriched basis function of the finite element scheme. Therefore, the finite element calculation can be carried out without the time-consuming internal boundary mesh generation. Moreover, the required overly fine mesh conforming to the complex tissue boundary which leads to excess time cost can be avoided. XFEM conveniences its application to tissues with complex internal structure and improves the computational efficiency. Phantom and digital mouse experiments were carried out to validate the efficiency of the proposed method. Compared with standard finite element method and classical Monte Carlo (MC method, the validation results show the merits and potential of the XFEM for optical imaging.
Radwan, Ahmed F.; Sobhy, Mohammed
2018-06-01
This work presents a nonlocal strain gradient theory for the dynamic deformation response of a single-layered graphene sheet (SLGS) on a viscoelastic foundation and subjected to a time harmonic thermal load for various boundary conditions. Material of graphene sheets is presumed to be orthotropic and viscoelastic. The viscoelastic foundation is modeled as Kelvin-Voigt's pattern. Based on the two-unknown plate theory, the motion equations are obtained from the dynamic version of the virtual work principle. The nonlocal strain gradient theory is established from Eringen nonlocal and strain gradient theories, therefore, it contains two material scale parameters, which are nonlocal parameter and gradient coefficient. These scale parameters have two different effects on the graphene sheets. The obtained deflection is compared with that predicted in the literature. Additional numerical examples are introduced to illustrate the influences of the two length scale coefficients and other parameters on the dynamic deformation of the viscoelastic graphene sheets.
Systematic Modelling and Crystal Size Distribution Control for Batch Crystallization Processes
DEFF Research Database (Denmark)
Abdul Samad, Noor Asma Fazli; Singh, Ravendra; Sin, Gürkan
Crystallization processes form an important class of separation methods that are frequently used in the chemical, the pharmaceutical and the food industry. The specifications of the crystal product are usually given in terms of crystal size, shape and purity. In order to predict the desired cryst...
A thermomechanical crystal plasticity constitutive model for ultrasonic consolidation
Siddiq, Amir
2012-01-01
We present a micromechanics-based thermomechanical constitutive model to simulate the ultrasonic consolidation process. Model parameters are calibrated using an inverse modeling approach. A comparison of the simulated response and experimental results for uniaxial tests validate and verify the appropriateness of the proposed model. Moreover, simulation results of polycrystalline aluminum using the identified crystal plasticity based material parameters are compared qualitatively with the electron back scattering diffraction (EBSD) results reported in the literature. The validated constitutive model is then used to simulate the ultrasonic consolidation process at sub-micron scale where an effort is exerted to quantify the underlying micromechanisms involved during the ultrasonic consolidation process. © 2011 Elsevier B.V. All rights reserved.
A critical discussion of the vacancy diffusion model of ion beam induced epitaxial crystallization
International Nuclear Information System (INIS)
Heera, V.
1989-01-01
A simple vacancy diffusion model of ion beam induced epitaxial crystallization of silicon including divacancy formation is developed. The model reproduces some of the experimental findings, as e.g. the dose rate dependence of the crystallization rate. However, the measured activation energy of the ion beam induced epitaxial crystallization cannot be accounted for by vacancy diffusion alone. (author)
Modeling Commercial Turbofan Engine Icing Risk With Ice Crystal Ingestion
Jorgenson, Philip C. E.; Veres, Joseph P.
2013-01-01
The occurrence of ice accretion within commercial high bypass aircraft turbine engines has been reported under certain atmospheric conditions. Engine anomalies have taken place at high altitudes that have been attributed to ice crystal ingestion, partially melting, and ice accretion on the compression system components. The result was degraded engine performance, and one or more of the following: loss of thrust control (roll back), compressor surge or stall, and flameout of the combustor. As ice crystals are ingested into the fan and low pressure compression system, the increase in air temperature causes a portion of the ice crystals to melt. It is hypothesized that this allows the ice-water mixture to cover the metal surfaces of the compressor stationary components which leads to ice accretion through evaporative cooling. Ice accretion causes a blockage which subsequently results in the deterioration in performance of the compressor and engine. The focus of this research is to apply an engine icing computational tool to simulate the flow through a turbofan engine and assess the risk of ice accretion. The tool is comprised of an engine system thermodynamic cycle code, a compressor flow analysis code, and an ice particle melt code that has the capability of determining the rate of sublimation, melting, and evaporation through the compressor flow path, without modeling the actual ice accretion. A commercial turbofan engine which has previously experienced icing events during operation in a high altitude ice crystal environment has been tested in the Propulsion Systems Laboratory (PSL) altitude test facility at NASA Glenn Research Center. The PSL has the capability to produce a continuous ice cloud which are ingested by the engine during operation over a range of altitude conditions. The PSL test results confirmed that there was ice accretion in the engine due to ice crystal ingestion, at the same simulated altitude operating conditions as experienced previously in
Models of protein–ligand crystal structures: trust, but verify
Deller, Marc C.
2015-01-01
X-ray crystallography provides the most accurate models of protein–ligand structures. These models serve as the foundation of many computational methods including structure prediction, molecular modelling, and structure-based drug design. The success of these computational methods ultimately depends on the quality of the underlying protein–ligand models. X-ray crystallography offers the unparalleled advantage of a clear mathematical formalism relating the experimental data to the protein–ligand model. In the case of X-ray crystallography, the primary experimental evidence is the electron density of the molecules forming the crystal. The first step in the generation of an accurate and precise crystallographic model is the interpretation of the electron density of the crystal, typically carried out by construction of an atomic model. The atomic model must then be validated for fit to the experimental electron density and also for agreement with prior expectations of stereochemistry. Stringent validation of protein–ligand models has become possible as a result of the mandatory deposition of primary diffraction data, and many computational tools are now available to aid in the validation process. Validation of protein–ligand complexes has revealed some instances of overenthusiastic interpretation of ligand density. Fundamental concepts and metrics of protein–ligand quality validation are discussed and we highlight software tools to assist in this process. It is essential that end users select high quality protein–ligand models for their computational and biological studies, and we provide an overview of how this can be achieved. PMID:25665575
The effect of harmonized emissions on aerosol properties in global models – an AeroCom experiment
Directory of Open Access Journals (Sweden)
C. Textor
2007-08-01
Full Text Available The effects of unified aerosol sources on global aerosol fields simulated by different models are examined in this paper. We compare results from two AeroCom experiments, one with different (ExpA and one with unified emissions, injection heights, and particle sizes at the source (ExpB. Surprisingly, harmonization of aerosol sources has only a small impact on the simulated inter-model diversity of the global aerosol burden, and consequently global optical properties, as the results are largely controlled by model-specific transport, removal, chemistry (leading to the formation of secondary aerosols and parameterizations of aerosol microphysics (e.g., the split between deposition pathways and to a lesser extent by the spatial and temporal distributions of the (precursor emissions.
The burdens of black carbon and especially sea salt become more coherent in ExpB only, because the large ExpA diversities for these two species were caused by a few outliers. The experiment also showed that despite prescribing emission fluxes and size distributions, ambiguities in the implementation in individual models can lead to substantial differences.
These results indicate the need for a better understanding of aerosol life cycles at process level (including spatial dispersal and interaction with meteorological parameters in order to obtain more reliable results from global aerosol simulations. This is particularly important as such model results are used to assess the consequences of specific air pollution abatement strategies.
Crystal Plasticity Model of Reactor Pressure Vessel Embrittlement in GRIZZLY
Energy Technology Data Exchange (ETDEWEB)
Chakraborty, Pritam [Idaho National Laboratory (INL), Idaho Falls, ID (United States); Biner, Suleyman Bulent [Idaho National Laboratory (INL), Idaho Falls, ID (United States); Zhang, Yongfeng [Idaho National Laboratory (INL), Idaho Falls, ID (United States); Spencer, Benjamin Whiting [Idaho National Laboratory (INL), Idaho Falls, ID (United States)
2015-07-01
The integrity of reactor pressure vessels (RPVs) is of utmost importance to ensure safe operation of nuclear reactors under extended lifetime. Microstructure-scale models at various length and time scales, coupled concurrently or through homogenization methods, can play a crucial role in understanding and quantifying irradiation-induced defect production, growth and their influence on mechanical behavior of RPV steels. A multi-scale approach, involving atomistic, meso- and engineering-scale models, is currently being pursued within the GRIZZLY project to understand and quantify irradiation-induced embrittlement of RPV steels. Within this framework, a dislocation-density based crystal plasticity model has been developed in GRIZZLY that captures the effect of irradiation-induced defects on the flow stress behavior and is presented in this report. The present formulation accounts for the interaction between self-interstitial loops and matrix dislocations. The model predictions have been validated with experiments and dislocation dynamics simulation.
Crystal Plasticity Model of Reactor Pressure Vessel Embrittlement in GRIZZLY
International Nuclear Information System (INIS)
Chakraborty, Pritam; Biner, Suleyman Bulent; Zhang, Yongfeng; Spencer, Benjamin Whiting
2015-01-01
The integrity of reactor pressure vessels (RPVs) is of utmost importance to ensure safe operation of nuclear reactors under extended lifetime. Microstructure-scale models at various length and time scales, coupled concurrently or through homogenization methods, can play a crucial role in understanding and quantifying irradiation-induced defect production, growth and their influence on mechanical behavior of RPV steels. A multi-scale approach, involving atomistic, meso- and engineering-scale models, is currently being pursued within the GRIZZLY project to understand and quantify irradiation-induced embrittlement of RPV steels. Within this framework, a dislocation-density based crystal plasticity model has been developed in GRIZZLY that captures the effect of irradiation-induced defects on the flow stress behavior and is presented in this report. The present formulation accounts for the interaction between self-interstitial loops and matrix dislocations. The model predictions have been validated with experiments and dislocation dynamics simulation.
Lattice dynamics of ionic crystals
International Nuclear Information System (INIS)
Mahan, G.D.
1990-01-01
The theory of lattice dynamics for ionic and rare-gas crystals is derived in the harmonic approximation. We start from a Hamiltonian and average over electron coordinates in order to obtain an effective interaction between ion displacements. We assume that electronic excitations are localized on a single ion, which limits the theory to ionic crystals. The deformation-dipole model and the indirect-ionic-interaction model are derived. These two contributions are closely linked, and together provide an accurate description of short-range forces
Computational Modeling of Photonic Crystal Microcavity Single-Photon Emitters
Saulnier, Nicole A.
Conventional cryptography is based on algorithms that are mathematically complex and difficult to solve, such as factoring large numbers. The advent of a quantum computer would render these schemes useless. As scientists work to develop a quantum computer, cryptographers are developing new schemes for unconditionally secure cryptography. Quantum key distribution has emerged as one of the potential replacements of classical cryptography. It relics on the fact that measurement of a quantum bit changes the state of the bit and undetected eavesdropping is impossible. Single polarized photons can be used as the quantum bits, such that a quantum system would in some ways mirror the classical communication scheme. The quantum key distribution system would include components that create, transmit and detect single polarized photons. The focus of this work is on the development of an efficient single-photon source. This source is comprised of a single quantum dot inside of a photonic crystal microcavity. To better understand the physics behind the device, a computational model is developed. The model uses Finite-Difference Time-Domain methods to analyze the electromagnetic field distribution in photonic crystal microcavities. It uses an 8-band k · p perturbation theory to compute the energy band structure of the epitaxially grown quantum dots. We discuss a method that combines the results of these two calculations for determining the spontaneous emission lifetime of a quantum dot in bulk material or in a microcavity. The computational models developed in this thesis are used to identify and characterize microcavities for potential use in a single-photon source. The computational tools developed are also used to investigate novel photonic crystal microcavities that incorporate 1D distributed Bragg reflectors for vertical confinement. It is found that the spontaneous emission enhancement in the quasi-3D cavities can be significantly greater than in traditional suspended slab
Harmonic Domain Modeling of a Distribution System Using the DIgSILENT PowerFactory Software
Wasilewski, J.; Wiechowski, Wojciech Tomasz; Bak, Claus Leth
2005-01-01
The first part of this paper presents the comparison between two models of distribution system created in computer simulation software PowerFactory (PF). Model A is an exciting simplified equivalent model of the distribution system used by Transmission System Operator (TSO) Eltra for balenced load-flow calculation and stability studies. Model B is accurate model of the distribution system created on the basis of the detailed data of the investigated network and is used as a reference. The har...
Molecular Dynamics Modeling of PPTA Crystals in Aramid Fibers
Energy Technology Data Exchange (ETDEWEB)
Mercer, Brian Scott [Univ. of California, Berkeley, CA (United States)
2016-05-19
In this work, molecular dynamics modeling is used to study the mechanical properties of PPTA crystallites, which are the fundamental microstructural building blocks of polymer aramid bers such as Kevlar. Particular focus is given to constant strain rate axial loading simulations of PPTA crystallites, which is motivated by the rate-dependent mechanical properties observed in some experiments with aramid bers. In order to accommodate the covalent bond rupture that occurs in loading a crystallite to failure, the reactive bond order force eld ReaxFF is employed to conduct the simulations. Two major topics are addressed: The rst is the general behavior of PPTA crystallites under strain rate loading. Constant strain rate loading simulations of crystalline PPTA reveal that the crystal failure strain increases with increasing strain rate, while the modulus is not a ected by the strain rate. Increasing temperature lowers both the modulus and the failure strain. The simulations also identify the C N bond connecting the aromatic rings as weakest primary bond along the backbone of the PPTA chain. The e ect of chain-end defects on PPTA micromechanics is explored, and it is found that the presence of a chain-end defect transfers load to the adjacent chains in the hydrogen-bonded sheet in which the defect resides, but does not in uence the behavior of any other chains in the crystal. Chain-end defects are found to lower the strength of the crystal when clustered together, inducing bond failure via stress concentrations arising from the load transfer to bonds in adjacent chains near the defect site. The second topic addressed is the nature of primary and secondary bond failure in crystalline PPTA. Failure of both types of bonds is found to be stochastic in nature and driven by thermal uctuations of the bonds within the crystal. A model is proposed which uses reliability theory to model bonds under constant strain rate loading as components with time-dependent failure rate
Phase field modeling of twinning in indentation of transparent crystals
International Nuclear Information System (INIS)
Clayton, J D; Knap, J
2011-01-01
Continuum phase field theory is applied to study elastic twinning in calcite and sapphire single crystals subjected to indentation loading by wedge-shaped indenters. An order parameter is associated with the magnitude of stress-free twinning shear. Geometrically linear and nonlinear theories are implemented and compared, the latter incorporating neo-Hookean elasticity. Equilibrium configurations of deformed and twinned crystals are attained numerically via direct energy minimization. Results are in qualitative agreement with experimental observations: a long thin twin forms asymmetrically under one side of the indenter, the tip of the twin is sharp and the length of the twin increases with increasing load. Qualitatively similar results are obtained using isotropic and anisotropic elastic constants, though the difference between isotropic and anisotropic results is greater in sapphire than in calcite. Similar results are also obtained for nanometer-scale specimens and millimeter-scale specimens. Indentation forces are greater in the nonlinear model than the linear model because of the increasing tangent bulk modulus with increasing pressure in the former. Normalized relationships between twin length and indentation force are similar for linear and nonlinear theories at both nanometer and millimeter scales. Twin morphologies are similar for linear and nonlinear theories for indentation with a 90° wedge. However, in the nonlinear model, indentation with a 120° wedge produces a lamellar twin structure between the indenter and the long sharp primary twin. This complex microstructure is not predicted by the linear theory
Intrinsic frame transport for a model of nematic liquid crystal
Cozzini, S.; Rull, L. F.; Ciccotti, G.; Paolini, G. V.
1997-02-01
We present a computer simulation study of the dynamical properties of a nematic liquid crystal model. The diffusional motion of the nematic director is taken into account in our calculations in order to give a proper estimate of the transport coefficients. Differently from other groups we do not attempt to stabilize the director through rigid constraints or applied external fields. We instead define an intrinsic frame which moves along with the director at each step of the simulation. The transport coefficients computed in the intrinsic frame are then compared against the ones calculated in the fixed laboratory frame, to show the inadequacy of the latter for systems with less than 500 molecules. Using this general scheme on the Gay-Berne liquid crystal model, we evidence the natural motion of the director and attempt to quantify its intrinsic time scale and size dependence. Through extended simulations of systems of different size we calculate the diffusion and viscosity coefficients of this model and compare our results with values previously obtained with fixed director.
Crystal plasticity modeling of irradiation growth in Zircaloy-2
Patra, Anirban; Tomé, Carlos N.; Golubov, Stanislav I.
2017-08-01
A physically based reaction-diffusion model is implemented in the visco-plastic self-consistent (VPSC) crystal plasticity framework to simulate irradiation growth in hcp Zr and its alloys. The reaction-diffusion model accounts for the defects produced by the cascade of displaced atoms, their diffusion to lattice sinks and the contribution to crystallographic strain at the level of single crystals. The VPSC framework accounts for intergranular interactions and irradiation creep, and calculates the strain in the polycrystalline ensemble. A novel scheme is proposed to model the simultaneous evolution of both, number density and radius, of irradiation-induced dislocation loops directly from experimental data of dislocation density evolution during irradiation. This framework is used to predict the irradiation growth behaviour of cold-worked Zircaloy-2 and trends compared to available experimental data. The role of internal stresses in inducing irradiation creep is discussed. Effects of grain size, texture and external stress on the coupled irradiation growth and creep behaviour are also studied and compared with available experimental data.
A discrete dislocation–transformation model for austenitic single crystals
International Nuclear Information System (INIS)
Shi, J; Turteltaub, S; Remmers, J J C; Van der Giessen, E
2008-01-01
A discrete model for analyzing the interaction between plastic flow and martensitic phase transformations is developed. The model is intended for simulating the microstructure evolution in a single crystal of austenite that transforms non-homogeneously into martensite. The plastic flow in the untransformed austenite is simulated using a plane-strain discrete dislocation model. The phase transformation is modeled via the nucleation and growth of discrete martensitic regions embedded in the austenitic single crystal. At each instant during loading, the coupled elasto-plasto-transformation problem is solved using the superposition of analytical solutions for the discrete dislocations and discrete transformation regions embedded in an infinite homogeneous medium and the numerical solution of a complementary problem used to enforce the actual boundary conditions and the heterogeneities in the medium. In order to describe the nucleation and growth of martensitic regions, a nucleation criterion and a kinetic law suitable for discrete regions are specified. The constitutive rules used in discrete dislocation simulations are supplemented with additional evolution rules to account for the phase transformation. To illustrate the basic features of the model, simulations of specimens under plane-strain uniaxial extension and contraction are analyzed. The simulations indicate that plastic flow reduces the average stress at which transformation begins, but it also reduces the transformation rate when compared with benchmark simulations without plasticity. Furthermore, due to local stress fluctuations caused by dislocations, martensitic systems can be activated even though transformation would not appear to be favorable based on the average stress. Conversely, the simulations indicate that the plastic hardening behavior is influenced by the reduction in the effective austenitic grain size due to the evolution of transformation. During cyclic simulations, the coupled plasticity
Energy Technology Data Exchange (ETDEWEB)
Mitzschke, Kerstin
2007-11-01
Nonlinear optical spectroscopy is a powerful method to study surface or bulk properties of condensed matter. In centrosymmetric materials like silicon even order nonlinear optical processes are forbidden. Besides self-focussing or self phase modulation third-harmonic-generation (THG) is the simplest process that can be studied. This work demonstrates that THG is a adapted non-contact and non-invasive optical method to get information about bulk structures of silicon and Photonic crystals (PC), consisting of silicon. Until now most studies are done in the visible spectral range being limited by the linear absorption losses. So the extension of THG to the IR spectral range is extremely useful. This will allow the investigation of Photonic Crystals, where frequencies near a photonic bandgap are of special interest. 2D- photonic structures under investigation were fabricated via photoelectrochemical etching of the Si (100) wafer (thickness 500 {mu}m) receiving square and hexagonal arranged pores. The typical periodicity of the structures used is 2 {mu}m and the length of the pores reached to 400 {mu}m. Because of stability the photonic structures were superimposed on silicon substrate. The experimental set-up used for the THG experiments generates tuneable picosecond IR pulses (tuning range 1500-4000 cm{sup -1}). The IR-pulse hit the sample either perpendicular to the sample surface or under an angle {theta}. The sample can be rotated (f) around the surface normal. The generated third harmonic is analysed by a polarizer, spectrally filtered by a polychromator and registered by a CCD camera. The setup can be used either in transmission or in reflection mode. Optical transmission and reflection spectra of the Si bulk correspond well with the theoretical description, a 4-fold and a 8-fold dependencies of the azimuth angle resulting in the structure of the x{sup (3)}-tensor of (100)-Si. The situation changes dramatically if the PC with hexagonal structure is investigated
Four-quadrant propeller modeling: A low-order harmonic approximation
Digital Repository Service at National Institute of Oceanography (India)
Haeusler, A.J; Saccon, A.; Hauser, J; Pascoal, A.M.; Aguiar, A.P.
. We explore the connection between the propeller thrust, torque, and efficiency curves and the lift and drag curves of the propeller blades. The model originates from a well-known four-quadrant model, based on a sinusoidal approximation...
Harmonic Domain Modeling of a Distribution System Using the DIgSILENT PowerFactory Software
DEFF Research Database (Denmark)
Wasilewski, J.; Wiechowski, Wojciech Tomasz; Bak, Claus Leth
The first part of this paper presents the comparison between two models of distribution system created in computer simulation software PowerFactory (PF). Model A is an exciting simplified equivalent model of the distribution system used by Transmission System Operator (TSO) Eltra for balenced load...
Kim, Hyun Keol; Montejo, Ludguier D; Jia, Jingfei; Hielscher, Andreas H
2017-06-01
We introduce here the finite volume formulation of the frequency-domain simplified spherical harmonics model with n -th order absorption coefficients (FD-SP N ) that approximates the frequency-domain equation of radiative transfer (FD-ERT). We then present the FD-SP N based reconstruction algorithm that recovers absorption and scattering coefficients in biological tissue. The FD-SP N model with 3 rd order absorption coefficient (i.e., FD-SP 3 ) is used as a forward model to solve the inverse problem. The FD-SP 3 is discretized with a node-centered finite volume scheme and solved with a restarted generalized minimum residual (GMRES) algorithm. The absorption and scattering coefficients are retrieved using a limited-memory Broyden-Fletcher-Goldfarb-Shanno (L-BFGS) algorithm. Finally, the forward and inverse algorithms are evaluated using numerical phantoms with optical properties and size that mimic small-volume tissue such as finger joints and small animals. The forward results show that the FD-SP 3 model approximates the FD-ERT (S 12 ) solution within relatively high accuracy; the average error in the phase (<3.7%) and the amplitude (<7.1%) of the partial current at the boundary are reported. From the inverse results we find that the absorption and scattering coefficient maps are more accurately reconstructed with the SP 3 model than those with the SP 1 model. Therefore, this work shows that the FD-SP 3 is an efficient model for optical tomographic imaging of small-volume media with non-diffuse properties both in terms of computational time and accuracy as it requires significantly lower CPU time than the FD-ERT (S 12 ) and also it is more accurate than the FD-SP 1 .
Bokarev, Valery P.; Krasnikov, Gennady Ya
2018-02-01
Based on the evaluation of the properties of crystals, such as surface energy and its anisotropy, the surface melting temperature, the anisotropy of the work function of the electron, and the anisotropy of adsorption, were shown the advantages of the model of coordination melting (MCM) in calculating the surface properties of crystals. The model of coordination melting makes it possible to calculate with an acceptable accuracy the specific surface energy of the crystals, the anisotropy of the surface energy, the habit of the natural crystals, the temperature of surface melting of the crystal, the anisotropy of the electron work function and the anisotropy of the adhesive properties of single-crystal surfaces. The advantage of our model is the simplicity of evaluating the surface properties of the crystal based on the data given in the reference literature. In this case, there is no need for a complex mathematical tool, which is used in calculations using quantum chemistry or modeling by molecular dynamics.
Mathematical modeling of static layer crystallization for propellant grade hydrogen peroxide
Hao, Lin; Chen, Xinghua; Sun, Yaozhou; Liu, Yangyang; Li, Shuai; Zhang, Mengqian
2017-07-01
Hydrogen peroxide (H2O2) is an important raw material widely used in many fields. In this work a mathematical model of heat conduction with a moving boundary was proposed to study the melt crystallization process of hydrogen peroxide which was carried out outside a cylindrical crystallizer. Considering the effects of the temperature of the cooling fluid on the thermal conductivity of crude crystal, the model is an improvement of Guardani's research and can be solved by analytic iteration method. An experiment was designed to measure the thickness of crystal layer with time under different conditions. A series of analysis, including the effects of different refrigerant temperature on crystal growth rate, the effects of different cooling rates on crystal layer growth rate, the effects of crystallization temperature on heat transfer and the model's application scope were conducted based on the comparison between experimental results and simulation results of the model.
Directory of Open Access Journals (Sweden)
Piotr FOLĘGA
2014-03-01
Full Text Available The variety of types and sizes currently in production harmonic drive is a problem in their rational choice. Properly selected harmonic drive must meet certain requirements during operation, and achieve the anticipated service life. The paper discusses the problems associated with the selection of the harmonic drive. It also presents the algorithm correct choice of harmonic drive. The main objective of this study was to develop a computer program that allows the correct choice of harmonic drive by developed algorithm.
An Application of the Harmonic Oscillator Model to Verify Dunning’s Theory of the Economic Growth
Directory of Open Access Journals (Sweden)
Marcin Salamaga
2013-09-01
Full Text Available Analogies with mechanisms ruling the natural world have oft en been sought in the course of economic phenomena.Th is paper is also an attempt to combine the physical phenomenon of a harmonious oscillator withthe theory of economic growth by J. H. Dunning (1981. In his theory, Dunning distinguished stages of economicgrowth of countries that imply the dependency between the investment position of countries and theirGDP per capita, while the graph presenting this dependency reminds a trajectory of oscillating motion of adamped harmonic oscillator. Th is analogy has given inspiration to reinterpret the theory of economy on thegrounds of the mechanism of a physical model. In this paper, the harmonious oscillator motion equation wasadapted to the description of dependencies shown in the theory of economic growth by J. H. Dunning. Th emathematical solution of this equation is properly parameterised and parameters are estimated with the useof the Gauss-Newton algorithm. Th e main objective of this paper is to allocate a specifi c stage in the economicgrowth to each country on the basis of the values of parameter estimations of the proposed cyclical models ofchanges in the net investment indicator.
Multifractal modeling of the production of concentrated sugar syrup crystal
International Nuclear Information System (INIS)
Bi Sheng; Gao Jianbo
2016-01-01
High quality, concentrated sugar syrup crystal is produced in a critical step in cane sugar production: the clarification process. It is characterized by two variables: the color of the produced sugar and its clarity degree. We show that the temporal variations of these variables follow power-law distributions and can be well modeled by multiplicative cascade multifractal processes. These interesting properties suggest that the degradation in color and clarity degree has a system-wide cause. In particular, the cascade multifractal model suggests that the degradation in color and clarity degree can be equivalently accounted for by the initial “impurities” in the sugarcane. Hence, more effective cleaning of the sugarcane before the clarification stage may lead to substantial improvement in the effect of clarification. (paper)
Energy Technology Data Exchange (ETDEWEB)
Koval' chuk, L V; Grezev, A N; Niz' ev, V G; Yakunin, V P [Institute on Laser and Information Technologies, Russian Academy of Sciences, Shatura, Moscow Region (Russian Federation); Mezhevov, V S [Kaluga Laser Innovation and Technology Centre, Obninsk, Kaluga region (Russian Federation); Goryachkin, D A [Russian State Scientific Center for Robotics and Technical Cybernetics, St. Petersburg (Russian Federation); Sergeev, V V; Kalintsev, A G [Open Joint Stock Company S.I.Vavilov State Optical Institute, St. Petersburg (Russian Federation)
2015-10-31
Experimental results are presented on the development of a radiation source emitting at a wavelength of 4.775 μm with a pulse energy up to 50 mJ and an average power up to several watts in short pulse trains. A TEA CO{sub 2} laser and a nonlinear converter based on a ZnGeP{sub 2} crystal, which are specially designed for these experiments, are described. The main limitations of nonlinear conversion and possible ways to overcome these limitations are considered. (lasers)
Modeling of Photonic Band Gap Crystals and Applications
Energy Technology Data Exchange (ETDEWEB)
El-Kady, Ihab Fathy [Iowa State Univ., Ames, IA (United States)
2002-01-01
In this work, the authors have undertaken a theoretical approach to the complex problem of modeling the flow of electromagnetic waves in photonic crystals. The focus is to address the feasibility of using the exciting phenomena of photonic gaps (PBG) in actual applications. The authors start by providing analytical derivations of the computational electromagnetic methods used in their work. They also present a detailed explanation of the physics underlying each approach, as well as a comparative study of the strengths and weaknesses of each method. The Plane Wave expansion, Transfer Matrix, and Finite Difference time Domain Methods are addressed. They also introduce a new theoretical approach, the Modal Expansion Method. They then shift the attention to actual applications. They begin with a discussion of 2D photonic crystal wave guides. The structure addressed consists of a 2D hexagonal structure of air cylinders in a layered dielectric background. Comparison with the performance of a conventional guide is made, as well as suggestions for enhancing it. The studies provide an upper theoretical limit on the performance of such guides, as they assumed no crystal imperfections and non-absorbing media. Next, they study 3D metallic PBG materials at near infrared and optical wavelengths. The main objective is to study the importance of absorption in the metal and the suitability of observing photonic band gaps in such structures. They study simple cubic structures where the metallic scatters are either cubes or interconnected metallic rods. Several metals are studied (aluminum, gold, copper, and silver). The effect of topology is addressed and isolated metallic cubes are found to be less lossy than the connected rod structures. The results reveal that the best performance is obtained by choosing metals with a large negative real part of the dielectric function, together with a relatively small imaginary part. Finally, they point out a new direction in photonic crystal
International Nuclear Information System (INIS)
Hall, I.H.; Somashekar, R.
1991-01-01
The intensity profile of the X-ray reflection from a crystalline material is related to the lattice disorder and the distribution of crystal sizes through its Fourier cosine coefficients. However, existing methods of obtaining these structural parameters from the coefficients require more than one order of reflection and this is seldom available with polymer fibres. They also rely heavily on the low-order harmonics which are those determined with least accuracy. The development and testing of a method which overcomes this weakness and which is suitable for use with a single order is described. The coefficients are calculated for a model with paracrystalline disorder and an assumed distribution of crystal sizes and the parameters describing this model are refined to minimize the discrepancy between the calculated and experimental values of the coefficients. Provided the distribution of lengths is asymmetric this discrepancy is no greater than would be expected from experimental error and so the assumed model cannot be rejected on the evidence available. Since a range of model parameters all gave equally good agreement with experiment, it was not possible with a single order to obtain a well defined set of values. Diffraction patterns displaying two orders had been chosen and results from the second order were consistent with the first, only a narrow range satisfying both simultaneously. The method was further developed by calculating the intensity profile from the harmonics and using this in the refinement. There was no advantage over using harmonics; indeed, on occasions the refinement algorithm was unstable producing unreliable results. (orig.)
Modelling a multi-crystal detector block for PET
International Nuclear Information System (INIS)
Carroll, L.R.; Nutt, R.; Casey, M.
1985-01-01
A simple mathematical model describes the performance of a modular detector ''block'' which is a key component in an advanced, high-resolution PET Scanner. Each block contains 32 small bismuth germanate (BGO) crystals coupled to four photomultiplier tubes (PMTs) through a coded light pipe. AT each PMT cathode the charge released for 511 keV coincidence events may be characterized as Poisson random variables in which the variance grows as the mean of the observed current. Given the light from BGO, one must; arrange the best coding - the distribution of light to the four PMTs, specify an optimum decoding scheme for choosing the correct crystal location from a noisy ensemble of PMT currents, and estimate the average probability of error. The statistical fluctuation or ''noise'' becomes decoupled from the ''signal'' and can be regarded as independent, additive components with zero mean and unit variance. Moreover, the envelope of the transformed noise distribution approximates very closely a normal (Gaussian) distribution with variance = 1. Specifying the coding and decoding strategy becomes a problem of signalling through a channel corrupted by additive, white, Gaussian noise; a classic problem long since solved within the context of Communication Engineering using geometry: i.e. distance, volume, angle, inner product, etc., in a linear space of higher dimension
Modeling Conformal Growth in Photonic Crystals and Comparing to Experiment
Brzezinski, Andrew; Chen, Ying-Chieh; Wiltzius, Pierre; Braun, Paul
2008-03-01
Conformal growth, e.g. atomic layer deposition (ALD), of materials such as silicon and TiO2 on three dimensional (3D) templates is important for making photonic crystals. However, reliable calculations of optical properties as a function of the conformal growth, such as the optical band structure, are hampered by difficultly in accurately assessing a deposited material's spatial distribution. A widely used approximation ignores ``pinch off'' of precursor gas and assumes complete template infilling. Another approximation results in non-uniform growth velocity by employing iso-intensity surfaces of the 3D interference pattern used to create the template. We have developed an accurate model of conformal growth in arbitrary 3D periodic structures, allowing for arbitrary surface orientation. Results are compared with the above approximations and with experimentally fabricated photonic crystals. We use an SU8 polymer template created by 4-beam interference lithography, onto which various amounts of TiO2 are grown by ALD. Characterization is performed by analysis of cross-sectional scanning electron micrographs and by solid angle resolved optical spectroscopy.
A discrete dislocation dynamics model of creeping single crystals
Rajaguru, M.; Keralavarma, S. M.
2018-04-01
Failure by creep is a design limiting issue for metallic materials used in several high temperature applications. Current theoretical models of creep are phenomenological with little connection to the underlying microscopic mechanisms. In this paper, a bottom-up simulation framework based on the discrete dislocation dynamics method is presented for dislocation creep aided by the diffusion of vacancies, known to be the rate controlling mechanism at high temperature and stress levels. The time evolution of the creep strain and the dislocation microstructure in a periodic unit cell of a nominally infinite single crystal is simulated using the kinetic Monte Carlo method, together with approximate constitutive laws formulated for the rates of thermal activation of dislocations over local pinning obstacles. The deformation of the crystal due to dislocation glide between individual thermal activation events is simulated using a standard dislocation dynamics algorithm, extended to account for constant stress periodic boundary conditions. Steady state creep conditions are obtained in the simulations with the predicted creep rates as a function of stress and temperature in good agreement with experimentally reported values. Arrhenius scaling of the creep rates as a function of temperature and power-law scaling with the applied stress are also reproduced, with the values of the power-law exponents in the high stress regime in good agreement with experiments.
Signell, Richard; Camossi, E.
2016-01-01
Work over the last decade has resulted in standardised web services and tools that can significantly improve the efficiency and effectiveness of working with meteorological and ocean model data. While many operational modelling centres have enabled query and access to data via common web services, most small research groups have not. The penetration of this approach into the research community, where IT resources are limited, can be dramatically improved by (1) making it simple for providers to enable web service access to existing output files; (2) using free technologies that are easy to deploy and configure; and (3) providing standardised, service-based tools that work in existing research environments. We present a simple, local brokering approach that lets modellers continue to use their existing files and tools, while serving virtual data sets that can be used with standardised tools. The goal of this paper is to convince modellers that a standardised framework is not only useful but can be implemented with modest effort using free software components. We use NetCDF Markup language for data aggregation and standardisation, the THREDDS Data Server for data delivery, pycsw for data search, NCTOOLBOX (MATLAB®) and Iris (Python) for data access, and Open Geospatial Consortium Web Map Service for data preview. We illustrate the effectiveness of this approach with two use cases involving small research modelling groups at NATO and USGS.
Samad, Noor Asma Fazli Abdul; Sin, Gürkan; Gernaey, Krist V; Gani, Rafiqul
2013-11-01
This paper presents the application of uncertainty and sensitivity analysis as part of a systematic model-based process monitoring and control (PAT) system design framework for crystallization processes. For the uncertainty analysis, the Monte Carlo procedure is used to propagate input uncertainty, while for sensitivity analysis, global methods including the standardized regression coefficients (SRC) and Morris screening are used to identify the most significant parameters. The potassium dihydrogen phosphate (KDP) crystallization process is used as a case study, both in open-loop and closed-loop operation. In the uncertainty analysis, the impact on the predicted output of uncertain parameters related to the nucleation and the crystal growth model has been investigated for both a one- and two-dimensional crystal size distribution (CSD). The open-loop results show that the input uncertainties lead to significant uncertainties on the CSD, with appearance of a secondary peak due to secondary nucleation for both cases. The sensitivity analysis indicated that the most important parameters affecting the CSDs are nucleation order and growth order constants. In the proposed PAT system design (closed-loop), the target CSD variability was successfully reduced compared to the open-loop case, also when considering uncertainty in nucleation and crystal growth model parameters. The latter forms a strong indication of the robustness of the proposed PAT system design in achieving the target CSD and encourages its transfer to full-scale implementation. Copyright © 2013 Elsevier B.V. All rights reserved.
Dynamical properties of a non-autonomous bouncing ball model forced by non-harmonic excitation
Czech Academy of Sciences Publication Activity Database
Lampart, M.; Zapoměl, Jaroslav
2016-01-01
Roč. 39, č. 16 (2016), s. 4923-4929 ISSN 0170-4214 R&D Projects: GA ČR GA15-06621S Institutional support: RVO:61388998 Keywords : bifurcation * chaos tests * mechanical model Subject RIV: BI - Acoustics Impact factor: 1.017, year: 2016
Barry T. Wilson; Joseph F. Knight; Ronald E. McRoberts
2018-01-01
Imagery from the Landsat Program has been used frequently as a source of auxiliary data for modeling land cover, as well as a variety of attributes associated with tree cover. With ready access to all scenes in the archive since 2008 due to the USGS Landsat Data Policy, new approaches to deriving such auxiliary data from dense Landsat time series are required. Several...
Parameter identification in a generalized time-harmonic Rayleigh damping model for elastography.
Directory of Open Access Journals (Sweden)
Elijah E W Van Houten
Full Text Available The identifiability of the two damping components of a Generalized Rayleigh Damping model is investigated through analysis of the continuum equilibrium equations as well as a simple spring-mass system. Generalized Rayleigh Damping provides a more diversified attenuation model than pure Viscoelasticity, with two parameters to describe attenuation effects and account for the complex damping behavior found in biological tissue. For heterogeneous Rayleigh Damped materials, there is no equivalent Viscoelastic system to describe the observed motions. For homogeneous systems, the inverse problem to determine the two Rayleigh Damping components is seen to be uniquely posed, in the sense that the inverse matrix for parameter identification is full rank, with certain conditions: when either multi-frequency data is available or when both shear and dilatational wave propagation is taken into account. For the multi-frequency case, the frequency dependency of the elastic parameters adds a level of complexity to the reconstruction problem that must be addressed for reasonable solutions. For the dilatational wave case, the accuracy of compressional wave measurement in fluid saturated soft tissues becomes an issue for qualitative parameter identification. These issues can be addressed with reasonable assumptions on the negligible damping levels of dilatational waves in soft tissue. In general, the parameters of a Generalized Rayleigh Damping model are identifiable for the elastography inverse problem, although with more complex conditions than the simpler Viscoelastic damping model. The value of this approach is the additional structural information provided by the Generalized Rayleigh Damping model, which can be linked to tissue composition as well as rheological interpretations.
Classical nucleation theory in the phase-field crystal model.
Jreidini, Paul; Kocher, Gabriel; Provatas, Nikolas
2018-04-01
A full understanding of polycrystalline materials requires studying the process of nucleation, a thermally activated phase transition that typically occurs at atomistic scales. The numerical modeling of this process is problematic for traditional numerical techniques: commonly used phase-field methods' resolution does not extend to the atomic scales at which nucleation takes places, while atomistic methods such as molecular dynamics are incapable of scaling to the mesoscale regime where late-stage growth and structure formation takes place following earlier nucleation. Consequently, it is of interest to examine nucleation in the more recently proposed phase-field crystal (PFC) model, which attempts to bridge the atomic and mesoscale regimes in microstructure simulations. In this work, we numerically calculate homogeneous liquid-to-solid nucleation rates and incubation times in the simplest version of the PFC model, for various parameter choices. We show that the model naturally exhibits qualitative agreement with the predictions of classical nucleation theory (CNT) despite a lack of some explicit atomistic features presumed in CNT. We also examine the early appearance of lattice structure in nucleating grains, finding disagreement with some basic assumptions of CNT. We then argue that a quantitatively correct nucleation theory for the PFC model would require extending CNT to a multivariable theory.
Classical nucleation theory in the phase-field crystal model
Jreidini, Paul; Kocher, Gabriel; Provatas, Nikolas
2018-04-01
A full understanding of polycrystalline materials requires studying the process of nucleation, a thermally activated phase transition that typically occurs at atomistic scales. The numerical modeling of this process is problematic for traditional numerical techniques: commonly used phase-field methods' resolution does not extend to the atomic scales at which nucleation takes places, while atomistic methods such as molecular dynamics are incapable of scaling to the mesoscale regime where late-stage growth and structure formation takes place following earlier nucleation. Consequently, it is of interest to examine nucleation in the more recently proposed phase-field crystal (PFC) model, which attempts to bridge the atomic and mesoscale regimes in microstructure simulations. In this work, we numerically calculate homogeneous liquid-to-solid nucleation rates and incubation times in the simplest version of the PFC model, for various parameter choices. We show that the model naturally exhibits qualitative agreement with the predictions of classical nucleation theory (CNT) despite a lack of some explicit atomistic features presumed in CNT. We also examine the early appearance of lattice structure in nucleating grains, finding disagreement with some basic assumptions of CNT. We then argue that a quantitatively correct nucleation theory for the PFC model would require extending CNT to a multivariable theory.
Tediosi, A.; Bulgheroni, C.; Sali, G.; Facchi, A.; Gandolfi, C.
2009-04-01
After a few years from the delivery of the EU Water Framework Directive (WFD) the need to link agriculture and WFD has emerged as one of the highest priorities; therefore, it is important to discuss on how the EU Common Agricultural Policy (CAP) can contribute to the achievements of the WFD objectives. The recent CAP reform - known as Mid Term Review (MTR) or Fischler Reform - has increased the opportunities, offering to farmers increased support to address some environmental issues. The central novelty coming from the MTR is the introduction of a farm single payment which aims to the Decoupling of EU Agricultural Support from production. Other MTR important topics deal with the Modulation of the payments, the Cross-Compliance and the strengthening of the Rural Development policy. All these new elements will affect the farmers' behaviour, steering their productive choices for the future, which, in turn, will have consequences on the water demand for irrigation. Indeed, from the water quantity viewpoint, agriculture is a large consumer and improving water use efficiency is one of the main issues at stake, following the increasing impacts of water scarcity and droughts across Europe in a context of climate change. According to a recent survey of the European Commission the saving potential in the agricultural sector is 43% of present abstraction and 95% of it is concentrated in southern europe. Many models have been developed to forecast the farmers' behaviour as a consequence of agricultural policies, both at sector and regional level; all of them are founded on Mathematical Programming techniques and many of them use the Positive approach, which better fits the territorial dimension. A large body of literature also exists focusing on the assessment of irrigation water requirements. The examples of conjunctive modelling of the two aspects are however much more limited. The work presented has got some innovative aspects: not only does it couple an economical model
Centre-of-mass corrections for the harmonic S+V potential model
International Nuclear Information System (INIS)
Palladino, B.E.; Ferreira, P.L.
1986-01-01
Center-of-Mass corrections to the mass spectrum and static properties of low-lying S-wave baryoins are discussed in the context of a relativistic, independent quark model, based on a Dirac equation, with equally mixed scalar and vector confining potential of harmomic type. A more stisfactory fitting of the parameters involved is obtained, as compared with previous treatments which CM corrections were neglected. (Author) [pt
CRYSTAL simulation code and modeling of coherent effects in a bent crystal at the LHC
Energy Technology Data Exchange (ETDEWEB)
Sytov, A.I., E-mail: alex_sytov@mail.ru [Research Institute for Nuclear Problems, Belarusian State University, Bobruiskaya str., 11, 220030 Minsk (Belarus); INFN Sezione di Ferrara, Dipartimento di Fisica e Scienze della Terra, Università di Ferrara, Via Saragat 1, 44100 Ferrara (Italy); Tikhomirov, V.V., E-mail: vvtikh@mail.ru [Research Institute for Nuclear Problems, Belarusian State University, Bobruiskaya str., 11, 220030 Minsk (Belarus)
2015-07-15
A CRYSTAL simulation code for particle tracking in crystals is introduced. Its essence consists in both adequate and fast sampling of proton trajectories in crystals which is crucial for both correct description of experiments and quantitative prediction of new effects. The H8 single-pass experiment at the CERN SPS as well as 7 TeV proton deflection by a bent crystal at the LHC are simulated. We predict the existence of dechanneling peaks corresponding to the planar channeling oscillations as well as describe the possibility of their observation at high energies, specifically at the LHC energy. An effect of excess over the amorphous level of ionization losses in the channeling mode was also found at 7 TeV.
Magnetic islands modelled by a phase-field-crystal approach
Faghihi, Niloufar; Mkhonta, Simiso; Elder, Ken R.; Grant, Martin
2018-03-01
Using a minimal model based on the phase-field-crystal formalism, we study the coupling between the density and magnetization in ferromagnetic solids. Analytical calculations for the square phase in two dimensions are presented and the small deformation properties of the system are examined. Furthermore, numerical simulations are conducted to study the influence of an external magnetic field on various phase transitions, the anisotropic properties of the free energy functional, and the scaling behaviour of the growth of the magnetic domains in a crystalline solid. It is shown that the energy of the system can depend on the direction of the magnetic moments, with respect to the crystalline direction. Furthermore, the growth of the magnetic domains in a crystalline solid is studied and is shown that the growth of domains is in agreement with expected behaviour.
Optical solitons in nematic liquid crystals: model with saturation effects
Borgna, Juan Pablo; Panayotaros, Panayotis; Rial, Diego; de la Vega, Constanza Sánchez F.
2018-04-01
We study a 2D system that couples a Schrödinger evolution equation to a nonlinear elliptic equation and models the propagation of a laser beam in a nematic liquid crystal. The nonlinear elliptic equation describes the response of the director angle to the laser beam electric field. We obtain results on well-posedness and solitary wave solutions of this system, generalizing results for a well-studied simpler system with a linear elliptic equation for the director field. The analysis of the nonlinear elliptic problem shows the existence of an isolated global branch of solutions with director angles that remain bounded for arbitrary electric field. The results on the director equation are also used to show local and global existence, as well as decay for initial conditions with sufficiently small L 2-norm. For sufficiently large L 2-norm we show the existence of energy minimizing optical solitons with radial, positive and monotone profiles.
Saripalli, Ravi Kiran; Katturi, Naga Krishnakanth; Soma, Venugopal Rao; Bhat, H. L.; Elizabeth, Suja
2017-12-01
The linear, second order, and third order nonlinear optical properties of glucuronic acid γ-lactone single crystals were investigated. The optic axes and principal dielectric axes were identified through optical conoscopy and the principal refractive indices were obtained using the Brewster's angle method. Conic sections were observed which is perceived to be due to spontaneous non-collinear phase matching. The direction of collinear phase matching was determined and the deff evaluated in this direction was 0.71 pm/V. Open and closed aperture Z-scan measurements with femtosecond pulses revealed high third order nonlinearity in the form of self-defocusing, two-photon absorption, as well as saturable absorption.
Efficient modeling of photonic crystals with local Hermite polynomials
International Nuclear Information System (INIS)
Boucher, C. R.; Li, Zehao; Albrecht, J. D.; Ram-Mohan, L. R.
2014-01-01
Developing compact algorithms for accurate electrodynamic calculations with minimal computational cost is an active area of research given the increasing complexity in the design of electromagnetic composite structures such as photonic crystals, metamaterials, optical interconnects, and on-chip routing. We show that electric and magnetic (EM) fields can be calculated using scalar Hermite interpolation polynomials as the numerical basis functions without having to invoke edge-based vector finite elements to suppress spurious solutions or to satisfy boundary conditions. This approach offers several fundamental advantages as evidenced through band structure solutions for periodic systems and through waveguide analysis. Compared with reciprocal space (plane wave expansion) methods for periodic systems, advantages are shown in computational costs, the ability to capture spatial complexity in the dielectric distributions, the demonstration of numerical convergence with scaling, and variational eigenfunctions free of numerical artifacts that arise from mixed-order real space basis sets or the inherent aberrations from transforming reciprocal space solutions of finite expansions. The photonic band structure of a simple crystal is used as a benchmark comparison and the ability to capture the effects of spatially complex dielectric distributions is treated using a complex pattern with highly irregular features that would stress spatial transform limits. This general method is applicable to a broad class of physical systems, e.g., to semiconducting lasers which require simultaneous modeling of transitions in quantum wells or dots together with EM cavity calculations, to modeling plasmonic structures in the presence of EM field emissions, and to on-chip propagation within monolithic integrated circuits
Belda, Santiago; Heinkelmann, Robert; Ferrándiz, José M.; Karbon, Maria; Nilsson, Tobias; Schuh, Harald
2017-10-01
Very Long Baseline Interferometry (VLBI) is the only space geodetic technique capable of measuring all the Earth orientation parameters (EOP) accurately and simultaneously. Modeling the Earth's rotational motion in space within the stringent consistency goals of the Global Geodetic Observing System (GGOS) makes VLBI observations essential for constraining the rotation theories. However, the inaccuracy of early VLBI data and the outdated products could cause non-compliance with these goals. In this paper, we perform a global VLBI analysis of sessions with different processing settings to determine a new set of empirical corrections to the precession offsets and rates, and to the amplitudes of a wide set of terms included in the IAU 2006/2000A precession-nutation theory. We discuss the results in terms of consistency, systematic errors, and physics of the Earth. We find that the largest improvements w.r.t. the values from IAU 2006/2000A precession-nutation theory are associated with the longest periods (e.g., 18.6-yr nutation). A statistical analysis of the residuals shows that the provided corrections attain an error reduction at the level of 15 μas. Additionally, including a Free Core Nutation (FCN) model into a priori Celestial Pole Offsets (CPOs) provides the lowest Weighted Root Mean Square (WRMS) of residuals. We show that the CPO estimates are quite insensitive to TRF choice, but slightly sensitive to the a priori EOP and the inclusion of different VLBI sessions. Finally, the remaining residuals reveal two apparent retrograde signals with periods of nearly 2069 and 1034 days.
HARMONIZED EUROPE OR EUROPEAN HARMONY?
Directory of Open Access Journals (Sweden)
Cosmin Marinescu
2007-07-01
Full Text Available Recent evolutions in Europe raise questions on the viability of the present economic and social model that defines the European construction project. In this paper, the author will try to explain the viability of institutional European model that sticks between free market mechanisms and protectionism. The main challenge for the EU is about the possibility to bring together the institutional convergence and the welfare for all Europeans. This is the result of the view, still dominant, of European politics elite, according to which institutional harmonization is the solution of a more dynamic and prosper Europe. But, economic realities convince us that, more and more, a harmonized, standardized Europe is not necessarily identical with a Europe of harmony and social cooperation. If „development through integration” seems to be harmonization through „institutional transplant”, how could then be the European model one sufficiently wide open to market, which creates the prosperity so long waited for by new member countries?
Synthesis and ultrastructure of plate-like apatite single crystals as a model for tooth enamel
International Nuclear Information System (INIS)
Zhuang, Zhi; Yoshimura, Hideyuki; Aizawa, Mamoru
2013-01-01
Hydroxyapatite (HAp) is an inorganic constituent compound of human bones and teeth, with superior biocompatibility and bioactivity characteristics. Its crystal structure is hexagonal, characterized by a(b)- and c-planes. In vertebrate long bones, HAp crystals have a c-axis orientation, while in tooth enamel, they have an a(b)-axis orientation. Many methods can be used to synthesize c-axis oriented HAp single crystals; however, to the best of our knowledge, there have been no reports on a synthesis method for a(b)-axis oriented HAp single crystals. In this study, we successfully synthesized plate-like HAp crystals at the air–liquid interface of a starting solution via an enzyme reaction of urea with urease. Crystal phase analysis and ultrastructure observations were carried out, and the results indicated that the particles were single crystals, with almost the same a(b)-axis orientation as tooth enamel. It is hoped that by utilizing their unique surface charge and atomic arrangement, the resulting particles can be used as a high-performance biomaterial, capable of adsorbing bio-related substances and a model for tooth enamel. - Highlights: ► Synthesis of plate-like hydroxyapatite crystals at air–liquid interface ► Ultrastructural analysis of plate-like hydroxyapatite crystals ► Plate-like hydroxyapatite single crystals with a high a(b)-axis orientation ► Plate-like hydroxyapatite single crystals as a model for tooth enamel
Synthesis and ultrastructure of plate-like apatite single crystals as a model for tooth enamel
Energy Technology Data Exchange (ETDEWEB)
Zhuang, Zhi, E-mail: zhuang@meiji.ac.jp [Department of Applied Chemistry, School of Science and Technology, Meiji University, 1-1-1 Higashimita, Tama-ku, Kawasaki, Kanagawa 214-8571 (Japan); Yoshimura, Hideyuki, E-mail: hyoshi@isc.meiji.ac.jp [Department of Physics, School of Science and Technology, Meiji University, 1-1-1 Higashimita, Tama-ku, Kawasaki, Kanagawa 214-8571 (Japan); Aizawa, Mamoru, E-mail: mamorua@isc.meiji.ac.jp [Department of Applied Chemistry, School of Science and Technology, Meiji University, 1-1-1 Higashimita, Tama-ku, Kawasaki, Kanagawa 214-8571 (Japan)
2013-07-01
Hydroxyapatite (HAp) is an inorganic constituent compound of human bones and teeth, with superior biocompatibility and bioactivity characteristics. Its crystal structure is hexagonal, characterized by a(b)- and c-planes. In vertebrate long bones, HAp crystals have a c-axis orientation, while in tooth enamel, they have an a(b)-axis orientation. Many methods can be used to synthesize c-axis oriented HAp single crystals; however, to the best of our knowledge, there have been no reports on a synthesis method for a(b)-axis oriented HAp single crystals. In this study, we successfully synthesized plate-like HAp crystals at the air–liquid interface of a starting solution via an enzyme reaction of urea with urease. Crystal phase analysis and ultrastructure observations were carried out, and the results indicated that the particles were single crystals, with almost the same a(b)-axis orientation as tooth enamel. It is hoped that by utilizing their unique surface charge and atomic arrangement, the resulting particles can be used as a high-performance biomaterial, capable of adsorbing bio-related substances and a model for tooth enamel. - Highlights: ► Synthesis of plate-like hydroxyapatite crystals at air–liquid interface ► Ultrastructural analysis of plate-like hydroxyapatite crystals ► Plate-like hydroxyapatite single crystals with a high a(b)-axis orientation ► Plate-like hydroxyapatite single crystals as a model for tooth enamel.
Modelling the acoustical response of lossy lamella-crystals
DEFF Research Database (Denmark)
Christensen, Johan; Mortensen, N. Asger; Willatzen, Morten
2014-01-01
The sound propagation properties of lossy lamella-crystals are analysed theoretically utilizing a rig- orous wave expansion formalism and an effective medium approach. We investigate both sup- ported and free-standing crystal slab structures and predict high absorption for a broad range...... of frequencies. A detailed derivation of the formalism is presented, and we show how the results obtained in the subwavelength and superwavelength regimes qualitatively can be reproduced by homogenizing the lamella-crystals. We come to the conclusion that treating this structure within the metamaterial limit...... only makes sense if the crystal filling fraction is sufficiently large to satisfy an effective medium approach....
Measurement and models of bent KAP(001) crystal integrated reflectivity and resolution (invited)
Energy Technology Data Exchange (ETDEWEB)
Loisel, G. P., E-mail: gploise@sandia.gov; Wu, M.; Lake, P.; Dunham, G. S.; Bailey, J. E.; Rochau, G. A. [Sandia National Laboratories, Albuquerque, New Mexico 87185 (United States); Stolte, W. [National Security Technologies, LLC, Livermore, California 94551 (United States); Kruschwitz, C. [National Security Technologies, LLC, Los Alamos, New Mexico 87544 (United States)
2016-11-15
The Advanced Light Source beamline-9.3.1 x-rays are used to calibrate the rocking curve of bent potassium acid phthalate (KAP) crystals in the 2.3-4.5 keV photon-energy range. Crystals are bent on a cylindrically convex substrate with a radius of curvature ranging from 2 to 9 in. and also including the flat case to observe the effect of bending on the KAP spectrometric properties. As the bending radius increases, the crystal reflectivity converges to the mosaic crystal response. The X-ray Oriented Programs (XOP) multi-lamellar model of bent crystals is used to model the rocking curve of these crystals and the calibration data confirm that a single model is adequate to reproduce simultaneously all measured integrated reflectivities and rocking-curve FWHM for multiple radii of curvature in both 1st and 2nd order of diffraction.
Harmonic and static susceptibilities of YBa2Cu3O7
International Nuclear Information System (INIS)
Ishida, T.; Goldfarb, R.B.; Okayasu, S.; Kazumata, Y.; Franz, J.; Arndt, T.; Schauer, W.
1993-01-01
Intergranular properties of the sintered superconductor YBa 2 Cu 3 O 7 have been studied in terms of complex harmonic magnetic susceptibility χ n χ n ' - iχ n '' (n integer) as well as DC susceptibility χ dc . As functions of temperature T, χ 1 ' and χ 1 '' depend on both the AC magnetic-field amplitude H ac and the magnitude of a superimposed DC field H dc . Only odd-harmonic susceptibilities are observed below the critical temperature, T c , for zero H dc while both odd and even harmonics are observed for nonzero H dc . With T constant, odd-harmonic susceptibilities are even functions of H dc , whereas even-harmonic susceptibilities are odd functions of H dc . Experimental intergranular characteristics of χ n ' and χ n '' are in good agreement with theoretical predictions from a simplified Kim model of magnetization. In contrast, even-harmonic susceptibilities measured for a GdBa 2 Cu 3 O 7 thin film and an YBa 2 Cu 3 O 7 single crystal are not prominent due to missing weak links, whereas odd-harmonic susceptibilities are remarkable. A survey of several models for the harmonic response of superconductors is presented. The DC susceptibility curve for the zero-field-cooled YBa 2 Cu 3 O 7 sample, χ ZFC (T), has a two-step structure arising from intra- and inter-granular components, similar to χ 1 '. DC susceptibility measured upon warming, χ FCW (T), shows a negative peak near T c for the sample cooled rapidly in small DC fields. DC susceptibility measured upon cooling, χ FCC (T), does not show a peak. A negative peak is not seen in measurements on a powdered sample. The negative peak can be explained by intergranular flux depinning upon warming. (orig.)
Cross-twinning model of fcc crystal growth
van de Waal, B.W.
1995-01-01
The theory developed in 1960 by Wagner, Hamilton and Seidensticker (WHS-theory) to explain observed crystal growth phenomena in Ge is critically reviewed and shown to be capable of explaining preservation of ABC stacking order in two dimensions in fcc crystals of effectively spherical closed shell
Analytic model of bunched beams for harmonic generation in the low-gain free electron laser regime
Directory of Open Access Journals (Sweden)
G. Penn
2006-06-01
Full Text Available One scheme for harmonic generation employs free electron lasers (FELs with two undulators: the first uses a seed laser to modulate the energy of the electron beam; following a dispersive element which acts to bunch the beam, the second undulator radiates at a higher harmonic. These processes are currently evaluated using extensive calculations or simulation codes which can be slow to evaluate and difficult to set up. We describe a simple algorithm to predict the output of a harmonic generation beam line in the low-gain FEL regime, based on trial functions for the output radiation. Full three-dimensional effects are included. This method has been implemented as a Mathematica® package, named CAMPANILE, which runs rapidly and can be generalized to include effects such as asymmetric beams and misalignments. This method is compared with simulation results using the FEL code GENESIS, both for single stages of harmonic generation and for the LUX project, a design concept for an ultrafast x-ray facility, where multiple stages upshift the input laser frequency by factors of up to 200.
Controlling Second Harmonic Efficiency of Laser Beam Interactions
Barnes, Norman P. (Inventor); Walsh, Brian M. (Inventor); Reichle, Donald J. (Inventor)
2011-01-01
A method is provided for controlling second harmonic efficiency of laser beam interactions. A laser system generates two laser beams (e.g., a laser beam with two polarizations) for incidence on a nonlinear crystal having a preferred direction of propagation. Prior to incidence on the crystal, the beams are optically processed based on the crystal's beam separation characteristics to thereby control a position in the crystal along the preferred direction of propagation at which the beams interact.
Reliability of conventional crystal field models in f-electron systems
Energy Technology Data Exchange (ETDEWEB)
Gajek, Z. [Polska Akademia Nauk, Wroclaw (Poland). Inst. Niskich Temperatur i Badan Strukturalnych
1995-03-15
Crystal field models commonly applied to explain the electronic properties of solid f-electron compounds are discussed from the point of view of their inherent limitations and the false conclusions they may lead to. Both phenomenological and ab initio approximate models are considered. The discussion is based on generalized perturbation model calculations of the crystal field parameters for europium, uranium, plutonium and neptunium ions in various crystals. The results reveal the inadequacy of various electrostatic approaches and the correctness of models based on renormalization terms. ((orig.))
Martelli, Nicolas; Devaux, Capucine; van den Brink, Hélène; Billaux, Mathilde; Pineau, Judith; Prognon, Patrice; Borget, Isabelle
2017-01-01
The number of new medical devices for individual use that are launched annually exceeds the assessment capacity of the French national health technology assessment (HTA) agency. This has resulted in hospitals, and particularly university hospitals (UHs), developing hospital-based HTA initiatives to support their decisions for purchasing innovative devices. However, the methodologies used in such hospitals have no common basis. The aim of this study was to assess a mini-HTA model as a potential solution to harmonize HTA methodology in French UHs. A systematic review was conducted on Medline, Embase, Health Technology Assessment database, and Google Scholar to identify published articles reporting the use of mini-HTA tools and decision support-like models. A survey was also carried out in eighteen French UHs to identify in-house decision support tools. Finally, topics evaluated in the Danish mini-HTA model and in French UHs were compared using Jaccard similarity coefficients. Our findings showed differences between topics evaluated in French UHs and those assessed in decision support models from the literature. Only five topics among the thirteen most evaluated in French UHs were similar to those assessed in the Danish mini-HTA model. The organizational and ethical/social impacts were rarely explored among the surveyed models used in French UHs when introducing new medical devices. Before its widespread and harmonized use in French UHs, the mini-HTA model would first require adaptations to the French context.
Harmonics and energy management
International Nuclear Information System (INIS)
Andresen, M.
1993-01-01
To summarize what this paper has presented: Voltage and current non-sinusoidal wave shapes exist in our power system. These harmonics result from the prolific use of non-linear loads. The use of these types of loads is increasing dramatically, partly due to the push to implement energy management techniques involving harmonic generating equipment. Harmonic analysis can identify specific harmonics, their frequency, magnitude, and phase shift referenced to the fundamental. Harmonic distortion forces the use of true RMS multimeters for measurement accuracy. High levels of neutral current and N-G voltages are now possible. Transformers may overheat and fail even though they are below rated capacity. Low power factors due to harmonics cannot be corrected by the installation of capacitors, and knowledge of the fundamental VARs or the displacement power factor is needed to use capacitors alone for power factor correction. The harmonic related problems presented are by no means an exhaustive list. Many other concerns arise when harmonics are involved in the power system. The critical issue behind these problems is that many of the devices being recommended from an energy management point of view are contributing to the harmonic levels, and thus to the potential for harmonic problems. We can no longer live in the sinusoidal mentality if we are to be effective in saving energy and reducing costs
Iwamoto, Mitsumasa; Manaka, Takaaki; Taguchi, Dai
2015-09-01
The probing and modeling of carrier motions in materials as well as in electronic devices is a fundamental research subject in science and electronics. According to the Maxwell electromagnetic field theory, carriers are a source of electric field. Therefore, by probing the dielectric polarization caused by the electric field arising from moving carriers and dipoles, we can find a way to visualize the carrier motions in materials and in devices. The techniques used here are an electrical Maxwell-displacement current (MDC) measurement and a novel optical method based on the electric field induced optical second harmonic generation (EFISHG) measurement. The MDC measurement probes changes of induced charge on electrodes, while the EFISHG probes nonlinear polarization induced in organic active layers due to the coupling of electron clouds of molecules and electro-magnetic waves of an incident laser beam in the presence of a DC field caused by electrons and holes. Both measurements allow us to probe dynamical carrier motions in solids through the detection of dielectric polarization phenomena originated from dipolar motions and electron transport. In this topical review, on the basis of Maxwell’s electro-magnetism theory of 1873, which stems from Faraday’s idea, the concept for probing electron and hole transport in solids by using the EFISHG is discussed in comparison with the conventional time of flight (TOF) measurement. We then visualize carrier transit in organic devices, i.e. organic field effect transistors, organic light emitting diodes, organic solar cells, and others. We also show that visualizing an EFISHG microscopic image is a novel way for characterizing anisotropic carrier transport in organic thin films. We also discuss the concept of the detection of rotational dipolar motions in monolayers by means of the MDC measurement, which is capable of probing the change of dielectric spontaneous polarization formed by dipoles in organic monolayers. Finally we
Harmonic dynamical behaviour of thallous halides
Indian Academy of Sciences (India)
The next is the deformation dipole model (DDM) of Karo and Hardy. [19] and rigid shell ... that the most realistic model for complete harmonic dynamical behaviour of the ..... metals, Ph.D. Thesis (Banaras Hindu University, 1971) Unpublished.
Longhi, J.
1977-01-01
A description is presented of an empirical model of fractional crystallization which predicts that slightly modified versions of certain of the proposed whole moon compositions can reproduce the major-element chemistry and mineralogy of most of the primitive highland rocks through equilibrium and fractional crystallization processes combined with accumulation of crystals and trapping of residual liquids. These compositions contain sufficient Al to form a plagioclase-rich crust 60 km thick on top of a magma ocean that was initially no deeper than about 300 km. Implicit in the model are the assumptions that all cooling and crystallization take place at low pressure and that there are no compositional or thermal gradients in the liquid. Discussions of the cooling and crystallization of the proposed magma ocean show these assumptions to be disturbingly naive when applied to the ocean as a whole. However, the model need not be applied to the whole ocean, but only to layers of cooling liquid near the surface.
Sprangers, R.L.J.; Paulides, J.J.H.; Gysen, B.L.J.; Waarma, J.; Lomonova, E.A.
2014-01-01
The use of empirically determined coefficients to include the effects of leakage and fringing flux is a large drawback of traditional induction motor (IM) models, such as lumped parameter, magnetic equivalent circuit and anisotropic layer models. As an alternative, Finite Element Analysis (FEA) is
Decomposition in aluminium alloys: diffuse scattering and crystal modelling
International Nuclear Information System (INIS)
Aslam-Malik, A.
1995-01-01
In the present study the microstructure of metastable precipitates in Al-Ag and Al-Cu, so called pre-precipitates or Guinier-Preston (GP) zones, was investigated. In both systems important aspects of the microstructure are still controversially discussed. In Al-Ag two forms of GP zones are suggested; depending on the aging temperatures above or below about 443 K, ε- or η-zones should evolve. Differences between these two types of zones may be due to differences in internal order and/or composition. In Al-Cu the characterization of GP I zones is difficult because of the strong atomic displacements around the zones. The proper separation of short-range order and displacement scattering within a diffuse scattering experiment is still under discussion. The technique used to determine the short-range order in both alloys was diffuse scattering with neutrons and X-rays. To separate short-range order and displacement scattering, the methods of Georgopoulos-Cohen (X-ray scattering) and Borie-Sparks (neutron scattering) were used. Of main importance is the optimization of the scattering contrast and thus the scattering contribution due to short-range order. Short-range order scattering is rationalized in terms of pair correlations. Crystals may subsequently be modelled to visualize the microstructure. The Al-Ag system was investigated by diffuse X-ray wide-angle scattering and small-angle neutron scattering. The small-angle neutron scattering measurement was necessary since the GP zones in Al-Ag are almost spherical and the main scattering contribution is found close to the origin of reciprocal space. The small-angle scattering is not that important in the case of Al-Cu because the main scattering extends along (100) owing to the planar character of the GP I zones on (100) lattice planes. (author) 24 figs., 10 tabs., refs
Validation of mathematical model for CZ process using small-scale laboratory crystal growth furnace
Bergfelds, Kristaps; Sabanskis, Andrejs; Virbulis, Janis
2018-05-01
The present material is focused on the modelling of small-scale laboratory NaCl-RbCl crystal growth furnace. First steps towards fully transient simulations are taken in the form of stationary simulations that deal with the optimization of material properties to match the model to experimental conditions. For this purpose, simulation software primarily used for the modelling of industrial-scale silicon crystal growth process was successfully applied. Finally, transient simulations of the crystal growth are presented, giving a sufficient agreement to experimental results.
Sabanskis, A.; Virbulis, J.
2018-05-01
Mathematical modelling is employed to numerically analyse the dynamics of the Czochralski (CZ) silicon single crystal growth. The model is axisymmetric, its thermal part describes heat transfer by conduction and thermal radiation, and allows to predict the time-dependent shape of the crystal-melt interface. Besides the thermal field, the point defect dynamics is modelled using the finite element method. The considered process consists of cone growth and cylindrical phases, including a short period of a reduced crystal pull rate, and a power jump to avoid large diameter changes. The influence of the thermal stresses on the point defects is also investigated.
A Navier-Stokes phase-field crystal model for colloidal suspensions.
Praetorius, Simon; Voigt, Axel
2015-04-21
We develop a fully continuous model for colloidal suspensions with hydrodynamic interactions. The Navier-Stokes Phase-Field Crystal model combines ideas of dynamic density functional theory with particulate flow approaches and is derived in detail and related to other dynamic density functional theory approaches with hydrodynamic interactions. The derived system is numerically solved using adaptive finite elements and is used to analyze colloidal crystallization in flowing environments demonstrating a strong coupling in both directions between the crystal shape and the flow field. We further validate the model against other computational approaches for particulate flow systems for various colloidal sedimentation problems.
Harmonic Lattice Dynamics of Germanium
Energy Technology Data Exchange (ETDEWEB)
Nelin, G
1974-07-01
The phonon dispersion relations of the DELTA-, LAMBDA-, and SIGMA-directions of germanium at 80 K are analysed in terms of current harmonic lattice dynamical models. On the basis of this experience, a new model is proposed which gives a unified account of the strong points of the previous models. The principal elements of the presented theory are quasiparticle bond charges combined with a valence force field.
Harmonic Lattice Dynamics of Germanium
International Nuclear Information System (INIS)
Nelin, G.
1974-01-01
The phonon dispersion relations of the Δ-, Λ-, and Σ-directions of germanium at 80 K are analysed in terms of current harmonic lattice dynamical models. On the basis of this experience, a new model is proposed which gives a unified account of the strong points of the previous models. The principal elements of the presented theory are quasiparticle bond charges combined with a valence force field
Linking high harmonics from gases and solids.
Vampa, G; Hammond, T J; Thiré, N; Schmidt, B E; Légaré, F; McDonald, C R; Brabec, T; Corkum, P B
2015-06-25
When intense light interacts with an atomic gas, recollision between an ionizing electron and its parent ion creates high-order harmonics of the fundamental laser frequency. This sub-cycle effect generates coherent soft X-rays and attosecond pulses, and provides a means to image molecular orbitals. Recently, high harmonics have been generated from bulk crystals, but what mechanism dominates the emission remains uncertain. To resolve this issue, we adapt measurement methods from gas-phase research to solid zinc oxide driven by mid-infrared laser fields of 0.25 volts per ångström. We find that when we alter the generation process with a second-harmonic beam, the modified harmonic spectrum bears the signature of a generalized recollision between an electron and its associated hole. In addition, we find that solid-state high harmonics are perturbed by fields so weak that they are present in conventional electronic circuits, thus opening a route to integrate electronics with attosecond and high-harmonic technology. Future experiments will permit the band structure of a solid to be tomographically reconstructed.
Dimova, E.; Steflekova, V.; Karatodorov, S.; Kyoseva, E.
2018-03-01
We propose a way of achieving efficient and robust second-harmonic generation. The technique proposed is similar to the adiabatic population transfer in a two-state quantum system with crossing energies. If the phase mismatching changes slowly, e.g., due to a temperature gradient along the crystal, and makes the phase match for second-harmonic generation to occur, then the energy would be converted adiabatically to the second harmonic. As an adiabatic technique, the second-harmonic generation scheme presented is stable to variations in the crystal parameters, as well as in the input light, crystal length, input intensity, wavelength and angle of incidence.
An affine microsphere approach to modeling strain-induced crystallization in rubbery polymers
Nateghi, A.; Dal, H.; Keip, M.-A.; Miehe, C.
2018-01-01
Upon stretching a natural rubber sample, polymer chains orient themselves in the direction of the applied load and form crystalline regions. When the sample is retracted, the original amorphous state of the network is restored. Due to crystallization, properties of rubber change considerably. The reinforcing effect of the crystallites stiffens the rubber and increases the crack growth resistance. It is of great importance to understand the mechanism leading to strain-induced crystallization. However, limited theoretical work has been done on the investigation of the associated kinetics. A key characteristic observed in the stress-strain diagram of crystallizing rubber is the hysteresis, which is entirely attributed to strain-induced crystallization. In this work, we propose a micromechanically motivated material model for strain-induced crystallization in rubbers. Our point of departure is constructing a micromechanical model for a single crystallizing polymer chain. Subsequently, a thermodynamically consistent evolution law describing the kinetics of crystallization on the chain level is proposed. This chain model is then incorporated into the affine microsphere model. Finally, the model is numerically implemented and its performance is compared to experimental data.
Phononic Crystal Waveguide Transducers for Nonlinear Elastic Wave Sensing.
Ciampa, Francesco; Mankar, Akash; Marini, Andrea
2017-11-07
Second harmonic generation is one of the most sensitive and reliable nonlinear elastic signatures for micro-damage assessment. However, its detection requires powerful amplification systems generating fictitious harmonics that are difficult to discern from pure nonlinear elastic effects. Current state-of-the-art nonlinear ultrasonic methods still involve impractical solutions such as cumbersome signal calibration processes and substantial modifications of the test component in order to create material-based tunable harmonic filters. Here we propose and demonstrate a valid and sensible alternative strategy involving the development of an ultrasonic phononic crystal waveguide transducer that exhibits both single and multiple frequency stop-bands filtering out fictitious second harmonic frequencies. Remarkably, such a sensing device can be easily fabricated and integrated on the surface of the test structure without altering its mechanical and geometrical properties. The design of the phononic crystal structure is supported by a perturbative theoretical model predicting the frequency band-gaps of periodic plates with sinusoidal corrugation. We find our theoretical findings in excellent agreement with experimental testing revealing that the proposed phononic crystal waveguide transducer successfully attenuates second harmonics caused by the ultrasonic equipment, thus demonstrating its wide range of potential applications for acousto/ultrasonic material damage inspection.
International Nuclear Information System (INIS)
Pirouzmand, Ahmad; Hadad, Kamal
2011-01-01
Highlights: → This paper describes the solution of time-independent neutron transport equation. → Using a novel method based on cellular neural networks (CNNs) coupled with P N method. → Utilize the CNN model to simulate spatial scalar flux distribution in steady state. → The accuracy, stability, and capabilities of CNN model are examined in x-y geometry. - Abstract: This paper describes a novel method based on using cellular neural networks (CNN) coupled with spherical harmonics method (P N ) to solve the time-independent neutron transport equation in x-y geometry. To achieve this, an equivalent electrical circuit based on second-order form of neutron transport equation and relevant boundary conditions is obtained using CNN method. We use the CNN model to simulate spatial response of scalar flux distribution in the steady state condition for different order of spherical harmonics approximations. The accuracy, stability, and capabilities of CNN model are examined in 2D Cartesian geometry for fixed source and criticality problems.
A novel method of rapidly modeling optical properties of actual photonic crystal fibres
International Nuclear Information System (INIS)
Li-Wen, Wang; Shu-Qin, Lou; Wei-Guo, Chen; Hong-Lei, Li
2010-01-01
The flexible structure of photonic crystal fibre not only offers novel optical properties but also brings some difficulties in keeping the fibre structure in the fabrication process which inevitably cause the optical properties of the resulting fibre to deviate from the designed properties. Therefore, a method of evaluating the optical properties of the actual fibre is necessary for the purpose of application. Up to now, the methods employed to measure the properties of the actual photonic crystal fibre often require long fibre samples or complex expensive equipments. To our knowledge, there are few studies of modeling an actual photonic crystal fibre and evaluating its properties rapidly. In this paper, a novel method, based on the combination model of digital image processing and the finite element method, is proposed to rapidly model the optical properties of the actual photonic crystal fibre. Two kinds of photonic crystal fibres made by Crystal Fiber A/S are modeled. It is confirmed from numerical results that the proposed method is simple, rapid and accurate for evaluating the optical properties of the actual photonic crystal fibre without requiring complex equipment. (rapid communication)
Development of a model for on-line control of crystal growth by the AHP method
Gonik, M. A.; Lomokhova, A. V.; Gonik, M. M.; Kuliev, A. T.; Smirnov, A. D.
2007-05-01
The possibility to apply a simplified 2D model for heat transfer calculations in crystal growth by the axial heat close to phase interface (AHP) method is discussed in this paper. A comparison with global heat transfer calculations with the CGSim software was performed to confirm the accuracy of this model. The simplified model was shown to provide adequate results for the shape of the melt-crystal interface and temperature field in an opaque (Ge) and a transparent crystal (CsI:Tl). The model proposed is used for identification of the growth setup as a control object, for synthesis of a digital controller (PID controller at the present stage) and, finally, in on-line simulations of crystal growth control.
On Regularity Criteria for the Two-Dimensional Generalized Liquid Crystal Model
Directory of Open Access Journals (Sweden)
Yanan Wang
2014-01-01
Full Text Available We establish the regularity criteria for the two-dimensional generalized liquid crystal model. It turns out that the global existence results satisfy our regularity criteria naturally.
On asymptotic isotropy for a hydrodynamic model of liquid crystals
Czech Academy of Sciences Publication Activity Database
Dai, M.; Feireisl, Eduard; Rocca, E.; Schimperna, G.; Schonbek, M.E.
2016-01-01
Roč. 97, 3-4 (2016), s. 189-210 ISSN 0921-7134 Grant - others:European Research Council(XE) MATHEF(320078) Institutional support: RVO:67985840 Keywords : liquid crystal * Q-tensor description * long-time behavior Subject RIV: BA - General Mathematics Impact factor: 0.933, year: 2016 http://content.iospress.com/articles/asymptotic-analysis/asy1348
On a hyperbolic system arising in liquid crystals modeling
Czech Academy of Sciences Publication Activity Database
Feireisl, Eduard; Rocca, E.; Schimperna, G.; Zarnescu, A.
2018-01-01
Roč. 15, č. 1 (2018), s. 15-35 ISSN 0219-8916 EU Projects: European Commission(XE) 320078 - MATHEF Institutional support: RVO:67985840 Keywords : dissipative solution * liquid crystal * weak-strong uniqueness Subject RIV: BA - General Mathematics OBOR OECD: Pure mathematics Impact factor: 0.940, year: 2016 https://www.worldscientific.com/doi/abs/10.1142/S0219891618500029
Variational cellular model of the molecular and crystal electronic structure
International Nuclear Information System (INIS)
Ferreira, L.G.; Leite, J.R.
1977-12-01
A variational version of the cellular method is developed to calculate the electronic structure of molecules and crystals. Due to the simplicity of the secular equation, the method is easy to be implemented. Preliminary calculations on the hydrogen molecular ion suggest that it is also accurate and of fast convergence [pt
Multiscale modelling of single crystal superalloys for gas turbine blades
Tinga, T.
2009-01-01
Gas turbines are extensively used for power generation and for the propulsion of aircraft and vessels. Their most severely loaded parts, the turbine rotor blades, are manufactured from single crystal nickel-base superalloys. The superior high temperature behaviour of these materials is attributed to
On asymptotic isotropy for a hydrodynamic model of liquid crystals
Czech Academy of Sciences Publication Activity Database
Dai, M.; Feireisl, Eduard; Rocca, E.; Schimperna, G.; Schonbek, M.E.
2016-01-01
Roč. 97, 3-4 (2016), s. 189-210 ISSN 0921-7134 Grant - others:European Research Council(XE) MATHEF(320078) Institutional support: RVO:67985840 Keywords : liquid crystal * Q-tensor description * long-time behavior Subject RIV: BA - General Mathematics Impact factor: 0.933, year: 2016 http://content.iospress.com/articles/asymptotic- analysis /asy1348
Investigation of the cluster formation in lithium niobate crystals by computer modeling method
Energy Technology Data Exchange (ETDEWEB)
Voskresenskii, V. M.; Starodub, O. R., E-mail: ol-star@mail.ru; Sidorov, N. V.; Palatnikov, M. N. [Russian Academy of Sciences, Tananaev Institute of Chemistry and Technology of Rare Earth Elements and Mineral Raw Materials, Kola Science Centre (Russian Federation)
2017-03-15
The processes occurring upon the formation of energetically equilibrium oxygen-octahedral clusters in the ferroelectric phase of a stoichiometric lithium niobate (LiNbO{sub 3}) crystal have been investigated by the computer modeling method within the semiclassical atomistic model. An energetically favorable cluster size (at which a structure similar to that of a congruent crystal is organized) is shown to exist. A stoichiometric cluster cannot exist because of the electroneutrality loss. The most energetically favorable cluster is that with a Li/Nb ratio of about 0.945, a value close to the lithium-to-niobium ratio for a congruent crystal.
Directory of Open Access Journals (Sweden)
Yufei Liu
2015-01-01
Full Text Available This paper investigates the dynamic of a flexible robotic manipulator (FRM which consists of rigid driving base, flexible links, and flexible joints. With considering the motion fluctuations caused by the coupling effect, such as the motor parameters and mechanism inertias, as harmonic disturbances, the system investigated in this paper remains a parametrically excited system. An elastic restraint model of the FRM with elastic joints (FRMEJ is proposed, which considers the elastic properties of the connecting joints between the flexible arm and the driving base, as well as the harmonic disturbances aroused by the electromechanical coupling effect. As a consequence, the FRMEJ accordingly remains a flexible multibody system which conveys the effects of rigid-flexible couple and electromechanical couple. The Lagrangian function and Hamilton’s principle are used to establish the dynamic model of the FRMEJ. Based on the dynamic model proposed, the vibration power flow is introduced to show the vibration energy distribution. Numerical simulations are conducted to investigate the effect of the joint elasticities and the disturbance excitations, and the influences of the structure parameters and motion parameters on the vibration power flow are studied. The results obtained in this paper contribute to the structure design, motion optimization, and vibration control of FRMs.
High order harmonic generation in rare gases
Energy Technology Data Exchange (ETDEWEB)
Budil, Kimberly Susan [Univ. of California, Davis, CA (United States)
1994-05-01
The process of high order harmonic generation in atomic gases has shown great promise as a method of generating extremely short wavelength radiation, extending far into the extreme ultraviolet (XUV). The process is conceptually simple. A very intense laser pulse (I ~10^{13}-10^{14} W/cm^{2}) is focused into a dense (~10^{17} particles/cm^{3}) atomic medium, causing the atoms to become polarized. These atomic dipoles are then coherently driven by the laser field and begin to radiate at odd harmonics of the laser field. This dissertation is a study of both the physical mechanism of harmonic generation as well as its development as a source of coherent XUV radiation. Recently, a semiclassical theory has been proposed which provides a simple, intuitive description of harmonic generation. In this picture the process is treated in two steps. The atom ionizes via tunneling after which its classical motion in the laser field is studied. Electron trajectories which return to the vicinity of the nucleus may recombine and emit a harmonic photon, while those which do not return will ionize. An experiment was performed to test the validity of this model wherein the trajectory of the electron as it orbits the nucleus or ion core is perturbed by driving the process with elliptically, rather than linearly, polarized laser radiation. The semiclassical theory predicts a rapid turn-off of harmonic production as the ellipticity of the driving field is increased. This decrease in harmonic production is observed experimentally and a simple quantum mechanical theory is used to model the data. The second major focus of this work was on development of the harmonic "source". A series of experiments were performed examining the spatial profiles of the harmonics. The quality of the spatial profile is crucial if the harmonics are to be used as the source for experiments, particularly if they must be refocused.
Electromagnetic cyclotron harmonic waves
International Nuclear Information System (INIS)
Ohnuma, T.; Watanabe, T.; Hamamatsu, K.
1981-09-01
Electromagnetic electron cyclotron harmonic waves just below the electron cyclotron harmonics are investigated numerically and experimentally. Backward waves which are observed to propagate nearly perpendicular to the magnetic field just below the electron cyclotron frequency in a high density magnetoplasma are confirmed to be in accord with the theoretical electromagnetic cyclotron waves. (author)
AUTHOR|(CDS)2210072; Mirarchi, Daniele; Redaelli, Stefano
The planes in crystalline solids can constrain the directions that charged particles take as they pass through. Physicists can use this "channelling" property of crystals to steer particle beams. In a bent crystal, for example, channelled particles follow the bend and can change their direction. Experiments are being carried out to study in detail this phenomenon. The UA9 collaboration is using high energy protons and heavy ions beams from the SPS accelerator at CERN to verify the possibility of using bent crystals as primary collimators in high energy hadron colliders like the LHC. Simulations have been developed to model the coherent interaction with crystal planes. The goal of the thesis is indeed to analyze the data and develop an improved simulation routine to better describe the data’s subtleties, in particular the transition between the volume reﬂection and amorphous modes of beam interaction with the crystal.
Probabilistic Aspects of Harmonic Emission of Large Offshore Wind Farms
DEFF Research Database (Denmark)
Jensen, Christian Flytkjær; Bak, Claus Leth; Kocewiak, Lukasz Hubert
2011-01-01
In this article, a new probabilistic method of as-sessment of harmonic emission of large offshore wind farms is presented. Based on measurements from the British wind farm Burbo Banks, probability density functions are estimated for the dominating low order harmonic currents injected by a single...... turbine. The degree and type of dependence between the harmonic emission and the operating point of a single turbine is established. A model of Burbo Banks, suitable for harmonic load flow studies, is created in DIgSILENT Power Factory along with a DPL-script that deals with the probabilistic issues...... of the harmonic emission. The simulated harmonic distortion at the PCC is compared to measurement. This reveals some diffi-culties regarding harmonic load flow studies. The harmonic background distortion in the grid to where the wind farm is connected must be included in the study. Furthermore, a very detailed...
International Nuclear Information System (INIS)
Pan, L.M.; Ghosh, R.N.; McLean, M.
1993-01-01
A physics based model has been developed that accounts for the principal features of anisotropic creep deformation of single crystal superalloys. The present paper extends this model to simulate other types of high temperature deformation under strain controlled test conditions, such as stress relaxation and tension tests at constant strain rate in single crystals subject to axial loading along an arbitrary crystal direction. The approach is applied to the SRR99 single crystal superalloy where a model parameter database is available, determined via analysis of a database of constant stress creep curves. A software package has been generated to simulate the deformation behaviour under complex stress-strain conditions taking into account anisotropic elasticity. (orig.)
A numerical method for eigenvalue problems in modeling liquid crystals
Energy Technology Data Exchange (ETDEWEB)
Baglama, J.; Farrell, P.A.; Reichel, L.; Ruttan, A. [Kent State Univ., OH (United States); Calvetti, D. [Stevens Inst. of Technology, Hoboken, NJ (United States)
1996-12-31
Equilibrium configurations of liquid crystals in finite containments are minimizers of the thermodynamic free energy of the system. It is important to be able to track the equilibrium configurations as the temperature of the liquid crystals decreases. The path of the minimal energy configuration at bifurcation points can be computed from the null space of a large sparse symmetric matrix. We describe a new variant of the implicitly restarted Lanczos method that is well suited for the computation of extreme eigenvalues of a large sparse symmetric matrix, and we use this method to determine the desired null space. Our implicitly restarted Lanczos method determines adoptively a polynomial filter by using Leja shifts, and does not require factorization of the matrix. The storage requirement of the method is small, and this makes it attractive to use for the present application.
Evaluation of Harmonics Impact on Digital Relays
Directory of Open Access Journals (Sweden)
Kinan Wannous
2018-04-01
Full Text Available This paper presents the concept of the impact of harmonic distortion on a digital protection relay. The aim is to verify and determine the reasons of a mal-trip or failure to trip the protection relays; the suggested solution of the harmonic distortion is explained by a mathematical model in the Matlab Simulink programming environment. The digital relays have been tested under harmonic distortions in order to verify the function of the relays algorithm under abnormal conditions. The comparison between the protection relay algorithm under abnormal conditions and a mathematical model in the Matlab Simulink programming environment based on injected harmonics of high values is provided. The test is separated into different levels; the first level is based on the harmonic effect of an individual harmonic and mixed harmonics. The test includes the effect of the harmonics in the location of the fault point into distance protection zones. This paper is a new proposal in the signal processing of power quality disturbances using Matlab Simulink and the power quality impact on the measurements of the power system quantities; the test simulates the function of protection in power systems in terms of calculating the current and voltage values of short circuits and their faults. The paper includes several tests: frequency variations and decomposition of voltage waveforms with Fourier transforms (model and commercial relay, the effect of the power factor on the location of fault points, the relation between the tripping time and the total harmonic distortion (THD levels in a commercial relay, and a comparison of the THD capture between the commercial relay and the model.
Energy Technology Data Exchange (ETDEWEB)
Land, T A; Dylla-Spears, R; Thorsness, C B
2006-08-29
Large dihydrogen phosphate (KDP) crystals are grown in large crystallizers to provide raw material for the manufacture of optical components for large laser systems. It is a challenge to grow crystal with sufficient mass and geometric properties to allow large optical plates to be cut from them. In addition, KDP has long been the canonical solution crystal for study of growth processes. To assist in the production of the crystals and the understanding of crystal growth phenomena, analysis of growth habits of large KDP crystals has been studied, small scale kinetic experiments have been performed, mass transfer rates in model systems have been measured, and computational-fluid-mechanics tools have been used to develop an engineering model of the crystal growth process. The model has been tested by looking at its ability to simulate the growth of nine KDP boules that all weighed more than 200 kg.
Harmonic Analysis of Offshore Wind Farms with Full Converter Wind Turbines
DEFF Research Database (Denmark)
Kocewiak, Lukasz Hubert; Hjerrild, Jesper; Bak, Claus Leth
2009-01-01
to a shore with a long HV cable. The way of propagation and effects of harmonics are presented for different study cases. Modeling strategies of harmonic sources for harmonic analysis are described and compared. Different results dependent on applied harmonic models are shown and discussed in this paper...
International Nuclear Information System (INIS)
Choi, M.; Pinsker, R. I.; Chan, V. S.; Muscatello, C. M.; Jaeger, E. F.
2011-01-01
In recent moderate to high harmonic fast wave heating and current drive experiments in DIII-D, a synergy effect was observed when the 6 th harmonic 90 MHz fast wave power is applied to the plasma preheated by neutral beams and the 4 th harmonic 60 MHz fast wave. In this paper, we investigate how the synergy can occur using ORBIT-RF coupled with AORSA. Preliminary simulations suggest that damping of 4 th harmonic FW on beam ions accelerates them above the injection energy, which may allow significant damping of 6 th harmonic FW on beam ion tails to produce synergy.
Three-dimensional modelling of thermal stress in floating zone silicon crystal growth
Plate, Matiss; Krauze, Armands; Virbulis, Jānis
2018-05-01
During the growth of large diameter silicon single crystals with the industrial floating zone method, undesirable level of thermal stress in the crystal is easily reached due to the inhomogeneous expansion as the crystal cools down. Shapes of the phase boundaries, temperature field and elastic material properties determine the thermal stress distribution in the solid mono crystalline silicon during cylindrical growth. Excessive stress can lead to fracture, generation of dislocations and altered distribution of intrinsic point defects. Although appearance of ridges on the crystal surface is the decisive factor of a dislocation-free growth, the influence of these ridges on the stress field is not completely clear. Here we present the results of thermal stress analysis for 4” and 5” diameter crystals using a quasi-stationary three dimensional mathematical model including the material anisotropy and the presence of experimentally observed ridges which cannot be addressed with axis-symmetric models. The ridge has a local but relatively strong influence on thermal stress therefore its relation to the origin of fracture is hypothesized. In addition, thermal stresses at the crystal rim are found to increase for a particular position of the crystal radiation reflector.
Benchmark of the FLUKA model of crystal channeling against the UA9-H8 experiment
Energy Technology Data Exchange (ETDEWEB)
Schoofs, P.; Cerutti, F.; Ferrari, A. [European Organization for Nuclear Research (CERN), Geneva (Switzerland); Smirnov, G. [European Organization for Nuclear Research (CERN), Geneva (Switzerland); Joint Institute for Nuclear Research (JINR), Dubna (Russian Federation)
2015-07-15
Channeling in bent crystals is increasingly considered as an option for the collimation of high-energy particle beams. The installation of crystals in the LHC has taken place during this past year and aims at demonstrating the feasibility of crystal collimation and a possible cleaning efficiency improvement. The performance of CERN collimation insertions is evaluated with the Monte Carlo code FLUKA, which is capable to simulate energy deposition in collimators as well as beam loss monitor signals. A new model of crystal channeling was developed specifically so that similar simulations can be conducted in the case of crystal-assisted collimation. In this paper, most recent results of this model are brought forward in the framework of a joint activity inside the UA9 collaboration to benchmark the different simulation tools available. The performance of crystal STF 45, produced at INFN Ferrara, was measured at the H8 beamline at CERN in 2010 and serves as the basis to the comparison. Distributions of deflected particles are shown to be in very good agreement with experimental data. Calculated dechanneling lengths and crystal performance in the transition region between amorphous regime and volume reflection are also close to the measured ones.
HDL inhibit cytokine production in a mouse model of urate crystal-induced inflammation
L. Punzi; D. Burger; J.M Dayer; P. Sfriso; R. Luisetto; F. Oliviero; A. Scanu
2011-01-01
Objectives: To evaluate whether high density lipoproteins (HDL) affect monosodium urate (MSU) crystal-induced inflammation in the murine air pouch model. Methods: MSU crystals were prepared by Denko’s method and sterilized by heating at 180°C for 2 h before each experiment. Human HDL were isolated from peripheral blood of healthy volunteers. MSU crystals (2 mg in 1 ml of PBS) were injected into subcutaneous air pouches in mice in the presence or absence of HDL (0.1 mg). Negative control pouch...
Invited review liquid crystal models of biological materials and silk spinning.
Rey, Alejandro D; Herrera-Valencia, Edtson E
2012-06-01
A review of thermodynamic, materials science, and rheological liquid crystal models is presented and applied to a wide range of biological liquid crystals, including helicoidal plywoods, biopolymer solutions, and in vivo liquid crystals. The distinguishing characteristics of liquid crystals (self-assembly, packing, defects, functionalities, processability) are discussed in relation to biological materials and the strong correspondence between different synthetic and biological materials is established. Biological polymer processing based on liquid crystalline precursors includes viscoelastic flow to form and shape fibers. Viscoelastic models for nematic and chiral nematics are reviewed and discussed in terms of key parameters that facilitate understanding and quantitative information from optical textures and rheometers. It is shown that viscoelastic modeling the silk spinning process using liquid crystal theories sheds light on textural transitions in the duct of spiders and silk worms as well as on tactoidal drops and interfacial structures. The range and consistency of the predictions demonstrates that the use of mesoscopic liquid crystal models is another tool to develop the science and biomimetic applications of mesogenic biological soft matter. Copyright © 2011 Wiley Periodicals, Inc.
Forcher, Francesco; Redaelli, Stefano; Zanetti, Marco; CERN. Geneva. ATS Department
2018-01-01
The planes in crystalline solids can constrain the directions that charged particles take as they pass through. Physicists can use this "channelling" property of crystals to steer particle beams. In a bent crystal, for example, channelled particles follow the bend and can change their direction. Several studies are on-going at CERN to verify the possibility of using bent crystals as primary collimators in high energy hadron colliders like the LHC. Simulations have been developed to model the coherent interaction with crystalline planes. The goal of this note is to analyze the data collected on extracted beam from the SPS and develop an improved model to simulate the data’s subtleties, in particular the transition between the volume reﬂection and amorphous interactions of the beam with crystals.
Mixed spin Ising model with four-spin interaction and random crystal field
International Nuclear Information System (INIS)
Benayad, N.; Ghliyem, M.
2012-01-01
The effects of fluctuations of the crystal field on the phase diagram of the mixed spin-1/2 and spin-1 Ising model with four-spin interactions are investigated within the finite cluster approximation based on a single-site cluster theory. The state equations are derived for the two-dimensional square lattice. It has been found that the system exhibits a variety of interesting features resulting from the fluctuation of the crystal field interactions. In particular, for low mean value D of the crystal field, the critical temperature is not very sensitive to fluctuations and all transitions are of second order for any value of the four-spin interactions. But for relatively high D, the transition temperature depends on the fluctuation of the crystal field, and the system undergoes tricritical behaviour for any strength of the four-spin interactions. We have also found that the model may exhibit reentrance for appropriate values of the system parameters.
Semi-analytical model for a slab one-dimensional photonic crystal
Libman, M.; Kondratyev, N. M.; Gorodetsky, M. L.
2018-02-01
In our work we justify the applicability of a dielectric mirror model to the description of a real photonic crystal. We demonstrate that a simple one-dimensional model of a multilayer mirror can be employed for modeling of a slab waveguide with periodically changing width. It is shown that this width change can be recalculated to the effective refraction index modulation. The applicability of transfer matrix method of reflection properties calculation was demonstrated. Finally, our 1-D model was employed to analyze reflection properties of a 2-D structure - a slab photonic crystal with a number of elliptic holes.
International Nuclear Information System (INIS)
Lin, Qui-xun; Van Wechel, T.D.
1987-01-01
A single gap harmonic buncher has been constructed as a pretandem buncher. Over 85% of a proton dc beam has been bunched into pulses. The width (fwhm) of the pulses is 0.7 ns. The buncher is based on that built at Argonne. Changes were made to the buncher's configuration so that the buncher could be tuned to the desired four harmonic frequencies. A method of calibrating and setting the relative phases and amplitudes of the four harmonic frequencies has been used to obtain an optimum sawtooth-like bunching waveform
Harmonic supergraphs. Green functions
International Nuclear Information System (INIS)
Galperin, A.; Ivanov, E.; Gievetsky, V.; Sokatchev, E.
1985-01-01
The quantization procedure in the harmonic superspace approach is worked out. Harmonic distributions are introduced and are used to construct the analytic superspace delta-functions and the Green functions for the hypermultiplet and the N=2 Yang-Mills superfields. The gauge fixing is described and the relevant Faddeev-Popov ghosts are defined. The corresponding BRST transformations are found. The harmonic superspace quantization of the N=2 gauge theory turns out to be rather simple and has many parallels with that for the standard (N=0) Yang-Mills theory. In particular, no ghosts-forghosts are needed
The Virasoro algebra from harmonic superspace
International Nuclear Information System (INIS)
Saidi, E.H.; Zakkari, M.
1990-08-01
Using harmonic superspace techniques, we construct a new field realization of the Virasoro algebra. The main conformal objects are U(1) Cartan tensors instead of the U(1) Lorentz ones. The new conformal model, which admits moreover a d=2 (4,0) global supersymmetry is constructed out of the infinitely relaxed HST and FS hypermultiplets. The conformal current T 4+ together with the harmonic superspace OPE rules are given. The Virasoro algebra and the harmonic superspace Schwarzian derivative S 4+ are also derived. (author). 14 refs
Modeling photonic crystal waveguides with noncircular geometry using green function method
International Nuclear Information System (INIS)
Uvarovaa, I.; Tsyganok, B.; Bashkatov, Y.; Khomenko, V.
2012-01-01
Currently in the field of photonics is an acute problem fast and accurate simulation photonic crystal waveguides with complex geometry. This paper describes an improved method of Green's functions for non-circular geometries. Based on comparison of selected efficient numerical method for finding the eigenvalues for the Green's function method for non-circular holes chosen effective method for our purposes. Simulation is realized in Maple environment. The simulation results confirmed experimentally. Key words: photonic crystal, waveguide, modeling, Green function, complex geometry
The diluted tri-dimensional spin-one Ising model with crystal field interactions
International Nuclear Information System (INIS)
Saber, M.
1988-09-01
3D spin-one Ising models with nearest-neighbour ferromagnetic interactions with crystal-field exhibit tricritical behaviour. A new method that applies to a wide class of random systems is used to study the influence of site and bond dilution on this behaviour. We have calculated temperature-crystal-field-concentration phase diagrams and determined, in particular, the influence of dilution on the zero temperature tricritical temperature. (author). 10 refs, 8 figs
Strategies for the coupling of global and local crystal growth models
Derby, Jeffrey J.; Lun, Lisa; Yeckel, Andrew
2007-05-01
The modular coupling of existing numerical codes to model crystal growth processes will provide for maximum effectiveness, capability, and flexibility. However, significant challenges are posed to make these coupled models mathematically self-consistent and algorithmically robust. This paper presents sample results from a coupling of the CrysVUn code, used here to compute furnace-scale heat transfer, and Cats2D, used to calculate melt fluid dynamics and phase-change phenomena, to form a global model for a Bridgman crystal growth system. However, the strategy used to implement the CrysVUn-Cats2D coupling is unreliable and inefficient. The implementation of under-relaxation within a block Gauss-Seidel iteration is shown to be ineffective for improving the coupling performance in a model one-dimensional problem representative of a melt crystal growth model. Ideas to overcome current convergence limitations using approximations to a full Newton iteration method are discussed.
MSET modeling of Crystal River-3 venturi flow meters
International Nuclear Information System (INIS)
Bockhorst, F. K.; Gross, K. C.; Herzog, J. P.; Wegerich, S. W.
1998-01-01
The analysis of archived Crystal River-3 feedwater flow data reveals a slow and steady degradation of the flow meter measurements during the 1992/1993 operating cycle. MSET can reliably estimate the true flow rate and quantify the degree of departure between the indicated signal and the true flow rate with high accuracy. The MSET computed flow rate could, in principle, be used to provide an improved estimate of the reactor power and hence avoid the revenue loss associated with derating the reactor based on a faulty feedwater flow rate indication
Ultrafast third-harmonic generation from textured aluminum nitride-sapphire interfaces
International Nuclear Information System (INIS)
Stoker, D. S.; Keto, J. W.; Baek, J.; Wang, W.; Becker, M. F.; Kovar, D.
2006-01-01
We measured and modeled third-harmonic generation (THG) from an AlN thin film on sapphire using a time-domain approach appropriate for ultrafast lasers. Second-harmonic measurements indicated that polycrystalline AlN contains long-range crystal texture. An interface model for third-harmonic generation enabled an analytical representation of scanning THG (z-scan) experiments. Using it and accounting for Fresnel reflections, we measured the AlN-sapphire susceptibility ratio and estimated the susceptibility for aluminum nitride, χ xxxx (3) (3ω;ω,ω,ω)=1.52±0.25x10 -13 esu. The third-harmonic (TH) spectrum strongly depended on the laser focus position and sample thickness. The amplitude and phase of the frequency-domain interference were fit to the Fourier transform of the calculated time-domain field to improve the accuracy of several experimental parameters. We verified that the model works well for explaining TH signal amplitudes and spectral phase. Some anomalous features in the TH spectrum were observed, which we attributed to nonparaxial effects
Advances in nonlinear polymers and inorganic crystals, liquid crystals, and laser media
International Nuclear Information System (INIS)
Musikant, S.
1987-01-01
These proceedings collect papers on laser materials. Topics include: solid state lasers, fracture mechanics in laser materials, optical second harmonic generation, nonlinear optics, molecular crystals, crystal-phase transformation, and materials for laser fusion reactors
A High-Rate, Single-Crystal Model including Phase Transformations, Plastic Slip, and Twinning
Energy Technology Data Exchange (ETDEWEB)
Addessio, Francis L. [Los Alamos National Lab. (LANL), Los Alamos, NM (United States). Theoretical Division; Bronkhorst, Curt Allan [Los Alamos National Lab. (LANL), Los Alamos, NM (United States). Theoretical Division; Bolme, Cynthia Anne [Los Alamos National Lab. (LANL), Los Alamos, NM (United States). Explosive Science and Shock Physics Division; Brown, Donald William [Los Alamos National Lab. (LANL), Los Alamos, NM (United States). Materials Science and Technology Division; Cerreta, Ellen Kathleen [Los Alamos National Lab. (LANL), Los Alamos, NM (United States). Materials Science and Technology Division; Lebensohn, Ricardo A. [Los Alamos National Lab. (LANL), Los Alamos, NM (United States). Materials Science and Technology Division; Lookman, Turab [Los Alamos National Lab. (LANL), Los Alamos, NM (United States). Theoretical Division; Luscher, Darby Jon [Los Alamos National Lab. (LANL), Los Alamos, NM (United States). Theoretical Division; Mayeur, Jason Rhea [Los Alamos National Lab. (LANL), Los Alamos, NM (United States). Theoretical Division; Morrow, Benjamin M. [Los Alamos National Lab. (LANL), Los Alamos, NM (United States). Materials Science and Technology Division; Rigg, Paulo A. [Washington State Univ., Pullman, WA (United States). Dept. of Physics. Inst. for Shock Physics
2016-08-09
An anisotropic, rate-dependent, single-crystal approach for modeling materials under the conditions of high strain rates and pressures is provided. The model includes the effects of large deformations, nonlinear elasticity, phase transformations, and plastic slip and twinning. It is envisioned that the model may be used to examine these coupled effects on the local deformation of materials that are subjected to ballistic impact or explosive loading. The model is formulated using a multiplicative decomposition of the deformation gradient. A plate impact experiment on a multi-crystal sample of titanium was conducted. The particle velocities at the back surface of three crystal orientations relative to the direction of impact were measured. Molecular dynamics simulations were conducted to investigate the details of the high-rate deformation and pursue issues related to the phase transformation for titanium. Simulations using the single crystal model were conducted and compared to the high-rate experimental data for the impact loaded single crystals. The model was found to capture the features of the experiments.
DEFF Research Database (Denmark)
Abdul Samad, Noor Asma Fazli Bin
A generic and systematic model-based framework for the design of a process monitoring and control system to achieve the desired crystal size distribution (CSD) and crystal shape for a wide range of crystallization processes has been developed. This framework combines a generic multi-dimensional m...
Numerical modelling of micro-machining of f.c.c. single crystal: Influence of strain gradients
Demiral, Murat; Roy, Anish; El Sayed, Tamer S.; Silberschmidt, Vadim V.
2014-01-01
of orthogonal micro-machining of f.c.c. single crystal copper was developed. The model was implemented in a commercial software ABAQUS/Explicit employing a user-defined subroutine VUMAT. Strain-gradient crystal-plasticity and conventional crystal
Superstrings and harmonic superspace
International Nuclear Information System (INIS)
Kallosh, R.E.; AN SSSR, Moscow. Fizicheskij Inst.)
1987-01-01
The paper on superstrings and harmonic superspace is a contribution to the book dedicated to E.S. Fradkin on his sixtieth birthday. The purpose of the paper is to propose a description of N = 2,3 superspace which could be used for the investigation of the effective d = 10 harmonic superspace corresponding to the heterotic superstring. A description is given of the structure of semi-simple Lie algebras in the Cartan-Weyl basis, as well as the general properties of the even, compact part of harmonic superspace. The main properties of the four-dimensional N = 2 SYM theory are discussed, along with the N = 3, d = 4 super Yang-Mills theory. Finally the relation between the harmonic superspace and the heterotic E 8 x E 8 superstring is examined. (U.K.)
Multidimensional high harmonic spectroscopy
International Nuclear Information System (INIS)
Bruner, Barry D; Soifer, Hadas; Shafir, Dror; Dudovich, Nirit; Serbinenko, Valeria; Smirnova, Olga
2015-01-01
High harmonic generation (HHG) has opened up a new frontier in ultrafast science where attosecond time resolution and Angstrom spatial resolution are accessible in a single measurement. However, reconstructing the dynamics under study is limited by the multiple degrees of freedom involved in strong field interactions. In this paper we describe a new class of measurement schemes for resolving attosecond dynamics, integrating perturbative nonlinear optics with strong-field physics. These approaches serve as a basis for multidimensional high harmonic spectroscopy. Specifically, we show that multidimensional high harmonic spectroscopy can measure tunnel ionization dynamics with high precision, and resolves the interference between multiple ionization channels. In addition, we show how multidimensional HHG can function as a type of lock-in amplifier measurement. Similar to multi-dimensional approaches in nonlinear optical spectroscopy that have resolved correlated femtosecond dynamics, multi-dimensional high harmonic spectroscopy reveals the underlying complex dynamics behind attosecond scale phenomena. (paper)
Multisite EPR oximetry from multiple quadrature harmonics.
Ahmad, R; Som, S; Johnson, D H; Zweier, J L; Kuppusamy, P; Potter, L C
2012-01-01
Multisite continuous wave (CW) electron paramagnetic resonance (EPR) oximetry using multiple quadrature field modulation harmonics is presented. First, a recently developed digital receiver is used to extract multiple harmonics of field modulated projection data. Second, a forward model is presented that relates the projection data to unknown parameters, including linewidth at each site. Third, a maximum likelihood estimator of unknown parameters is reported using an iterative algorithm capable of jointly processing multiple quadrature harmonics. The data modeling and processing are applicable for parametric lineshapes under nonsaturating conditions. Joint processing of multiple harmonics leads to 2-3-fold acceleration of EPR data acquisition. For demonstration in two spatial dimensions, both simulations and phantom studies on an L-band system are reported. Copyright © 2011 Elsevier Inc. All rights reserved.
Energy Technology Data Exchange (ETDEWEB)
Hohmann, Manuel [Physikalisches Institut, Universitaet Tartu (Estonia)
2016-07-01
Tensor harmonics are a useful mathematical tool for finding solutions to differential equations which transform under a particular representation of the rotation group SO(3). In order to make use of this tool also in the setting of Finsler geometry, where the objects of relevance are d-tensors instead of tensors, we construct a set of d-tensor harmonics for both SO(3) and SO(4) symmetries and show how these can be used for calculations in Finsler geometry and gravity.
Laser waveform control of extreme ultraviolet high harmonics from solids.
You, Yong Sing; Wu, Mengxi; Yin, Yanchun; Chew, Andrew; Ren, Xiaoming; Gholam-Mirzaei, Shima; Browne, Dana A; Chini, Michael; Chang, Zenghu; Schafer, Kenneth J; Gaarde, Mette B; Ghimire, Shambhu
2017-05-01
Solid-state high-harmonic sources offer the possibility of compact, high-repetition-rate attosecond light emitters. However, the time structure of high harmonics must be characterized at the sub-cycle level. We use strong two-cycle laser pulses to directly control the time-dependent nonlinear current in single-crystal MgO, leading to the generation of extreme ultraviolet harmonics. We find that harmonics are delayed with respect to each other, yielding an atto-chirp, the value of which depends on the laser field strength. Our results provide the foundation for attosecond pulse metrology based on solid-state harmonics and a new approach to studying sub-cycle dynamics in solids.
A thermal model for czochralski silicon crystal growth with an axial magnetic field
Hjellming, L. N.
1990-07-01
This paper presents a thermal model for molten silicon in a Czochralski crystal puller system with an applied uniform axial magnetic field. The melt depth is treated as continually decreasing, which affects the thermal environment of the melt and crystal. The radiative heat loss and the input heat flux are treated as functions of time, with a constraint placed on the heat lost to the crystal from the melt. As the melt motion reaches a steady state rapidly, the temperature and flow fields are treated as instantaneously steady at each melt depth. The heat transport is a mixture of conduction and convection, and by considering the crystal and crucible to be rotating with the same angular velocity, the flows driven by buoyancy and thermocapillarity are isolated and provide the convective heat transport in the melt for the range of magnetic field strengths 0.2 ≤ B ≤ 1.0T.
REDUCED ISOTROPIC CRYSTAL MODEL WITH RESPECT TO THE FOURTH-ORDER ELASTIC MODULI
Directory of Open Access Journals (Sweden)
O. Burlayenko
2018-04-01
Full Text Available Using a reduced isotropic crystal model the relationship between the fourth-order elastic moduli of an isotropic medium and the independent components of the fourth-order elastic moduli tensor of real crystals of various crystal systems is found. To calculate the coefficients of these relations, computer algebra systems Redberry and Mathematica for working with high order tensors in the symbolic and explicit form were used, in light of the overly complex computation. In an isotropic medium, there are four independent fourth order elastic moduli. This is due to the presence of four invariants for an eighth-rank tensor in the three-dimensional space, that has symmetries over the pairs of indices. As an example, the moduli of elasticity of an isotropic medium corresponding to certain crystals of cubic system are given (LiF, NaCl, MgO, CaF2. From the obtained results it can be seen that the reduced isotropic crystal model can be most effectively applied to high-symmetry crystal systems.
International Nuclear Information System (INIS)
Chandra, B.P.; Singh, Seema; Ojha, Bharti; Shrivastava, R.G.
1996-01-01
A theoretical study is made on the mobile interstitial and mobile electron models of mechano-induced luminescence in coloured alkali halide crystals. Equations derived indicate that the mechanoluminescence intensity should depend on several factors like strain rate, applied stress, temperature, density of F-centres and volume of crystal. The equations also involve the efficiency and decay time of mechanoluminescence. Results of mobile interstitial and mobile electron models are compared with the experimental observations, which indicated that the latter is more suitable as compared to the former. From the temperature dependence of ML, the energy gaps between the dislocation band and ground state of F-centre is calculated which are 0.08, 0.072 and 0.09 eV for KCl, KBr and NaCl crystals, respectively. The theory predicts that the decay of ML intensity is related to the process of stress relaxation in crystals. (author). 33 refs., 5 figs., 1 tab
A thermomechanical crystal plasticity constitutive model for ultrasonic consolidation
Siddiq, Amir; El Sayed, Tamer S.
2012-01-01
We present a micromechanics-based thermomechanical constitutive model to simulate the ultrasonic consolidation process. Model parameters are calibrated using an inverse modeling approach. A comparison of the simulated response and experimental
Harmonic space and quaternionic manifolds
International Nuclear Information System (INIS)
Galperin, A.; Ogievetsky, O.; Ivanov, E.
1992-10-01
A principle of harmonic analyticity underlying the quaternionic (quaternion-Kaehler) geometry is found, and the differential constraints which define this geometry are solved. To this end the original 4n-dimensional quaternionic manifold is extended to a biharmonic space. The latter includes additional harmonic coordinates associated with both the tangent local Sp(1) group and an extra rigid SU(2) group rotating the complex structures. An one-to-one correspondence is established between the quaternionic spaces and off-shell N=2 supersymmetric sigma-models coupled to N=2 supergravity. Coordinates of the analytic subspace are identified with superfields describing N=2 matter hypermultiplets and a compensating hypermultiplet of N=2 supergravity. As an illustration the potentials for the symmetric quaternionic spaces are presented. (K.A.) 22 refs
Yang, Defu; Chen, Xueli; Peng, Zhen; Wang, Xiaorui; Ripoll, Jorge; Wang, Jing; Liang, Jimin
2013-01-01
Modeling light propagation in the whole body is essential and necessary for optical imaging. However, non-scattering, low-scattering and high absorption regions commonly exist in biological tissues, which lead to inaccuracy of the existing light transport models. In this paper, a novel hybrid light transport model that couples the simplified spherical harmonics approximation (SPN) with the radiosity theory (HSRM) was presented, to accurately describe light transport in turbid media with non-scattering, low-scattering and high absorption heterogeneities. In the model, the radiosity theory was used to characterize the light transport in non-scattering regions and the SPN was employed to handle the scattering problems, including subsets of low-scattering and high absorption. A Neumann source constructed by the light transport in the non-scattering region and formed at the interface between the non-scattering and scattering regions was superposed into the original light source, to couple the SPN with the radiosity theory. The accuracy and effectiveness of the HSRM was first verified with both regular and digital mouse model based simulations and a physical phantom based experiment. The feasibility and applicability of the HSRM was then investigated by a broad range of optical properties. Lastly, the influence of depth of the light source on the model was also discussed. Primary results showed that the proposed model provided high performance for light transport in turbid media with non-scattering, low-scattering and high absorption heterogeneities.
Sutherland, Richard L.
2002-12-01
Polarization properties and electro-optical switching behavior of holographic polymer-dispersed liquid-crystal (HPDLC) reflection and transmission gratings are studied. A theoretical model is developed that combines anisotropic coupled-wave theory with an elongated liquid-crystal-droplet switching model and includes the effects of a statistical orientational distribution of droplet-symmetry axes. Angle- and polarization-dependent switching behaviors of HPDLC gratings are elucidated, and the effects on dynamic range are described. A new type of electro-optical switching not seen in ordinary polymer-dispersed liquid crystals, to the best of the author's knowledge, is presented and given a physical interpretation. The model provides valuable insight to the physics of these gratings and can be applied to the design of HPDLC holographic optical elements.
Kinetic modeling of multi‐component crystallization of industrial‐grade oils and fats
DEFF Research Database (Denmark)
Hjorth, Jeppe L.; Miller, Rasmus L.; Woodley, John M.
2015-01-01
Transient crystallization kinetics is investigated for complex, industrial‐grade vegetable oils consisting of more than ten triacylglycerols (TAG). The classical nucleation model has been used to describe primary nucleation, while secondary nucleation has been described by a semi‐empirical approach......‐fat content (SFC) measurements for a given oil at different cooling rates and degrees of dilution. The developed model can accommodate more polymorphs simultaneously and performs well with respect to predicting crystallization onset, rate of crystallization and final SFC value. It can also qualitatively...... compositions. Such a predictive model may provide a powerful tool to screen and optimize oil formulations in industrial processes and allow product developers to evaluate recrystallization events....
Hase, E; Sato, K; Yonekura, D; Minamikawa, T; Takahashi, M; Yasui, T
2016-11-01
This study aimed to evaluate the histological and mechanical features of tendon healing in a rabbit model with second-harmonic-generation (SHG) imaging and tensile testing. A total of eight male Japanese white rabbits were used for this study. The flexor digitorum tendons in their right leg were sharply transected, and then were repaired by intratendinous stitching. At four weeks post-operatively, the rabbits were killed and the flexor digitorum tendons in both right and left legs were excised and used as specimens for tendon healing (n = 8) and control (n = 8), respectively. Each specimen was examined by SHG imaging, followed by tensile testing, and the results of the two testing modalities were assessed for correlation. While the SHG light intensity of the healing tendon samples was significantly lower than that of the uninjured tendon samples, 2D Fourier transform SHG images showed a clear difference in collagen fibre structure between the uninjured and the healing samples, and among the healing samples. The mean intensity of the SHG image showed a moderate correlation (R 2 = 0.37) with Young's modulus obtained from the tensile testing. Our results indicate that SHG microscopy may be a potential indicator of tendon healing.Cite this article: E. Hase, K. Sato, D. Yonekura, T. Minamikawa, M. Takahashi, T. Yasui. Evaluation of the histological and mechanical features of tendon healing in a rabbit model with the use of second-harmonic-generation imaging and tensile testing. Bone Joint Res 2016;5:577-585. DOI: 10.1302/2046-3758.511.BJR-2016-0162.R1. © 2016 Yasui et al.
Effects of harmonic roving on pitch discrimination
DEFF Research Database (Denmark)
Santurette, Sébastien; de Kérangal, Mathilde le Gal; Joshi, Suyash Narendra
2015-01-01
Performance in pitch discrimination tasks is limited by variability intrinsic to listeners which may arise from peripheral auditory coding limitations or more central noise sources. The present study aimed at quantifying such “internal noise” by estimating the amount of harmonic roving required...... to impair pitch discrimination performance. Fundamental-frequency difference limens (F0DLs) were obtained in normal-hearing listeners with and without musical training for complex tones filtered between 1.5 and 3.5 kHz with F0s of 300 Hz (resolved harmonics) and 75 Hz (unresolved harmonics). The harmonicity...... that could be used to quantify the internal noise and provide strong constraints for physiologically inspired models of pitch perception....
Energy Technology Data Exchange (ETDEWEB)
Nanev, C.N.; Dimitrov, I.L.; Hodzhaoglu, F.V. [Rostislaw Kaischew Institute of Physical Chemistry, Bulgarian Academy of Sciences, Sofia (Bulgaria)
2011-02-15
Insulin is the only protein that is secreted in a crystalline form in a human healthy body. To mimic the secretion process we used NaCl salting-out to growing tiny rhombohedral Zn-insulin crystals. The dissolution of the insulin crystals is of special interest for the therapeutical praxis, because the human body is supplied with the physiologically active monomers of the insulin through dissolution of the crystalline granules secreted in the pancreatic {beta}-cells. Sets of tiny rhombohedral Zn-insulin crystals, which resembled the granules secreted in the {beta}-cells, were subjected to dissolution in blood plasma and model solutions. The impacts of the solution composition, flow rate, pH and ionic strength on the insulin crystal dissolution were investigated. The effect of the blood plasma was determinant because it dissolved the rhombohedral Zn-insulin crystals almost instantly, while the effects of solution's physicochemical characteristics were of minor importance. In addition, we found that the presence of abundant zinc ions suppressed the dissolution of the insulin crystals. (copyright 2011 WILEY-VCH Verlag GmbH and Co. KGaA, Weinheim) (orig.)
Birdsall, Robert E.; Koshel, Brooke M.; Hua, Yimin; Ratnayaka, Saliya N.; Wirth, Mary J.
2013-01-01
Sieving of proteins in silica colloidal crystals of mm dimensions is characterized for particle diameters of nominally 350 and 500 nm, where the colloidal crystals are chemically modified with a brush layer of polyacrylamide. A model is developed that relates the reduced electrophoretic mobility to the experimentally measurable porosity. The model fits the data with no adjustable parameters for the case of silica colloidal crystals packed in capillaries, for which independent measurements of the pore radii were made from flow data. The model also fits the data for electrophoresis in a highly ordered colloidal crystal formed in a channel, where the unknown pore radius was used as a fitting parameter. Plate heights as small as 0.4 μm point to the potential for miniaturized separations. Band broadening increases as the pore radius approaches the protein radius, indicating that the main contribution to broadening is the spatial heterogeneity of the pore radius. The results quantitatively support the notion that sieving occurs for proteins in silica colloidal crystals, and facilitate design of new separations that would benefit from miniaturization. PMID:23229163
A simple localized-itinerant model for PrAl3: crystal field and exchange effects
International Nuclear Information System (INIS)
Ranke, P.J. von; Palermo, L.
1990-01-01
We present a simple magnetic model for PrAl sub(3). The effects of crystal field are treated using a reduced set of levels and the corresponding wave functions are extracted from the actual crystal field levels of Pr sup(+3) in a hexagonal symmetry. The exchange between 4f- and conduction electrons are dealt within a molecular field approximation. An analytical magnetic state equation is derived and the magnetic behaviour discussed. The parameters of the model are estimated from a fitting of the inverse susceptibility of PrAl sub(3) given in the literature. (author)
A Review of Domain Modelling and Domain Imaging Techniques in Ferroelectric Crystals
Directory of Open Access Journals (Sweden)
John E. Huber
2011-02-01
Full Text Available The present paper reviews models of domain structure in ferroelectric crystals, thin films and bulk materials. Common crystal structures in ferroelectric materials are described and the theory of compatible domain patterns is introduced. Applications to multi-rank laminates are presented. Alternative models employing phase-field and related techniques are reviewed. The paper then presents methods of observing ferroelectric domain structure, including optical, polarized light, scanning electron microscopy, X-ray and neutron diffraction, atomic force microscopy and piezo-force microscopy. Use of more than one technique for unambiguous identification of the domain structure is also described.
An atomic-scale model of fcc crystal-growth
Energy Technology Data Exchange (ETDEWEB)
Waal, B.W. van de (Technische Hogeschool Twente, Enschede (Netherlands). Dept. of Physics)
1991-01-01
Nearly perfect fcc growth may be simulated by the application of a simple growth-algorithm - only sites that are at least 4-coordinated are occupied - to a selected seed. The seed is a 22-atom cluster, being the smallest close-packed structure with two crossing stacking-faults. The stacking-faults produce active surface-sites, that can not be exhausted by occupation; they are arranged in non-vanishing steps, similar to those produced by screw-dislocations. The algorithm prevents further stacking-faults, and ensures ABC-stacking of close-packed (111)-layers, characteristic of the fcc structure. The same algorithm would not produce further growth of perfect fcc clusters or of Mackay icosahedra. It is proposed that the ability to grow fast under near-equilibrium conditions is a better criterion to select clusters as precursors of the bulk-structure than their cohesive energy. The crystal structure problem of the rare gases - why fcc, not hcp - is discussed in connection with the apparent impossibility to simulate hcp growth by an analogous procedure. (orig.).
Model and experimental investigation of frequency conversion in AgGaGexS2(1+x) (x = 0, 1) crystals
International Nuclear Information System (INIS)
Wang Tiejun; Kang Zhihui; Zhang Hongzhi; Feng Zhishu; Jiang Yun; Gao Jinyue; Andreev, Yury M; Lanskii, Gregory V; Shaiduko, Anna V
2007-01-01
Analysis of available and developed data on phase matching in AgGaGe x S 2(1+x) (x = 0, 1) crystals is carried out. Nanosecond AgGaS 2 type I optical parametric oscillator with a continuously tunable range 2.65-5.29 μm is demonstrated pumped by a Q-switched Nd : YAG laser. An output pulse energy of up to 0.56 mJ at 4 μm is recorded. Phase matching of second harmonic generation in both crystals is represented. Best sets of Sellmeier equations for two crystals are determined
Quantization of the damped harmonic oscillator revisited
Energy Technology Data Exchange (ETDEWEB)
Baldiotti, M.C., E-mail: baldiott@fma.if.usp.b [Instituto de Fisica, Universidade de Sao Paulo, Caixa Postal 66318-CEP, 05315-970 Sao Paulo, S.P. (Brazil); Fresneda, R., E-mail: fresneda@gmail.co [Instituto de Fisica, Universidade de Sao Paulo, Caixa Postal 66318-CEP, 05315-970 Sao Paulo, S.P. (Brazil); Gitman, D.M., E-mail: gitman@dfn.if.usp.b [Instituto de Fisica, Universidade de Sao Paulo, Caixa Postal 66318-CEP, 05315-970 Sao Paulo, S.P. (Brazil)
2011-04-11
We return to the description of the damped harmonic oscillator with an assessment of previous works, in particular the Bateman-Caldirola-Kanai model and a new model proposed by one of the authors. We argue the latter has better high energy behavior and is connected to existing open-systems approaches. - Highlights: We prove the local equivalence of two damped harmonic oscillator models. We find different high energy behaviors between the two models. Based on the local equivalence, we make a simple construction of the coherent states.
Quantization of the damped harmonic oscillator revisited
International Nuclear Information System (INIS)
Baldiotti, M.C.; Fresneda, R.; Gitman, D.M.
2011-01-01
We return to the description of the damped harmonic oscillator with an assessment of previous works, in particular the Bateman-Caldirola-Kanai model and a new model proposed by one of the authors. We argue the latter has better high energy behavior and is connected to existing open-systems approaches. - Highlights: → We prove the local equivalence of two damped harmonic oscillator models. → We find different high energy behaviors between the two models. → Based on the local equivalence, we make a simple construction of the coherent states.
Constitutive and life modeling of single crystal blade alloys for root attachment analysis
Meyer, T. G.; Mccarthy, G. J.; Favrow, L. H.; Anton, D. L.; Bak, Joe
1988-01-01
Work to develop fatigue life prediction and constitutive models for uncoated attachment regions of single crystal gas turbine blades is described. At temperatures relevant to attachment regions, deformation is dominated by slip on crystallographic planes. However, fatigue crack initiation and early crack growth are not always observed to be crystallographic. The influence of natural occurring microporosity will be investigated by testing both hot isostatically pressed and conventionally cast PWA 1480 single crystal specimens. Several differnt specimen configurations and orientations relative to the natural crystal axes are being tested to investigate the influence of notch acuity and the material's anisotropy. Global and slip system stresses in the notched regions were determined from three dimensional stress analyses and will be used to develop fatigue life prediction models consistent with the observed lives and crack characteristics.
Kinetic characteristics of crystallization from model solutions of the oral cavity
Golovanova, O. A.; Chikanova, E. S.
2015-11-01
The kinetic regularities of crystallization from model solutions of the oral cavity are investigated and the growth order and constants are determined for two systems: saliva and dental plaque fluid (DPF). It is found that the stage in which the number of particles increases occurs in the range of mixed kinetics and their growth occurs in the diffusion range. The enhancing effect of additives HCO- 3 > C6H12O6 > F- and the retarding effect of Mg2+ are demonstrated. The HCO- 3 and Mg2+ additives, taken in high concentrations, affect the corresponding rate constants. It is revealed the crystallization in DPF is favorable for the growth of small crystallites, while the model solution of saliva is, vice versa, favorable for the growth of larger crystals.
Low-Temperature Crystal Structures of the Hard Core Square Shoulder Model
Directory of Open Access Journals (Sweden)
Alexander Gabriëlse
2017-11-01
Full Text Available In many cases, the stability of complex structures in colloidal systems is enhanced by a competition between different length scales. Inspired by recent experiments on nanoparticles coated with polymers, we use Monte Carlo simulations to explore the types of crystal structures that can form in a simple hard-core square shoulder model that explicitly incorporates two favored distances between the particles. To this end, we combine Monte Carlo-based crystal structure finding algorithms with free energies obtained using a mean-field cell theory approach, and draw phase diagrams for two different values of the square shoulder width as a function of the density and temperature. Moreover, we map out the zero-temperature phase diagram for a broad range of shoulder widths. Our results show the stability of a rich variety of crystal phases, such as body-centered orthogonal (BCO lattices not previously considered for the square shoulder model.
Energy Technology Data Exchange (ETDEWEB)
Matyáš, Josef; Gervasio, Vivianaluxa; Sannoh, Sulaiman E.; Kruger, Albert A.
2017-11-01
The effectiveness of HLW vitrification is limited by precipitation/accumulation of spinel crystals [(Fe, Ni, Mn, Zn)(Fe, Cr)2O4] in the glass discharge riser of Joule-heated ceramic melters during idling. These crystals do not affect glass durability; however, if accumulated in thick layer, they can clog the melter and prevent discharge of molten glass into canisters. To address this problem, an empirical model was developed that can predict thicknesses of accumulated layers as a function of glass composition. This model predicts well the accumulation of single crystals and/or small-scale agglomerates, but, excessive agglomeration observed in high-Ni-Fe glass resulted in an under-prediction of accumulated layers, which gradually worsen over time as an increased number of agglomerates formed. Accumulation rate of ~53.8 ± 3.7 µm/h determined for this glass will result in ~26 mm thick layer in 20 days of melter idling.
Harmonic Distortion of Rectifier Topologies for Adjustable Speed Drives
DEFF Research Database (Denmark)
Hansen, Steffan
This thesis deals with the harmonic distortion of the diode rectifier and a number of alternative rectifier topologies for adjustable speed drives. The main intention of this thesis is to provide models and tools that allow easy prediction of the harmonic distortion of ASD’s in a given system...... rectifier are presented. The first level is an ideal model where the diode rectifier basically is treated as an independent (harmonic) current source. The second level is an empirical model, where simulated (or measured) values of the harmonic currents of the diode rectifier for different parameters......-angle of the individual harmonic currents of different diode rectifier types is analyzed. Four selected rectifier topologies with a high input power factor are presented. It is shown that using ac- or dc-coils is a very simple and efficient method to reduce the harmonic currents compared to the basic diode rectifier...
Modelling of ion implantation in SiC crystals
Energy Technology Data Exchange (ETDEWEB)
Chakarov, Ivan [SILVACO International, 4701 Patrick Henry Drive, Building 2, Santa Clara, CA 95054 (United States)]. E-mail: ivan.chakarov@silvaco.com; Temkin, Misha [SILVACO International, 4701 Patrick Henry Drive, Building 2, Santa Clara, CA 95054 (United States)
2006-01-15
An advanced electronic stopping model for ion implantation in SiC has been implemented within the binary collision approximation. The model has been thoroughly tested and validated for Al implantation into 4H-, 6H-SiC under different initial implant conditions. A very good agreement between calculated and experimental profiles has been achieved. The model has been integrated in an industrial technology CAD process simulator.
Modelling of ion implantation in SiC crystals
International Nuclear Information System (INIS)
Chakarov, Ivan; Temkin, Misha
2006-01-01
An advanced electronic stopping model for ion implantation in SiC has been implemented within the binary collision approximation. The model has been thoroughly tested and validated for Al implantation into 4H-, 6H-SiC under different initial implant conditions. A very good agreement between calculated and experimental profiles has been achieved. The model has been integrated in an industrial technology CAD process simulator
LIQUIDUS TEMPERATURE AND ONE PERCENT CRYSTAL CONTENT MODELS FOR INITIAL HANFORD HLW GLASSES
International Nuclear Information System (INIS)
Vienna, John D.; Edwards, Tommy B.; Crum, Jarrod V.; Kim, Dong-Sang; Peeler, David K.
2005-01-01
Preliminary models for liquidus temperature (TL) and temperature at 1 vol% crystal (T01) applicable to WTP HLW glasses in the spinel primary phase field were developed. A series of literature model forms were evaluated using consistent sets of data form model fitting and validation. For TL, the ion potential and linear mixture models performed best, while for T01 the linear mixture model out performed all other model forms. TL models were able to predict with smaller uncertainty. However, the lower T01 values (even with higher prediction uncertainties) were found to allow for a much broader processing envelope for WTP HLW glasses
Substructure based modeling of nickel single crystals cycled at low plastic strain amplitudes
Zhou, Dong
In this dissertation a meso-scale, substructure-based, composite single crystal model is fully developed from the simple uniaxial model to the 3-D finite element method (FEM) model with explicit substructures and further with substructure evolution parameters, to simulate the completely reversed, strain controlled, low plastic strain amplitude cyclic deformation of nickel single crystals. Rate-dependent viscoplasticity and Armstrong-Frederick type kinematic hardening rules are applied to substructures on slip systems in the model to describe the kinematic hardening behavior of crystals. Three explicit substructure components are assumed in the composite single crystal model, namely "loop patches" and "channels" which are aligned in parallel in a "vein matrix," and persistent slip bands (PSBs) connected in series with the vein matrix. A magnetic domain rotation model is presented to describe the reverse magnetostriction of single crystal nickel. Kinematic hardening parameters are obtained by fitting responses to experimental data in the uniaxial model, and the validity of uniaxial assumption is verified in the 3-D FEM model with explicit substructures. With information gathered from experiments, all control parameters in the model including hardening parameters, volume fraction of loop patches and PSBs, and variation of Young's modulus etc. are correlated to cumulative plastic strain and/or plastic strain amplitude; and the whole cyclic deformation history of single crystal nickel at low plastic strain amplitudes is simulated in the uniaxial model. Then these parameters are implanted in the 3-D FEM model to simulate the formation of PSB bands. A resolved shear stress criterion is set to trigger the formation of PSBs, and stress perturbation in the specimen is obtained by several elements assigned with PSB material properties a priori. Displacement increment, plastic strain amplitude control and overall stress-strain monitor and output are carried out in the user
Harmonization versus Mutual Recognition
DEFF Research Database (Denmark)
Jørgensen, Jan Guldager; Schröder, Philipp
The present paper examines trade liberalization driven by the coordination of product standards. For oligopolistic firms situated in separate markets that are initially sheltered by national standards, mutual recognition of standards implies entry and reduced profits at home paired with the oppor......The present paper examines trade liberalization driven by the coordination of product standards. For oligopolistic firms situated in separate markets that are initially sheltered by national standards, mutual recognition of standards implies entry and reduced profits at home paired...... countries and three firms, where firms first lobby for the policy coordination regime (harmonization versus mutual recognition), and subsequently, in case of harmonization, the global standard is auctioned among the firms. We discuss welfare effects and conclude with policy implications. In particular......, harmonized standards may fail to harvest the full pro-competitive effects from trade liberalization compared to mutual recognition; moreover, the issue is most pronounced in markets featuring price competition....
Second harmonic generation imaging
2013-01-01
Second-harmonic generation (SHG) microscopy has shown great promise for imaging live cells and tissues, with applications in basic science, medical research, and tissue engineering. Second Harmonic Generation Imaging offers a complete guide to this optical modality, from basic principles, instrumentation, methods, and image analysis to biomedical applications. The book features contributions by experts in second-harmonic imaging, including many pioneering researchers in the field. Written for researchers at all levels, it takes an in-depth look at the current state of the art and possibilities of SHG microscopy. Organized into three sections, the book: Provides an introduction to the physics of the process, step-by-step instructions on how to build an SHG microscope, and comparisons with related imaging techniques Gives an overview of the capabilities of SHG microscopy for imaging tissues and cells—including cell membranes, muscle, collagen in tissues, and microtubules in live cells—by summarizing experi...
Bennett, Charles L.
2016-03-22
A reciprocating-piston uniflow engine includes a harmonic oscillator inlet valve capable of oscillating at a resonant frequency for controlling the flow of working fluid into the engine. In particular, the inlet valve includes an inlet valve head and a spring arranged together as a harmonic oscillator so that the inlet valve head is moveable from an unbiased equilibrium position to a biased closed position occluding an inlet. When released, the inlet valve head undergoes a single oscillation past the equilibrium position to a maximum open position and returns to a biased return position close to the closed position to choke the flow and produce a pressure drop across the inlet valve causing the inlet valve to close. In other embodiments, the harmonic oscillator arrangement of the inlet valve enables the uniflow engine to be reversibly operated as a uniflow compressor.
International Nuclear Information System (INIS)
Au, R.; Fowler, M.; Hanawa, H.; Riedel, J.; Qua, Z.G.
1984-01-01
In early 1983 it was decided to mount coils on arms separated by 120 degrees and buck them out so that the third harmonic dphi/dt component would be cancelled and thus the first and second field harmonics could be very accurately measured. The original intention was to do as others had done, namely, use fast ADC's to read the voltages, and computer process the result to get the Fourier components. However, because of the 100 to 1 dynamic range of the fast ADC's and the likelihood that noise would be a problem, the authors decided to do things differently. Using a fast Fourier transform analyzer was considered, but this instrument is very expensive, so they decided to use a completely electronic analog approach: The authors decided to use active bandpass filters to render the harmonic components
Effects of rotation on crystal settling in a terrestrial magma ocean: Spherical shell model
Maas, C.; Hansen, U.
2015-12-01
Like Moon or Mars, Earth experienced one or several deep magma ocean periods of globalextent in a later stage of its accretion. The crystallization of these magma oceans is of keyimportance for the chemical structure of Earth, the mantle evolution and the onset of platetectonics. Due to the fast rotation of early Earth and the small magma viscosity, rotationprobably had a profound effect on differentiation processes. For example, Matyska et al.[1994] propose that the distribution of heterogeneities like the two large low shear velocityprovinces (LLSVP) at the core mantle boundary is influenced by rotational dynamicsof early Earth. Further Garnero and McNamara [2008] suggest that the LLSVPs arevery long-living anomalies, probably reaching back to the time of differentiation andsolidification of Earth. However, nearly all previous studies neglect the effects of rotation.In our previous work using a Cartesian model, a strong influence of rotation as well asof latitude on the differentiation processes in an early magma ocean was revealed. Weshowed that crystal settling in an early stage of magma ocean crystallization cruciallydepends on latitude as well as on rotational strength and crystal density.In order to overcome the restrictions as to the geometry of the Cartesian model, we arecurrently developing a spherical model to simulate crystal settling in a rotating sphericalshell. This model will allow us not only to investigate crystal settling at the poles andthe equator, but also at latitudes in-between these regions, as well as the migration ofcrystals between poles and equator. ReferencesE. J. Garnero and A. K. McNamara. Structure and dynamics of earth's lower mantle.Science, 320(5876):626-628, 2008.C. Matyska, J. Moser, and D. A. Yuen. The potential influence of radiative heat transferon the formation of megaplumes in the lower mantle. Earth and Planetary ScienceLetters, 125(1):255-266, 1994.
Tellier, Gildas; Boisrobert, Christian
2007-11-01
The Maker fringes technique is commonly used for the determination of nonlinear optical coefficients. In this article, we present a new formulation of Maker fringes in parallel-surface samples, using boundary conditions taking into account the anisotropy of the crystal, the refractive-index dispersion, and the reflections of the fundamental and the second harmonic waves inside the material. Complete expressions for the generated second harmonic intensity are given for birefringent crystals for the case of no pump depletion. A comparison between theory and experimental results is made, showing the accuracy of our theoretical expressions.
Harmonic arbitrary waveform generator
Roberts, Brock Franklin
2017-11-28
High frequency arbitrary waveforms have applications in radar, communications, medical imaging, therapy, electronic warfare, and charged particle acceleration and control. State of the art arbitrary waveform generators are limited in the frequency they can operate by the speed of the Digital to Analog converters that directly create their arbitrary waveforms. The architecture of the Harmonic Arbitrary Waveform Generator allows the phase and amplitude of the high frequency content of waveforms to be controlled without taxing the Digital to Analog converters that control them. The Harmonic Arbitrary Waveform Generator converts a high frequency input, into a precision, adjustable, high frequency arbitrary waveform.
General Criterion for Harmonicity
Proesmans, Karel; Vandebroek, Hans; Van den Broeck, Christian
2017-10-01
Inspired by Kubo-Anderson Markov processes, we introduce a new class of transfer matrices whose largest eigenvalue is determined by a simple explicit algebraic equation. Applications include the free energy calculation for various equilibrium systems and a general criterion for perfect harmonicity, i.e., a free energy that is exactly quadratic in the external field. As an illustration, we construct a "perfect spring," namely, a polymer with non-Gaussian, exponentially distributed subunits which, nevertheless, remains harmonic until it is fully stretched. This surprising discovery is confirmed by Monte Carlo and Langevin simulations.
Layers of Cold Dipolar Molecules in the Harmonic Approximation
DEFF Research Database (Denmark)
R. Armstrong, J.; Zinner, Nikolaj Thomas; V. Fedorov, D.
2012-01-01
We consider the N-body problem in a layered geometry containing cold polar molecules with dipole moments that are polarized perpendicular to the layers. A harmonic approximation is used to simplify the hamiltonian and bound state properties of the two-body inter-layer dipolar potential are used...... to adjust this effective interaction. To model the intra-layer repulsion of the polar molecules, we introduce a repulsive inter-molecule potential that can be parametrically varied. Single chains containing one molecule in each layer, as well as multi-chain structures in many layers are discussed...... and their energies and radii determined. We extract the normal modes of the various systems as measures of their volatility and eventually of instability, and compare our findings to the excitations in crystals. We find modes that can be classified as either chains vibrating in phase or as layers vibrating against...
The synergy of modeling and novel experiments for melt crystal growth research
Derby, Jeffrey J.
2018-05-01
Computational modeling and novel experiments, when performed together, can enable the identification of new, fundamental mechanisms important for the growth of bulk crystals from the melt. In this paper, we present a compelling example of this synergy via the discovery of previously unascertained physical mechanisms that govern the engulfment of silicon carbide particles during the growth of crystalline silicon.
Virtual and Printed 3D Models for Teaching Crystal Symmetry and Point Groups
Casas, Lluís; Estop, Euge`nia
2015-01-01
Both, virtual and printed 3D crystal models can help students and teachers deal with chemical education topics such as symmetry and point groups. In the present paper, two freely downloadable tools (interactive PDF files and a mobile app) are presented as examples of the application of 3D design to study point-symmetry. The use of 3D printing to…
Perturbative modeling of Bragg-grating-based biosensors in photonic-crystal fibers
DEFF Research Database (Denmark)
Burani, Nicola; Lægsgaard, Jesper
2005-01-01
We present a modeling study carried out to support the design of a novel, to our knowledge, kind of photonic-crystal fiber (PCF)-based sensor. This device, based on a PCF Bragg grating, detects the presence of selected single-stranded DNA molecules, hybridized to a biofilm in the air holes of the...
CRYSTAL: A model of a fractured rock geosphere for performance assessment within SKI Project-90
International Nuclear Information System (INIS)
Worgan, K.; Robinson, P.
1992-02-01
A one-dimensional model of a fractured rock geosphere (CRYSTAL) has been developed, which forms part of the toolkit for the Swedish Nuclear Power Inspectorates reference repository performance assessment programme (Project-90). CRYSTAL predicts the transport of arbitrary-length decay chains by advection, diffusion and surface sorption in the fractures and sideways diffusion into the rock matrix. The model equations are solved in Laplace transform space, and inverted numerically to the time domain. This approach avoids time-stepping and consequently is numerically very efficient. The interface of CRYSTAL with the time-series output from a near-field model, such as CALIBRE, is achieved using the method of convolution. The response of the geosphere to delta-function inputs from each nuclide is combined with the time series outputs from the near-field, to obtain the nuclide flux emerging from the far-field. The method is sufficiently flexible to allow for any general time-series input from CALIBRE or any other near-field model. Although CRYSTAL was developed to handle one-dimensional transport in a fractured rock, the equations solved are sufficiently general for it to be used in other applications, e.g. in a porous system. (au)
Non-local crystal plasticity model with intrinsic SSD and GND effects
Evers, L.P.; Brekelmans, W.A.M.; Geers, M.G.D.
2004-01-01
A strain gradient-dependent crystal plasticity approach is presented to model the constitutive behaviour of polycrystal FCC metals under large plastic deformation. In order to be capable of predicting scale dependence, the heterogeneous deformation-induced evolution and distribution of geometrically
Modeling of Thermal Phase Noise in a Solid Core Photonic Crystal Fiber-Optic Gyroscope.
Song, Ningfang; Ma, Kun; Jin, Jing; Teng, Fei; Cai, Wei
2017-10-26
A theoretical model of the thermal phase noise in a square-wave modulated solid core photonic crystal fiber-optic gyroscope has been established, and then verified by measurements. The results demonstrate a good agreement between theory and experiment. The contribution of the thermal phase noise to the random walk coefficient of the gyroscope is derived. A fiber coil with 2.8 km length is used in the experimental solid core photonic crystal fiber-optic gyroscope, showing a random walk coefficient of 9.25 × 10 -5 deg/√h.
Experimental investigation and crystal-field modeling of Er{sup 3+} energy levels in GSGG crystal
Energy Technology Data Exchange (ETDEWEB)
Gao, J.Y., E-mail: jygao1985@sina.com [Anhui Institute of Optics and Fine Mechanics, Chinese Academy of Sciences, Hefei 230031 (China); Sun, D.L.; Zhang, Q.L. [Anhui Institute of Optics and Fine Mechanics, Chinese Academy of Sciences, Hefei 230031 (China); Wang, X.F. [Anhui Institute of Optics and Fine Mechanics, Chinese Academy of Sciences, Hefei 230031 (China); Graduate School of the Chinese Academy of Sciences, Beijing 100049 (China); Liu, W.P.; Luo, J.Q.; Sun, G.H.; Yin, S.T. [Anhui Institute of Optics and Fine Mechanics, Chinese Academy of Sciences, Hefei 230031 (China)
2016-06-25
The Er{sup 3+}-doped Gd{sub 3}Sc{sub 2}Ga{sub 3}O{sub 12} (Er{sup 3+}:GSGG) single crystal, a excellent medium of the mid-infrared and anti-radiation solid state laser pumped by laser diode, was grown by Czochralski method successfully. The absorption spectra were measured and analyzed in a wider spectral wavelength range of 350–1700 nm at different temperatures of 7.6, 77, 200 and 300 K. The free-ions and crystal-field parameters were fitted to the experimental energy levels with the root mean square deviation of 9.86 cm{sup −1}. According to the crystal-field calculations, 124 degenerate energy levels of Er{sup 3+} in GSGG host crystals were assigned. The fitting results of free-ions and crystal-field parameters were compared with those already reported of Er{sup 3+}:YSGG. The results indicated that the free-ions parameters for Er{sup 3+} in GSGG host are similar to those in YSGG host crystals, and the crystal-field interaction of GSGG is weaker than that of YSGG, which may result in the better laser characterization of Er{sup 3+}:GSGG crystal. - Highlights: • The efficient diode-end-pumped laser crystal Er:GSGG has been grown successfully. • The absorption spectra of Er:GSGG have been measured in range of 350–1700 nm. • The fitting result is very well for the root mean square deviation is 9.86 cm{sup −1}. • The 124 levels of Er:GSGG have been assigned from the crystal-field calculations.
Tricritical behavior in the diluted transverse spin-1 Ising model with a longitudinal crystal field
International Nuclear Information System (INIS)
Htoutou, K.; Oubelkacem, A.; Ainane, A.; Saber, M.
2005-01-01
The transverse spin-1 Ising model with a longitudinal crystal field exhibits a tricritical behavior. Within the effective field theory with a probability distribution technique that accounts for the self-spin correlations, we have studied the influence of site dilution on this behavior and have calculated the temperature-transverse field-longitudinal crystal field-concentration phase diagrams and determined, in particular, the influence of the concentration of magnetic atoms c on the tricritical behavior. We have found that the tricritical point appears for large values of the concentration c of magnetic atoms and disappears with the increase in dilution (small values of c). Results for square lattice are calculated numerically and some interesting results are obtained. In certain ranges of values of the strength of the longitudinal crystal field D/J when it becomes sufficiently negative, we found re-entrant phenomenon, which disappears with increase in the value of the strength of the transverse field
The study of the elasticity of spider dragline silk with liquid crystal model
International Nuclear Information System (INIS)
Cui Linying; Liu Fei; Ouyang Zhongcan
2009-01-01
Spider dragline silk is an optimal biomaterial with a combination of high tensile strength and high elasticity, and it has long been suggested to belong to liquid crystalline materials. However, a satisfactory liquid crystal description for the mechanical properties of the dragline is still missing. To solve the long existing problem, we generalized the Maier-Saupe theory of nematics to construct a liquid crystal model of the deformation mechanism of the dragline silk. We show that the remarkable elasticity of the dragline can be understood as the isotropic-nematic phase transition of the chain network with the beginning of the transition corresponding to the yield point. The calculated curve fits well with the measurements and the yield point is obtained self-consistently within our framework. The present theory can also qualitatively account for the drop of stress in supercontracted spider silk. All these comprehensive agreements between theory and experiments strongly indicate the dragline to belong to liquid crystal materials.
Comparing Harmonic Similarity Measures
de Haas, W.B.; Robine, M.; Hanna, P.; Veltkamp, R.C.; Wiering, F.
2010-01-01
We present an overview of the most recent developments in polyphonic music retrieval and an experiment in which we compare two harmonic similarity measures. In contrast to earlier work, in this paper we specifically focus on the symbolic chord description as the primary musical representation and
DEFF Research Database (Denmark)
Nielsen, Jesper Kjær; Jensen, Tobias Lindstrøm; Jensen, Jesper Rindom
2017-01-01
-robust to noise, or very computationally inten- sive. In this paper, we propose a fast algorithm for the harmonic chirp summation method which has been demonstrated in the liter- ature to be accurate and robust to noise. The proposed algorithm is orders of magnitudes faster than previous algorithms which is also...
Harmonically excited orbital variations
International Nuclear Information System (INIS)
Morgan, T.
1985-01-01
Rephrasing the equations of motion for orbital maneuvers in terms of Lagrangian generalized coordinates instead of Newtonian rectangular cartesian coordinates can make certain harmonic terms in the orbital angular momentum vector more readily apparent. In this formulation the equations of motion adopt the form of a damped harmonic oscillator when torques are applied to the orbit in a variationally prescribed manner. The frequencies of the oscillator equation are in some ways unexpected but can nonetheless be exploited through resonant forcing functions to achieve large secular variations in the orbital elements. Two cases are discussed using a circular orbit as the control case: (1) large changes in orbital inclination achieved by harmonic excitation rather than one impulsive velocity change, and (2) periodic and secular changes to the longitude of the ascending node using both stable and unstable excitation strategies. The implications of these equations are also discussed for both artificial satellites and natural satellites. For the former, two utilitarian orbits are suggested, each exploiting a form of harmonic excitation. 5 refs
Gluck, P.; Krakower, Zeev
2010-01-01
We present a unit comprising theory, simulation and experiment for a body oscillating on a vertical spring, in which the simultaneous use of a force probe and an ultrasonic range finder enables one to explore quantitatively and understand many aspects of simple and damped harmonic motions. (Contains 14 figures.)
Modelling of creep curves of Ni3Ge single crystals
Starenchenko, V. A.; Starenchenko, S. V.; Pantyukhova, O. D.; Solov'eva, Yu V.
2015-01-01
In this paper the creep model of alloys with L12 superstructure is presented. The creep model is based on the idea of the mechanisms superposition connected with the different elementary deformation processes. Some of them are incident to the ordered structure L12 (anomalous mechanisms), others are typical to pure metals with the fcc structure (normal mechanisms): the accumulation of thermal APBs by means of the intersection of moving dislocations; the formation of APB tubes; the multiplication of superdislocations; the movement of single dislocations; the accumulation of point defects, such as vacancies and interstitial atoms; the accumulation APBs at the climb of edge dislocations. This model takes into account the experimental facts of the wetting antiphase boundaries and emergence of the disordered phase within the ordered phase. The calculations of the creep curves are performed under different conditions. This model describes different kinds of the creep curves and demonstrates the important meaning of the deformation superlocalisation leading to the inverse creep. The experimental and theoretical results coincide rather well.
Evolution of the Bangalore ICT Cluster: The "Crystal Growth" Model
Manimala, Mathew J.
2006-01-01
In about twenty years, starting in 1984, Bangalore has become the fourth best "Global Hub of Technological Innovation", according to Business Week. This article reviews the major milestones in Bangalore's development and the interactive roles of government, universities and private entrepreneurs. The author offers a new model: innovation…
Second-harmonic generation in substoichiometric silicon nitride layers
Pecora, Emanuele; Capretti, Antonio; Miano, Giovanni; Dal Negro, Luca
2013-03-01
Harmonic generation in optical circuits offers the possibility to integrate wavelength converters, light amplifiers, lasers, and multiple optical signal processing devices with electronic components. Bulk silicon has a negligible second-order nonlinear optical susceptibility owing to its crystal centrosymmetry. Silicon nitride has its place in the microelectronic industry as an insulator and chemical barrier. In this work, we propose to take advantage of silicon excess in silicon nitride to increase the Second Harmonic Generation (SHG) efficiency. Thin films have been grown by reactive magnetron sputtering and their nonlinear optical properties have been studied by femtosecond pumping over a wide range of excitation wavelengths, silicon nitride stoichiometry and thermal processes. We demonstrate SHG in the visible range (375 - 450 nm) using a tunable 150 fs Ti:sapphire laser, and we optimize the SH emission at a silicon excess of 46 at.% demonstrating a maximum SHG efficiency of 4x10-6 in optimized films. Polarization properties, generation efficiency, and the second order nonlinear optical susceptibility are measured for all the investigated samples and discussed in terms of an effective theoretical model. Our findings show that the large nonlinear optical response demonstrated in optimized Si-rich silicon nitride materials can be utilized for the engineering of nonlinear optical functions and devices on a Si chip.
Numerical modelling of micro-machining of f.c.c. single crystal: Influence of strain gradients
Demiral, Murat
2014-11-01
A micro-machining process becomes increasingly important with the continuous miniaturization of components used in various fields from military to civilian applications. To characterise underlying micromechanics, a 3D finite-element model of orthogonal micro-machining of f.c.c. single crystal copper was developed. The model was implemented in a commercial software ABAQUS/Explicit employing a user-defined subroutine VUMAT. Strain-gradient crystal-plasticity and conventional crystal-plasticity theories were used to demonstrate the influence of pre-existing and evolved strain gradients on the cutting process for different combinations of crystal orientations and cutting directions. Crown Copyright © 2014.
Phase field modeling of rapid crystallization in the phase-change material AIST
Tabatabaei, Fatemeh; Boussinot, Guillaume; Spatschek, Robert; Brener, Efim A.; Apel, Markus
2017-07-01
We carry out phase field modeling as a continuum simulation technique in order to study rapid crystallization processes in the phase-change material AIST (Ag4In3Sb67Te26). In particular, we simulate the spatio-temporal evolution of the crystallization of a molten area of the phase-change material embedded in a layer stack. The simulation model is adapted to the experimental conditions used for recent measurements of crystallization rates by a laser pulse technique. Simulations are performed for substrate temperatures close to the melting temperature of AIST down to low temperatures when an amorphous state is involved. The design of the phase field model using the thin interface limit allows us to retrieve the two limiting regimes of interface controlled (low temperatures) and thermal transport controlled (high temperatures) dynamics. Our simulations show that, generically, the crystallization velocity presents a maximum in the intermediate regime where both the interface mobility and the thermal transport, through the molten area as well as through the layer stack, are important. Simulations reveal the complex interplay of all different contributions. This suggests that the maximum switching velocity depends not only on material properties but also on the precise design of the thin film structure into which the phase-change material is embedded.
A continuum model for the anisotropic creep of single crystal nickel-based superalloys
International Nuclear Information System (INIS)
Prasad, Sharat C.; Rajagopal, K.R.; Rao, I.J.
2006-01-01
In this paper, we extend the constitutive theory developed by Prasad et al. [Prasad SC, Rao IJ, Rajagopal KR. A continuum model for the creep of single crystal nickel-base superalloys. Acta Mater 2005;53(3):669-79], to describe the creep anisotropy associated with crystallographic orientation in single crystal nickel-based superalloys. The constitutive theory is cast within a general thermodynamic framework that has been developed to describe the response of materials capable of existing in multiple stress free configurations ('natural configurations'). Central to the theory is the prescription of the forms for the stored energy and rate of dissipation functions. The stored energy reflects the fact that the elastic response exhibits cubic symmetry. The model takes into account the fact that the symmetry of single crystals does not change with inelastic deformation. The rate of dissipation function is also chosen to be anisotropic, in that it reflects invariance to transformations that belong to the cubic symmetry group. The model is used to simulate uniaxial creep of single crystal nickel-based superalloy CMSX-4 for loading along the , and orientations. The predictions of the theory agree well with the experimental data
Bajul, Audrey; Gerbaud, Vincent; Teychene, Sébastien; Devatine, Audrey; Bajul, Gilles
2017-08-01
Instability in bottled wines refer to tartaric salts crystallization such as potassium bitartrate (KHT). It is not desirable as consumers see the settled salts as an evidence of a poor quality control. In some cases, it causes excessive gushing in sparkling wine. We investigate the effect of two oenological carboxymethylcellulose (CMC) for KHT inhibition in a model solution of white wine by studying the impact of some properties of CMC such as the degree of polymerization, the degree of substitution, and the apparent dissociation constant determined by potentiometric titration. Polyelectrolyte adsorption is used for determining the surface and total charge and for providing information about the availability of CMC charged groups for interacting with KHT crystal faces. The inhibitory efficiency of CMC on model solution is evaluated by measuring the induction time with the help of conductimetric methods. Crystals growth with and without CMC are studied by observation with MEB and by thermal analysis using DSC. The results confirm the effectiveness of CMC as an inhibitor of KHT crystallization in a model solution. The main hypothesis of the mechanism lies in the interaction of dissociated anionic carboxymethyl groups along the cellulose backbone with positively charged layers on KHT faces like the {0 1 0} face. Key factors such as pH, CMC chain length and total charge are discusses.
Energy Technology Data Exchange (ETDEWEB)
Fan, Ya-Nan, E-mail: fanyn12@mails.tsinghua.edu.cn; Shi, Hui-Ji, E-mail: shihj@mail.tsinghua.edu.cn; Qiu, Wen-Hui
2015-09-17
Rafting and creep modeling of single crystal superalloys at high temperatures are important for the safety assessment and life prediction in practice. In this research, a new model has been developed to describe the rafting evolution and incorporated into the Cailletaud single crystal plasticity model to simulate the creep behavior. The driving force of rafting is assumed to be the relaxation of the strain energy, and it is calculated with the local stress state, a superposition of the external and misfit stress tensors. In addition, the isotropic coarsening is introduced by the cube root dependence of the microstructure periodicity on creep time based on Ostwal ripening. Then the influence of rafting on creep deformation is taken into account as the Orowan stress in the single crystal plasticity model. The capability of the proposed model is validated with creep experiments of CMSX-4 at 950 °C and 1050 °C. It is able to predict the rafting direction at complex loading conditions and evaluate the channel width during rafting. For [001] tensile creep tests, good agreement has been shown between the model predictions and experimental results at different temperatures and stress levels. The creep acceleration can be captured with this model and is attributed to the microstructure degradation caused by the precipitate coarsening.
A numerical model including PID control of a multizone crystal growth furnace
Panzarella, Charles H.; Kassemi, Mohammad
1992-01-01
This paper presents a 2D axisymmetric combined conduction and radiation model of a multizone crystal growth furnace. The model is based on a programmable multizone furnace (PMZF) designed and built at NASA Lewis Research Center for growing high quality semiconductor crystals. A novel feature of this model is a control algorithm which automatically adjusts the power in any number of independently controlled heaters to establish the desired crystal temperatures in the furnace model. The control algorithm eliminates the need for numerous trial and error runs previously required to obtain the same results. The finite element code, FIDAP, used to develop the furnace model, was modified to directly incorporate the control algorithm. This algorithm, which presently uses PID control, and the associated heat transfer model are briefly discussed. Together, they have been used to predict the heater power distributions for a variety of furnace configurations and desired temperature profiles. Examples are included to demonstrate the effectiveness of the PID controlled model in establishing isothermal, Bridgman, and other complicated temperature profies in the sample. Finally, an example is given to show how the algorithm can be used to change the desired profile with time according to a prescribed temperature-time evolution.
Energy Technology Data Exchange (ETDEWEB)
Lim, Hojun [Sandia National Lab. (SNL-NM), Albuquerque, NM (United States); Owen, Steven J. [Sandia National Lab. (SNL-NM), Albuquerque, NM (United States); Abdeljawad, Fadi F. [Sandia National Lab. (SNL-NM), Albuquerque, NM (United States); Hanks, Byron [Sandia National Lab. (SNL-NM), Albuquerque, NM (United States); Battaile, Corbett Chandler [Sandia National Lab. (SNL-NM), Albuquerque, NM (United States)
2015-09-01
In order to better incorporate microstructures in continuum scale models, we use a novel finite element (FE) meshing technique to generate three-dimensional polycrystalline aggregates from a phase field grain growth model of grain microstructures. The proposed meshing technique creates hexahedral FE meshes that capture smooth interfaces between adjacent grains. Three dimensional realizations of grain microstructures from the phase field model are used in crystal plasticity-finite element (CP-FE) simulations of polycrystalline a -iron. We show that the interface conformal meshes significantly reduce artificial stress localizations in voxelated meshes that exhibit the so-called "wedding cake" interfaces. This framework provides a direct link between two mesoscale models - phase field and crystal plasticity - and for the first time allows mechanics simulations of polycrystalline materials using three-dimensional hexahedral finite element meshes with realistic topological features.
Liu, Feng; Chen, Long; Rao, Hui-Ying; Teng, Xiao; Ren, Ya-Yun; Lu, Yan-Qiang; Zhang, Wei; Wu, Nan; Liu, Fang-Fang; Wei, Lai
2017-01-01
Animal models provide a useful platform for developing and testing new drugs to treat liver fibrosis. Accordingly, we developed a novel automated system to evaluate liver fibrosis in rodent models. This system uses second-harmonic generation (SHG)/two-photon excited fluorescence (TPEF) microscopy to assess a total of four mouse and rat models, using chemical treatment with either thioacetamide (TAA) or carbon tetrachloride (CCl 4 ), and a surgical method, bile duct ligation (BDL). The results obtained by the new technique were compared with that using Ishak fibrosis scores and two currently used quantitative methods for determining liver fibrosis: the collagen proportionate area (CPA) and measurement of hydroxyproline (HYP) content. We show that 11 shared morphological parameters faithfully recapitulate Ishak fibrosis scores in the models, with high area under the receiver operating characteristic (ROC) curve (AUC) performance. The AUC values of 11 shared parameters were greater than that of the CPA (TAA: 0.758-0.922 vs 0.752-0.908; BDL: 0.874-0.989 vs 0.678-0.966) in the TAA mice and BDL rat models and similar to that of the CPA in the TAA rat and CCl 4 mouse models. Similarly, based on the trends in these parameters at different time points, 9, 10, 7, and 2 model-specific parameters were selected for the TAA rats, TAA mice, CCl 4 mice, and BDL rats, respectively. These parameters identified differences among the time points in the four models, with high AUC accuracy, and the corresponding AUC values of these parameters were greater compared with those of the CPA in the TAA rat and mouse models (rats: 0.769-0.894 vs 0.64-0.799; mice: 0.87-0.93 vs 0.739-0.836) and similar to those of the CPA in the CCl 4 mouse and BDL rat models. Similarly, the AUC values of 11 shared parameters and model-specific parameters were greater than those of HYP in the TAA rats, TAA mice, and CCl 4 mouse models and were similar to those of HYP in the BDL rat models. The automated
Young children's harmonic perception.
Costa-Giomi, Eugenia
2003-11-01
Harmony and tonality are two of the most difficult elements for young children to perceive and manipulate and are seldom taught in the schools until the end of early childhood. Children's gradual harmonic and tonal development has been attributed to their cumulative exposure to Western tonal music and their increasing experiential knowledge of its rules and principles. Two questions that are relevant to this problem are: (1) Can focused and systematic teaching accelerate the learning of the harmonic/tonal principles that seem to occur in an implicit way throughout childhood? (2) Are there cognitive constraints that make it difficult for young children to perceive and/or manipulate certain harmonic and tonal principles? A series of studies specifically addressed the first question and suggested some possible answers to the second one. Results showed that harmonic instruction has limited effects on children's perception of harmony and indicated that the drastic improvement in the perception of implied harmony noted approximately at age 9 is due to development rather than instruction. I propose that young children's difficulty in perceiving implied harmony stems from their attention behaviors. Older children have less memory constraints and more strategies to direct their attention to the relevant cues of the stimulus. Younger children focus their attention on the melody, if present in the stimulus, and specifically on its concrete elements such as rhythm, pitch, and contour rather than its abstract elements such as harmony and key. The inference of the abstract harmonic organization of a melody required in the perception of implied harmony is thus an elusive task for the young child.
Symmetries in physics and harmonics
International Nuclear Information System (INIS)
Kolk, D.
2006-01-01
In this book the symmetries of elementary particles are described in relation to the rules of harmonics in music. The selection rules are described in connections with harmonic intervals. Also symmetry breaking is considered in this framework. (HSI)
On a simple model of the photonic or photonic crystal
International Nuclear Information System (INIS)
Kosevich, A.M.
2001-01-01
A model is proposed for a one-dimensional dielectric or superlattice (SL) that relatively simply describes the frequency spectrum of electromagnetic or acoustic waves. The band frequency spectrum is reduced to minibands contracting with increasing frequency. A procedure is suggested for obtaining local states near a defect in a SL, and the simplest of these states is described. Conditions for the initiation of Bloch oscillations of a wave packet in a SL are discussed
The effect of roughness model on scattering properties of ice crystals
International Nuclear Information System (INIS)
Geogdzhayev, Igor; Diedenhoven, Bastiaan van
2016-01-01
We compare stochastic models of microscale surface roughness assuming uniform and Weibull distributions of crystal facet tilt angles to calculate scattering by roughened hexagonal ice crystals using the geometric optics (GO) approximation. Both distributions are determined by similar roughness parameters, while the Weibull model depends on the additional shape parameter. Calculations were performed for two visible wavelengths (864 nm and 410 nm) for roughness values between 0.2 and 0.7 and Weibull shape parameters between 0 and 1.0 for crystals with aspect ratios of 0.21, 1 and 4.8. For this range of parameters we find that, for a given roughness level, varying the Weibull shape parameter can change the asymmetry parameter by up to about 0.05. The largest effect of the shape parameter variation on the phase function is found in the backscattering region, while the degree of linear polarization is most affected at the side-scattering angles. For high roughness, scattering properties calculated using the uniform and Weibull models are in relatively close agreement for a given roughness parameter, especially when a Weibull shape parameter of 0.75 is used. For smaller roughness values, a shape parameter close to unity provides a better agreement. Notable differences are observed in the phase function over the scattering angle range from 5° to 20°, where the uniform roughness model produces a plateau while the Weibull model does not. - Highlights: • We compare scattering by hexagonal crystals for uniform and Weibull roughness models. • The Weibull shape parameter has a stronger effect on the phase function at backscattering. • DoLP is mostly affected at the side-scattering angles. • For high roughness, the two models are in relatively close agreement for a given roughness. • A plateau from 5° to 20° is observed in the phase function when using the uniform model.
Development of a CE-QUAL-W2 temperature model for Crystal Springs Lake, Portland, Oregon
Buccola, Norman L.; Stonewall, Adam J.
2016-05-19
During summer 2014, lake level, streamflow, and water temperature in and around Crystal Springs Lake in Portland, Oregon, were measured by the U.S. Geological Survey and the City of Portland Bureau of Environmental Services to better understand the effect of the lake on Crystal Springs Creek and Johnson Creek downstream. Johnson Creek is listed as an impaired water body for temperature by the Oregon Department of Environmental Quality (ODEQ), as required by section 303(d) of the Clean Water Act. A temperature total maximum daily load applies to all streams in the Johnson Creek watershed, including Crystal Springs Creek. Summer water temperatures downstream of Crystal Springs Lake and the Golf Pond regularly exceed the ODEQ numeric criterion of 64.4 °F (18.0 °C) for salmonid rearing and migration. To better understand temperature contributions of this system, the U.S. Geological Survey developed two-dimensional hydrodynamic water temperature models of Crystal Springs Lake and the Golf Pond. Model grids were developed to closely resemble the bathymetry of the lake and pond using data from a 2014 survey. The calibrated models simulated surface water elevations to within 0.06 foot (0.02 meter) and outflow water temperature to within 1.08 °F (0.60 °C). Streamflow, water temperature, and lake elevation data collected during summer 2014 supplied the boundary and reference conditions for the model. Measured discrepancies between outflow and inflow from the lake, assumed to be mostly from unknown and diffuse springs under the lake, accounted for about 46 percent of the total inflow to the lake.
Harmonic Patterns in Forex Trading
Nemček, Sebastian
2013-01-01
This diploma thesis is committed to examination of validity of Harmonic Patterns in Forex trading. Scott Carney described existing and introduced new Harmonic Patterns in 1999 in his book Harmonic Trader. These patterns use the Fibonacci principle to analyze price action and to provide both bullish and bearish trading signals. The goal of this thesis is to find out whether harmonic trading strategy on selected pairs is profitable in FX market, which patterns are the most profitable and what i...
Squeezing and entanglement in doubly resonant, type II, second-harmonic generation
DEFF Research Database (Denmark)
Andersen, Ulrik Lund; Buchhave, Preben
2003-01-01
We investigate, theoretically, the generation of bright and vacuum-squeezed light as well as entanglement in intracavity, type II, phase-matched second-harmonic generation. The cavity in which the crystal is embedded is resonant at the fundamental frequency but not at the second-harmonic frequenc...
Coherent harmonic production using a two-section undulator FEL
Energy Technology Data Exchange (ETDEWEB)
Jaroszynski, D.A. [Commissariat a l`Energie, Bruyeres-le-Chatel (France); Prazeres, R.; Glotin, F. [Centre Universitaire Paris-Sud (France)] [and others
1995-12-31
We present measurements and a theoretical analysis of a new method of generating harmonic radiation in a free-electron laser oscillator with a two section undulator in a single optical cavity. To produce coherent harmonic radiation the undulator is arranged so that the downstream undulator section resonance frequency matches a harmonic of the upstream undulator. Both the fundamental and the harmonic optical fields evolve in the same optical cavity and are coupled out with different extraction fractions using a hole in one of the cavity mirrors. We present measurements that show that the optical power at the second and third harmonic can be enhanced by more than an order of magnitude in this fundamental/harmonic configuration. We compare the production of harmonic radiation of a two sectioned fundamental/harmonic undulator with that produced from a FEL operating at its highest efficiency with a step-tapered undulator, where the bunching at the end of the first section is very large. We examine, the dependence of the harmonic power on the intracavity power by adjusting the optical cavity desynchronism, {delta}L. We also examine the evolution of the fundamental and harmonic powers as a function of cavity roundtrip number to evaluate the importance of the small signal gain at the harmonic. We compare our measurements with predictions of a multi-electron numerical model that follows the evolution of fundamental and harmonic power to saturation. This fundamental/harmonic mode, of operation of the FEL may have useful applications in the production of coherent X-ray and VUV radiation, a spectral range where high reflectivity optical cavity mirrors are difficult or impossible to manufacture.
Atto second high harmonic sources
International Nuclear Information System (INIS)
Nam, Chang Hee
2008-01-01
High harmonic generation is a powerful method to produce attosecond pulses. The high harmonics, emitted from atoms driven by intense femtosecond laser pulses, can from an attosecond pulse train with equally spaced harmonic spectrum or an isolated single attosecond pulse with broad continuum spectrum. Using high power femtosecond laser technology developed at CXRC, we have investigated the spectral and temporal characteristics of high harmonics obtained from gaseous atoms. The spectral structure of harmonics could be manipulated by controlling laser chirp, and continuous tuning of harmonic wavelengths was achieved. For rigorous temporal characterization of attosecond harmonic pulses a cross correlation technique was applied to the photoionization process by harmonic and IR femtosecond pulses and achieved the complete temporal reconstruction of attosecond pulse trains, revealing the detailed temporal structure of the attosecond chirp by material dispersion. The duration of attosecond high harmonic pulses is usually much longer than that of transform limited pulses due to the inherent chirp originating from the harmonic generation process. The attosecond chirp compensation in the harmonic generation medium itself was demonstrated, thereby realizing the generation of near transform limited attosecond pulses. The interference of attosecond electron wave packets, generated from an atom by attosecond harmonic pulses, will be also presented
Morozova, K.; Jaeger, R.; Balodis, J.; Kaminskis, J.
2017-10-01
Over several years the Institute of Geodesy and Geoinformatics (GGI) was engaged in the design and development of a digital zenith camera. At the moment the camera developments are finished and tests by field measurements are done. In order to check these data and to use them for geoid model determination DFHRS (Digital Finite element Height reference surface (HRS)) v4.3. software is used. It is based on parametric modelling of the HRS as a continous polynomial surface. The HRS, providing the local Geoid height N, is a necessary geodetic infrastructure for a GNSS-based determination of physcial heights H from ellipsoidal GNSS heights h, by H=h-N. The research and this publication is dealing with the inclusion of the data of observed vertical deflections from digital zenith camera into the mathematical model of the DFHRS approach and software v4.3. A first target was to test out and validate the mathematical model and software, using additionally real data of the above mentioned zenith camera observations of deflections of the vertical. A second concern of the research was to analyze the results and the improvement of the Latvian quasi-geoid computation compared to the previous version HRS computed without zenith camera based deflections of the vertical. The further development of the mathematical model and software concerns the use of spherical-cap-harmonics as the designed carrier function for the DFHRS v.5. It enables - in the sense of the strict integrated geodesy approach, holding also for geodetic network adjustment - both a full gravity field and a geoid and quasi-geoid determination. In addition, it allows the inclusion of gravimetric measurements, together with deflections of the vertical from digital-zenith cameras, and all other types of observations. The theoretical description of the updated version of DFHRS software and methods are discussed in this publication.
Anisotropic Heisenberg model for a semi-infinite crystal
International Nuclear Information System (INIS)
Queiroz, C.A.
1985-11-01
A semi-infinite Heisenberg model with exchange interactions between nearest and next-nearest neighbors in a simple cubic lattice. The free surface from the other layers of magnetic ions, by choosing a single ion uniaxial anisotropy in the surface (Ds) different from the anisotropy in the other layers (D). Using the Green function formalism, the behavior of magnetization as a function of the temperature for each layer, as well as the spectrum localized magnons for several values of ratio Ds/D for surface magnetization. Above this critical ratio, a ferromagnetic surface layer is obtained white the other layers are already in the paramagnetic phase. In this situation the critical temperature of surface becomes larger than the critical temperature of the bulk. (Author) [pt
Second harmonic inversion for ultrasound contrast harmonic imaging
Energy Technology Data Exchange (ETDEWEB)
Pasovic, Mirza; Danilouchkine, Mike; Faez, Telli; Van Neer, Paul L M J; Van der Steen, Antonius F W; De Jong, Nico [THORAXCENTER, Department of Biomedical Engineering Ee2302, Erasmus MC, Rotterdam (Netherlands); Cachard, Christian; Basset, Olivier, E-mail: mirza.pasovic@creatis.insa-lyon.fr [CREATIS-LRMN, Universite de Lyon, INSA-Lyon, Universite Lyon 1, Inserm U630, CNRS UMR 5220 (France)
2011-06-07
Ultrasound contrast agents (UCAs) are small micro-bubbles that behave nonlinearly when exposed to an ultrasound wave. This nonlinear behavior can be observed through the generated higher harmonics in a back-scattered echo. In past years several techniques have been proposed to detect or image harmonics produced by UCAs. In these proposed works, the harmonics generated in the medium during the propagation of the ultrasound wave played an important role, since these harmonics compete with the harmonics generated by the micro-bubbles. We present a method for the reduction of the second harmonic generated during nonlinear-propagation-dubbed second harmonic inversion (SHI). A general expression for the suppression signals is also derived. The SHI technique uses two pulses, p' and p'', of the same frequency f{sub 0} and the same amplitude P{sub 0} to cancel out the second harmonic generated by nonlinearities of the medium. Simulations show that the second harmonic is reduced by 40 dB on a large axial range. Experimental SHI B-mode images, from a tissue-mimicking phantom and UCAs, show an improvement in the agent-to-tissue ratio (ATR) of 20 dB compared to standard second harmonic imaging and 13 dB of improvement in harmonic power Doppler.
Second harmonic inversion for ultrasound contrast harmonic imaging
International Nuclear Information System (INIS)
Pasovic, Mirza; Danilouchkine, Mike; Faez, Telli; Van Neer, Paul L M J; Van der Steen, Antonius F W; De Jong, Nico; Cachard, Christian; Basset, Olivier
2011-01-01
Ultrasound contrast agents (UCAs) are small micro-bubbles that behave nonlinearly when exposed to an ultrasound wave. This nonlinear behavior can be observed through the generated higher harmonics in a back-scattered echo. In past years several techniques have been proposed to detect or image harmonics produced by UCAs. In these proposed works, the harmonics generated in the medium during the propagation of the ultrasound wave played an important role, since these harmonics compete with the harmonics generated by the micro-bubbles. We present a method for the reduction of the second harmonic generated during nonlinear-propagation-dubbed second harmonic inversion (SHI). A general expression for the suppression signals is also derived. The SHI technique uses two pulses, p' and p'', of the same frequency f 0 and the same amplitude P 0 to cancel out the second harmonic generated by nonlinearities of the medium. Simulations show that the second harmonic is reduced by 40 dB on a large axial range. Experimental SHI B-mode images, from a tissue-mimicking phantom and UCAs, show an improvement in the agent-to-tissue ratio (ATR) of 20 dB compared to standard second harmonic imaging and 13 dB of improvement in harmonic power Doppler.
Tunneling ionization and harmonic generation in two-color fields
International Nuclear Information System (INIS)
Kondo, K.; Kobayashi, Y.; Sagisaka, A.; Nabekawa, Y.; Watanabe, S.
1996-01-01
Tunneling ionization and harmonic generation in two-color fields were studied with a fundamental beam (ω) and its harmonics (2ω,3ω), which were generated by a 100-fs Ti:sapphire laser. Ion yields of atoms and molecules were successfully controlled by means of a change in the relative phase between ω and 3ω pulses. Two-color interference was clearly observed in photoelectron spectra and harmonic spectra. In the ω endash 2ω field even-order harmonics were observed in which the intensity was almost equal to that of the odd harmonics because of an asymmetric optical field. These results were compared with the quasi-static model for ionization and with the quantum theory for harmonic generation. copyright 1996 Optical Society of America
Monte Carlo modelling of germanium crystals that are tilted and have rounded front edges
International Nuclear Information System (INIS)
Gasparro, Joel; Hult, Mikael; Johnston, Peter N.; Tagziria, Hamid
2008-01-01
Gamma-ray detection efficiencies and cascade summing effects in germanium detectors are often calculated using Monte Carlo codes based on a computer model of the detection system. Such a model can never fully replicate reality and it is important to understand how various parameters affect the results. This work concentrates on quantifying two issues, namely (i) the effect of having a Ge-crystal that is tilted inside the cryostat and (ii) the effect of having a model of a Ge-crystal with rounded edges (bulletization). The effect of the tilting is very small (in the order of per mille) when the tilting angles are within a realistic range. The effect of the rounded edges is, however, relatively large (5-10% or higher) particularly for gamma-ray energies below 100 keV
Monte Carlo modelling of germanium crystals that are tilted and have rounded front edges
Energy Technology Data Exchange (ETDEWEB)
Gasparro, Joel [EC-JRC-IRMM, Institute for Reference Materials and Measurements, Retieseweg 111, B-2440 Geel (Belgium); Hult, Mikael [EC-JRC-IRMM, Institute for Reference Materials and Measurements, Retieseweg 111, B-2440 Geel (Belgium)], E-mail: mikael.hult@ec.europa.eu; Johnston, Peter N. [Applied Physics, Royal Melbourne Institute of Technology, GPO Box 2476V, Melbourne 3001 (Australia); Tagziria, Hamid [EC-JRC-IPSC, Institute for the Protection and the Security of the Citizen, Via E. Fermi 1, I-21020 Ispra (Vatican City State, Holy See,) (Italy)
2008-09-01
Gamma-ray detection efficiencies and cascade summing effects in germanium detectors are often calculated using Monte Carlo codes based on a computer model of the detection system. Such a model can never fully replicate reality and it is important to understand how various parameters affect the results. This work concentrates on quantifying two issues, namely (i) the effect of having a Ge-crystal that is tilted inside the cryostat and (ii) the effect of having a model of a Ge-crystal with rounded edges (bulletization). The effect of the tilting is very small (in the order of per mille) when the tilting angles are within a realistic range. The effect of the rounded edges is, however, relatively large (5-10% or higher) particularly for gamma-ray energies below 100 keV.
Wallen, Samuel P.
Granular media are one of the most common, yet least understood forms of matter on earth. The difficulties in understanding the physics of granular media stem from the fact that they are typically heterogeneous and highly disordered, and the grains interact via nonlinear contact forces. Historically, one approach to reducing these complexities and gaining new insight has been the study of granular crystals, which are ordered arrays of similarly-shaped particles (typically spheres) in Hertzian contact. Using this setting, past works explored the rich nonlinear dynamics stemming from contact forces, and proposed avenues where such granular crystals could form designer, dynamically responsive materials, which yield beneficial functionality in dynamic regimes. In recent years, the combination of self-assembly fabrication methods and laser ultrasonic experimental characterization have enabled the study of granular crystals at microscale. While our intuition may suggest that these microscale granular crystals are simply scaled-down versions of their macroscale counterparts, in fact, the relevant physics change drastically; for example, short-range adhesive forces between particles, which are negligible at macroscale, are several orders of magnitude stronger than gravity at microscale. In this thesis, we present recent advances in analytical and computational modeling of microscale granular crystals, in particular concerning the interplay of nonlinearity, shear interactions, and particle rotations, which have previously been either absent, or included separately at macroscale. Drawing inspiration from past works on phononic crystals and nonlinear lattices, we explore problems involving locally-resonant metamaterials, nonlinear localized modes, amplitude-dependent energy partition, and other rich dynamical phenomena. This work enhances our understanding of microscale granular media, which may find applicability in fields such as ultrasonic wave tailoring, signal processing
Harmonics in large offshore wind farms
DEFF Research Database (Denmark)
Kocewiak, Lukasz Hubert
and nature of various harmonic components. A comprehensive comparison of harmonic voltages and currents based on probability distribution estimation and appropriate statistics calculation (mean, variance, probability density function, etc.) is applied. Such approach gives a better overview and comparison...... and analysis, and ϐinally ending up on modelling and models application. Different aspects of validation in time domain, frequency domain, and by application of statistical methods are mentioned in relation to respective problems. Measurements constitute a core part in industry-oriented research. Due...... that it is of great importance to know the nature of generated harmonics in large offshore wind farms in order to apply the most suitable data processing technique. Time-frequency analysis based on multiresolution wavelet transform is used in order to perform time-frequency domain analysis helpful to distinguish...
Monte Carlo Modelling of Single-Crystal Diffuse Scattering from Intermetallics
Directory of Open Access Journals (Sweden)
Darren J. Goossens
2016-02-01
Full Text Available Single-crystal diffuse scattering (SCDS reveals detailed structural insights into materials. In particular, it is sensitive to two-body correlations, whereas traditional Bragg peak-based methods are sensitive to single-body correlations. This means that diffuse scattering is sensitive to ordering that persists for just a few unit cells: nanoscale order, sometimes referred to as “local structure”, which is often crucial for understanding a material and its function. Metals and alloys were early candidates for SCDS studies because of the availability of large single crystals. While great progress has been made in areas like ab initio modelling and molecular dynamics, a place remains for Monte Carlo modelling of model crystals because of its ability to model very large systems; important when correlations are relatively long (though still finite in range. This paper briefly outlines, and gives examples of, some Monte Carlo methods appropriate for the modelling of SCDS from metallic compounds, and considers data collection as well as analysis. Even if the interest in the material is driven primarily by magnetism or transport behaviour, an understanding of the local structure can underpin such studies and give an indication of nanoscale inhomogeneity.
Harmonic Analysis and Active Filtering in Offshore Wind Power Plants
DEFF Research Database (Denmark)
Chaudhary, Sanjay Kumar; Freijedo Fernandez, Francisco Daniel; Guerrero, Josep M.
2015-01-01
Due to presence of long high voltage cable networks, and power transformers for the grid connection, the offshore wind power plants (OWPPs) are susceptible to harmonic distortion and resonances. The grid connection of OWPP should not cause the harmonic distortion beyond the permissible limits...... at the point of common coupling (PCC). The resonance conditions should be avoided in all cases. This paper describes the harmonic analysis techniques applied on an OWPP network model. A method is proposed to estimate the harmonic current compensation from a shunt-connected active power filter to mitigate...
Motion of dislocation kinks in a simple model crystal
International Nuclear Information System (INIS)
Koizumi, H.; Suzuki, T.
2005-01-01
To investigate the effects of lattice periodicity on kink motion, a molecular-dynamic simulation for a kink in a screw dislocation has been performed in a simple model lattice of diamond type. The Stillinger-Weber potential is assumed to act between atoms. Under applied stresses larger than 0.0027G, a long distance motion of a kink is possible, where G is the shear modulus. A moving kink emits lattice waves and loses its kinetic energy, which is compensated by the applied stress. The kink attains a terminal velocity after moving a few atomic distances. The kink velocity is not proportional to the applied stress, and exceeds the shear wave velocity when the applied stress is larger than 0.026G. The energy loss of the moving kink is one order of magnitude smaller than that of a moving straight dislocation and is about the same order of magnitude as the theoretical value of phonon-scattering mechanisms at room temperature
Optically induced structural phase transitions in ion Coulomb crystals
DEFF Research Database (Denmark)
Horak, Peter; Dantan, Aurelien Romain; Drewsen, Michael
2012-01-01
We investigate numerically the structural dynamics of ion Coulomb crystals confined in a three-dimensional harmonic trap when influenced by an additional one-dimensional optically induced periodical potential. We demonstrate that transitions between thermally excited crystal structures, such as b......We investigate numerically the structural dynamics of ion Coulomb crystals confined in a three-dimensional harmonic trap when influenced by an additional one-dimensional optically induced periodical potential. We demonstrate that transitions between thermally excited crystal structures...
Anharmonicity and hydrogen bonding in electrooptic sucrose crystal
Szostak, M. M.; Giermańska, J.
1990-03-01
The polarized absorption spectra of the sucrose crystal in the 5300 - 7300 cm -1 region have been measured. The assignments of all the eight OH stretching overtones are proposed and their mechanical anharmonicities are estimated. The discrepancies from the oriented gas model (OGM) in the observed relative band intensities, especially of the -CH vibrations, are assumed to be connected with vibronic couplings enhanced by the helical arrangement of molecules joined by hydrogen bondings. It seems that this kind of interactions might be important for the second harmonic generation (SHG) by the sucrose crystal.
Wolff, Thomas H; Shubin, Carol
2003-01-01
This book demonstrates how harmonic analysis can provide penetrating insights into deep aspects of modern analysis. It is both an introduction to the subject as a whole and an overview of those branches of harmonic analysis that are relevant to the Kakeya conjecture. The usual background material is covered in the first few chapters: the Fourier transform, convolution, the inversion theorem, the uncertainty principle and the method of stationary phase. However, the choice of topics is highly selective, with emphasis on those frequently used in research inspired by the problems discussed in the later chapters. These include questions related to the restriction conjecture and the Kakeya conjecture, distance sets, and Fourier transforms of singular measures. These problems are diverse, but often interconnected; they all combine sophisticated Fourier analysis with intriguing links to other areas of mathematics and they continue to stimulate first-rate work. The book focuses on laying out a solid foundation for fu...
The Harmonization of Accounting
Directory of Open Access Journals (Sweden)
Hajnal Noémi
2017-11-01
Full Text Available The development and configuration of the regulatory framework of the accounting systems in Romania and Hungary took place in different ways. Among the reasons for the diversities in these countries’ accounting systems, the following can be certainly mentioned: different purposes of taxation, legal structure, the accountancy’s connection with the corporate law and family law, diversification on corporate financing policy, and cultural heterogeneity. Both countries quickly caught up with the international accounting harmonization standards. The adaptation of the international accounting standards has many advantages and disadvantages; these have been discussed in several previous researches. This paper aims at comparing the Romanian and Hungarian states’ accounting regulations from the early 1990s, which were implemented in order to harmonize the states’ accountancy regulations with the international standards, and their impact on the economy, based on secondary analysis.
DEFF Research Database (Denmark)
Knudsen, Hans
1995-01-01
A model of the 2×3-phase synchronous machine is presented using a new transformation based on the eigenvectors of the stator inductance matrix. The transformation fully decouples the stator inductance matrix, and this leads to an equivalent diagram of the machine with no mutual couplings...
Harmonic and geometric analysis
Citti, Giovanna; Pérez, Carlos; Sarti, Alessandro; Zhong, Xiao
2015-01-01
This book presents an expanded version of four series of lectures delivered by the authors at the CRM. Harmonic analysis, understood in a broad sense, has a very wide interplay with partial differential equations and in particular with the theory of quasiconformal mappings and its applications. Some areas in which real analysis has been extremely influential are PDE's and geometric analysis. Their foundations and subsequent developments made extensive use of the Calderón–Zygmund theory, especially the Lp inequalities for Calderón–Zygmund operators (Beurling transform and Riesz transform, among others) and the theory of Muckenhoupt weights. The first chapter is an application of harmonic analysis and the Heisenberg group to understanding human vision, while the second and third chapters cover some of the main topics on linear and multilinear harmonic analysis. The last serves as a comprehensive introduction to a deep result from De Giorgi, Moser and Nash on the regularity of elliptic partial differen...
[Harmonization of TSH Measurements.
Takeoka, Keiko; Hidaka, Yoh; Hishinuma, Akira; Ikeda, Katsuyoshi; Okubo, Shigeo; Tsuchiya, Tatsuyuki; Hashiguchi, Teruto; Furuta, Koh; Hotta, Taeko; Matsushita, Kazuyuki; Matsumoto, Hiroyuki; Murakami, Masami; Maekawa, Masato
2016-05-01
The measured concentration of thyroid stimulating hormone (TSH) differs depending on the reagents used. Harmonization of TSH is crucial because the decision limits are described in current clinical practice guide- lines as absolute values, e.g. 2.5 mIU/L in early pregnancy. In this study, we tried to harmonize the report- ed concentrations of TSH using the all-procedure trimmed mean. TSH was measured in 146 serum samples, with values ranging from 0.01 to 18.8 mIU/L, using 4 immunoassays. The concentration of TSH was highest with E test TOSOH and lowest with LUMIPULSE. The concentrations with each reagent were recalculated with the following formulas: E test TOSOH 0.855x-0.014; ECLusys 0.993x+0.079; ARCHITECT 1.041x- 0.010; and LUMIPULSE 1.096x-0.015. Recalculation eliminated the between-assay discrepancy. These formulas may be used until harmonization of TSH is achieved by the International Federation of Clinical Chemistry and Laboratory Medicine (IFCC).
A study of gradient strengthening based on a finite-deformation gradient crystal-plasticity model
Pouriayevali, Habib; Xu, Bai-Xiang
2017-11-01
A comprehensive study on a finite-deformation gradient crystal-plasticity model which has been derived based on Gurtin's framework (Int J Plast 24:702-725, 2008) is carried out here. This systematic investigation on the different roles of governing components of the model represents the strength of this framework in the prediction of a wide range of hardening behaviors as well as rate-dependent and scale-variation responses in a single crystal. The model is represented in the reference configuration for the purpose of numerical implementation and then implemented in the FEM software ABAQUS via a user-defined subroutine (UEL). Furthermore, a function of accumulation rates of dislocations is employed and viewed as a measure of formation of short-range interactions. Our simulation results reveal that the dissipative gradient strengthening can be identified as a source of isotropic-hardening behavior, which may represent the effect of irrecoverable work introduced by Gurtin and Ohno (J Mech Phys Solids 59:320-343, 2011). Here, the variation of size dependency at different magnitude of a rate-sensitivity parameter is also discussed. Moreover, an observation of effect of a distinctive feature in the model which explains the effect of distortion of crystal lattice in the reference configuration is reported in this study for the first time. In addition, plastic flows in predefined slip systems and expansion of accumulation of GNDs are distinctly observed in varying scales and under different loading conditions.
SITE-94. The CRYSTAL Geosphere Transport Model: Technical documentation version 2.1
International Nuclear Information System (INIS)
Worgan, K.; Robinson, P.
1995-12-01
CRYSTAL, a one-dimensional contaminant transport model of a densely fissured geosphere, was originally developed for the SKI Project-90 performance assessment program. It has since been extended to include matrix blocks of alternative basic geometries. CRYSTAL predicts the transport of arbitrary-length decay chains by advection, diffusion and surface sorption in the fissures and diffusion into the rock matrix blocks. The model equations are solved in Laplace transform space, and inverted numerically to the time domain. This approach avoids time-stepping and consequently is numerically very efficient. The source term for crystal may be supplied internally using either simple leaching or band release submodels or by input of a general time-series output from a near-field model. The time series input is interfaced with the geosphere model using the method of convolution. The response of the geosphere to delta-function inputs from each nuclide is combined with the time series outputs from the near-field, to obtain the nuclide flux emerging from the far-field. 14 refs
Konovalov, Y. V.; Nagornov, O. V.
2009-01-01
Different ice thickness distributions along the flow line and the flow line length changes of the Gregoriev Ice Cap, Terskey Ala-Tau, Central Asia, were obtained for some surface mass balance histories which can be considered as possible surface mass balances in the future. The ice cap modeling was performed by solving of steady state hydrodynamic equations in the case of low Reynolds number in the form of the mechanical equilibrium equation in terms of stress deviator components coupled with...
A simple model for localized-itinerant magnetic systems: crystal field effects
International Nuclear Information System (INIS)
Iannarella, L.; Silva, X.A. da; Guimarares, A.P.
1989-01-01
The magnetic behavior of a system consisting of localized electrons coupled to conduction electrons and submitted to an axial crystral field at T=0 K is ivestigated within the framework of the molecular field approximation. An analytical ionic magnetic state equation is deduced; it shows how the magnetization depends on the model parameters (exchange, crystal field, band occupation) and external magnetic field. A condition for the onset of spontaneous magnetic order is obtained and the ferro - and paramagnetic phases are studied. This study displays several features of real magnetic systems, including quenching or total suppression of the magnetic moments (depending on the relative value of the crystal field parameter) and exchange enhacement. The relevance of such model for the description of rare-earth intermetallic compounds is discussed. (author) [pt
The effect of montelukast in a model of gouty arthritis induced by sodium monourate crystals
Ponce, Loida; Arjona, Marjorie; Blanco, Gustavo; Alvarez, Stuart; Arcila, Eduardo; Ortega, Arnaldo; Nuñez, Dubelis; Verzura, Julie; Tovar, Robert; Bethencourt, Sarah; Riera, Ricardo; Mora-Orta, Sioly; Corado, José
2011-01-01
Non-steroidal anti-inflammatory drugs (NSAIDS) are the first line of therapy in acute gouty arthritis. NSAIDs inhibit the cyclooxygenase pathway, but not the lipooxygenase activity and can have many adverse effects and thus have a limited effect on the control of inflammation in this disease. In this work we studied the effect of montelukast on the cellular inflammatory infiltrate in a model of murine arthritis induced by sodium monourate crystals (SMU), using a subcutaneous air cavity (air p...
Validation of a Crystal Plasticity Model Using High Energy Diffraction Microscopy
Beaudoin, A. J.; Obstalecki, M.; Storer, R.; Tayon, W.; Mach, J.; Kenesei, P.; Lienert, U.
2012-01-01
High energy diffraction microscopy is used to measure the crystallographic orientation and evolution of lattice strain in an Al Li alloy. The relative spatial arrangement of the several pancake-shaped grains in a tensile sample is determined through in situ and ex situ techniques. A model for crystal plasticity with continuity of lattice spin is posed, where grains are represented by layers in a finite element mesh following the arrangement indicated by experiment. Comparison is drawn between experiment and simulation.
Ochi, H; Tazuma, S; Kajiyama, G
1996-01-01
The present study was performed to determine whether the degree of lecithin hydrophobicity regulates bile metastability and, therefore, affects the process of cholesterol crystallization. Supersaturated model bile (MB) solutions were prepared with an identical composition on a molar basis (taurocholate/lecithin/cholesterol, 73:19.5:7.5; total lipid concentration 9 g/dl) except for the lecithin species; egg yolk phosphatidylcholine, soybean phosphatidylcholine, 1-palmitoyl-2-linoleoyl-sn-phosp...
A new approach to non-isothermal models for nematic liquid crystals
Czech Academy of Sciences Publication Activity Database
Feireisl, Eduard; Frémond, M.; Rocca, E.; Schimperna, G.
2012-01-01
Roč. 205, č. 2 (2012), s. 651-672 ISSN 0003-9527 R&D Projects: GA ČR GA201/09/0917 Institutional research plan: CEZ:AV0Z10190503 Keywords : liquid crystals * non-isothermal model * flows Subject RIV: BA - General Mathematics Impact factor: 2.292, year: 2012 http://www.springerlink.com/content/cl205h73077jr810/
Degenerate Ising model for atomistic simulation of crystal-melt interfaces
International Nuclear Information System (INIS)
Schebarchov, D.; Schulze, T. P.; Hendy, S. C.
2014-01-01
One of the simplest microscopic models for a thermally driven first-order phase transition is an Ising-type lattice system with nearest-neighbour interactions, an external field, and a degeneracy parameter. The underlying lattice and the interaction coupling constant control the anisotropic energy of the phase boundary, the field strength represents the bulk latent heat, and the degeneracy quantifies the difference in communal entropy between the two phases. We simulate the (stochastic) evolution of this minimal model by applying rejection-free canonical and microcanonical Monte Carlo algorithms, and we obtain caloric curves and heat capacity plots for square (2D) and face-centred cubic (3D) lattices with periodic boundary conditions. Since the model admits precise adjustment of bulk latent heat and communal entropy, neither of which affect the interface properties, we are able to tune the crystal nucleation barriers at a fixed degree of undercooling and verify a dimension-dependent scaling expected from classical nucleation theory. We also analyse the equilibrium crystal-melt coexistence in the microcanonical ensemble, where we detect negative heat capacities and find that this phenomenon is more pronounced when the interface is the dominant contributor to the total entropy. The negative branch of the heat capacity appears smooth only when the equilibrium interface-area-to-volume ratio is not constant but varies smoothly with the excitation energy. Finally, we simulate microcanonical crystal nucleation and subsequent relaxation to an equilibrium Wulff shape, demonstrating the model's utility in tracking crystal-melt interfaces at the atomistic level
Degenerate Ising model for atomistic simulation of crystal-melt interfaces
Energy Technology Data Exchange (ETDEWEB)
Schebarchov, D., E-mail: Dmitri.Schebarchov@gmail.com [University Chemical Laboratories, Lensfield Road, Cambridge CB2 1EW (United Kingdom); Schulze, T. P., E-mail: schulze@math.utk.edu [Department of Mathematics, University of Tennessee, Knoxville, Tennessee 37996-1300 (United States); Hendy, S. C. [The MacDiarmid Institute for Advanced Materials and Nanotechnology, School of Chemical and Physical Sciences, Victoria University of Wellington, Wellington 6140 (New Zealand); Department of Physics, University of Auckland, Auckland 1010 (New Zealand)
2014-02-21
One of the simplest microscopic models for a thermally driven first-order phase transition is an Ising-type lattice system with nearest-neighbour interactions, an external field, and a degeneracy parameter. The underlying lattice and the interaction coupling constant control the anisotropic energy of the phase boundary, the field strength represents the bulk latent heat, and the degeneracy quantifies the difference in communal entropy between the two phases. We simulate the (stochastic) evolution of this minimal model by applying rejection-free canonical and microcanonical Monte Carlo algorithms, and we obtain caloric curves and heat capacity plots for square (2D) and face-centred cubic (3D) lattices with periodic boundary conditions. Since the model admits precise adjustment of bulk latent heat and communal entropy, neither of which affect the interface properties, we are able to tune the crystal nucleation barriers at a fixed degree of undercooling and verify a dimension-dependent scaling expected from classical nucleation theory. We also analyse the equilibrium crystal-melt coexistence in the microcanonical ensemble, where we detect negative heat capacities and find that this phenomenon is more pronounced when the interface is the dominant contributor to the total entropy. The negative branch of the heat capacity appears smooth only when the equilibrium interface-area-to-volume ratio is not constant but varies smoothly with the excitation energy. Finally, we simulate microcanonical crystal nucleation and subsequent relaxation to an equilibrium Wulff shape, demonstrating the model's utility in tracking crystal-melt interfaces at the atomistic level.
International Nuclear Information System (INIS)
March, Norman H.; Akbari, Ali; Rubio, Angel
2007-01-01
For arbitrary interparticle interaction u(r 12 ), the model two-electron atom in the title is shown to be such that the ground-state electron density ρ(r) is determined uniquely by the correlated kinetic energy density t R (r) of the relative motion. Explicit results for t R (r) are presented for the Hookean atom with force constant k=1/4, and also for u(r 12 )=(λ)/(r 12 2 ) . Possible relevance of the Hookean atom treatment to the ground state of the helium atom itself is briefly discussed
A stress-induced phase transition model for semi-crystallize shape memory polymer
Guo, Xiaogang; Zhou, Bo; Liu, Liwu; Liu, Yanju; Leng, Jinsong
2014-03-01
The developments of constitutive models for shape memory polymer (SMP) have been motivated by its increasing applications. During cooling or heating process, the phase transition which is a continuous time-dependent process happens in semi-crystallize SMP and the various individual phases form at different temperature and in different configuration. Then, the transformation between these phases occurred and shape memory effect will emerge. In addition, stress applied on SMP is an important factor for crystal melting during phase transition. In this theory, an ideal phase transition model considering stress or pre-strain is the key to describe the behaviors of shape memory effect. So a normal distributed model was established in this research to characterize the volume fraction of each phase in SMP during phase transition. Generally, the experiment results are partly backward (in heating process) or forward (in cooling process) compared with the ideal situation considering delay effect during phase transition. So, a correction on the normal distributed model is needed. Furthermore, a nonlinear relationship between stress and phase transition temperature Tg is also taken into account for establishing an accurately normal distributed phase transition model. Finally, the constitutive model which taking the stress as an influence factor on phase transition was also established. Compared with the other expressions, this new-type model possesses less parameter and is more accurate. For the sake of verifying the rationality and accuracy of new phase transition and constitutive model, the comparisons between the simulated and experimental results were carried out.
Directory of Open Access Journals (Sweden)
Kryukov Igor Yu.
2017-01-01
Full Text Available Present article is devoted to the development of the mathematical model, which describes thermal state and crystallization process of the rectangular cross-section blank while continious process of extraction from a horysontal continious casting machine (HCCM.The developed model took cue for the heat-transfer properties of non-iron metal teeming; its temperature on entry to the casting mold; cooling conditions of blank in the carbon molds in the presence of a copper water cooler. Besides, has been considered the asymmetry of heat interchange from blank`s head and drag at mold, coming out from fluid contraction and features of the horizontal casting mold. The developed mathematical model allows to determine alterations in crystallizing blank of the following factors with respect to time: temperature pattern of crystallizing blank under different technical working regimes of HCCM; boundaries of solid two-phase field and liquid two-phase filed; blank`s thickness variation under shrinkage of the ingot`s material
Stelian, Carmen; Velázquez, Matias; Veber, Philippe; Ahmine, Abdelmounaim; Sand, Jean-Baptiste; Buşe, Gabriel; Cabane, Hugues; Duffar, Thierry
2018-06-01
Lithium molybdate Li2MoO4 (LMO) crystals of mass ranging between 350 and 500 g are excellent candidates to build heat-scintillation cryogenic bolometers likely to be used for the detection of rare events in astroparticle physics. In this work, numerical modeling is applied in order to investigate the Czochralski growth of Li2MoO4 crystals in an inductive furnace. The numerical model was validated by comparing the numerical predictions of the crystal-melt interface shape to experimental visualization of the growth interface. Modeling was performed for two different Czochralski furnaces that use inductive heating. The simulation of the first furnace, which was used to grow Li2MoO4 crystals of 3-4 cm in diameter, reveals non-optimal heat transfer conditions for obtaining good quality crystals. The second furnace, which will be used to grow crystals of 5 cm in diameter, was numerically optimized in order to reduce the temperature gradients in the crystal and to avoid fast crystallization of the bath at the later stages of the growth process.
Far- and near-field second-harmonic imaging of ferroelectric domain walls
DEFF Research Database (Denmark)
Bozhevolnyi, Sergey I.; Pedersen, K.; Skettrup, Torben
1998-01-01
Domain walls in periodically poled ferroelectric LiNbO3 crystals are observed with both far- and near-field imaging techniques that make use of second harmonic generation in the transition regions between neighbouring domains. Second harmonic images of domain walls represent bright lines of about.......5 micrometers in width (as measured with the near-field microscope) for the polarization of the second harmonic radiation perpendicular to the domain walls. Origin and selection rules for the constrast in second harmonic images of domain walls are discussed....
Resonant second harmonic generation in potassium vapor
International Nuclear Information System (INIS)
Kim, D.; Mullin, C.S.; Shen, Y.R.; Lawrence Berkeley Lab., CA
1995-06-01
Picosecond pulses are used to study resonant second harmonic generation in potassium vapor. Although the process is both microscopically and macroscopically forbidden, it can readily be observed. The results can be quantitatively understood by a multiphoton-ionization-initiated, dc-field-induced, coherent transient model
ACCOUNTING HARMONIZATION AND HISTORICAL COST ACCOUNTING
Directory of Open Access Journals (Sweden)
Valentin Gabriel CRISTEA
2017-05-01
Full Text Available There is a huge interest in accounting harmonization and historical costs accounting, in what they offer us. In this article, different valuation models are discussed. Although one notices the movement from historical cost accounting to fair value accounting, each one has its advantages.
Masek, Pavel; Masek, Jan; Frantik, Petr; Fujdiak, Radek; Ometov, Aleksandr; Hosek, Jiri; Andreev, Sergey; Mlynek, Petr; Misurec, Jiri
2016-11-08
The unprecedented growth of today's cities together with increased population mobility are fueling the avalanche in the numbers of vehicles on the roads. This development led to the new challenges for the traffic management, including the mitigation of road congestion, accidents, and air pollution. Over the last decade, researchers have been focusing their efforts on leveraging the recent advances in sensing, communications, and dynamic adaptive technologies to prepare the deployed road traffic management systems (TMS) for resolving these important challenges in future smart cities. However, the existing solutions may still be insufficient to construct a reliable and secure TMS that is capable of handling the anticipated influx of the population and vehicles in urban areas. Along these lines, this work systematically outlines a perspective on a novel modular environment for traffic modeling, which allows to recreate the examined road networks in their full resemblance. Our developed solution is targeted to incorporate the progress in the Internet of Things (IoT) technologies, where low-power, embedded devices integrate as part of a next-generation TMS. To mimic the real traffic conditions, we recreated and evaluated a practical traffic scenario built after a complex road intersection within a large European city.
Directory of Open Access Journals (Sweden)
Pavel Masek
2016-11-01
Full Text Available The unprecedented growth of today’s cities together with increased population mobility are fueling the avalanche in the numbers of vehicles on the roads. This development led to the new challenges for the traffic management, including the mitigation of road congestion, accidents, and air pollution. Over the last decade, researchers have been focusing their efforts on leveraging the recent advances in sensing, communications, and dynamic adaptive technologies to prepare the deployed road traffic management systems (TMS for resolving these important challenges in future smart cities. However, the existing solutions may still be insufficient to construct a reliable and secure TMS that is capable of handling the anticipated influx of the population and vehicles in urban areas. Along these lines, this work systematically outlines a perspective on a novel modular environment for traffic modeling, which allows to recreate the examined road networks in their full resemblance. Our developed solution is targeted to incorporate the progress in the Internet of Things (IoT technologies, where low-power, embedded devices integrate as part of a next-generation TMS. To mimic the real traffic conditions, we recreated and evaluated a practical traffic scenario built after a complex road intersection within a large European city.
Bile salt-induced cholesterol crystal formation from model bile vesicles: a time course study
van de Heijning, B. J.; Stolk, M. F.; van Erpecum, K. J.; Renooij, W.; Groen, A. K.; vanBerge-Henegouwen, G. P.
1994-01-01
Precipitation of cholesterol crystals from vesicles is an important step in the pathogenesis of cholesterol gallstones. Little is known, however, about the kinetics and the mechanisms involved in cholesterol crystallization. Therefore, the time course of cholesterol crystal precipitation and lipid
DEFF Research Database (Denmark)
Abdul Samad, Noor Asma Fazli Bin; Sin, Gürkan; Gernaey, Krist
2013-01-01
This paper presents the application of uncertainty and sensitivity analysis as part of a systematic modelbased process monitoring and control (PAT) system design framework for crystallization processes. For the uncertainty analysis, the Monte Carlo procedure is used to propagate input uncertainty...
Matyáš, Josef; Gervasio, Vivianaluxa; Sannoh, Sulaiman E.; Kruger, Albert A.
2017-11-01
The effectiveness of high-level waste vitrification at Hanford's Waste Treatment and Immobilization Plant may be limited by precipitation/accumulation of spinel crystals [(Fe, Ni, Mn, Zn)(Fe, Cr)2O4] in the glass discharge riser of Joule-heated ceramic melters during idling. These crystals do not affect glass durability; however, if accumulated in thick layers, they can clog the melter and prevent discharge of molten glass into canisters. To address this problem, an empirical model was developed that can predict thicknesses of accumulated layers as a function of glass composition. This model predicts well the accumulation of single crystals and/or small-scale agglomerates, but excessive agglomeration observed in high-Ni-Fe glass resulted in an underprediction of accumulated layers, which gradually worsened over time as an increased number of agglomerates formed. The accumulation rate of ∼53.8 ± 3.7 μm/h determined for this glass will result in a ∼26 mm-thick layer after 20 days of melter idling.
Energy Technology Data Exchange (ETDEWEB)
Lan, Shuiquan [Department of Mechanical Engineering, Eindhoven University of Technology, Den Dolech 2, 5612AZ Eindhoven (Netherlands); Zondag, Herbert [Department of Mechanical Engineering, Eindhoven University of Technology, Den Dolech 2, 5612AZ Eindhoven (Netherlands); Energy research Center of the Netherlands – ECN, P.O. Box 1, 1755ZG Petten (Netherlands); Steenhoven, Anton van [Department of Mechanical Engineering, Eindhoven University of Technology, Den Dolech 2, 5612AZ Eindhoven (Netherlands); Rindt, Camilo, E-mail: c.c.m.rindt@tue.nl [Department of Mechanical Engineering, Eindhoven University of Technology, Den Dolech 2, 5612AZ Eindhoven (Netherlands)
2015-12-10
Highlights: • Kinetics of Li{sub 2}SO{sub 4}·H{sub 2}O single crystals were modeled based on elementary processes. • Kinetics of nucleation and nuclei growth were studied by using optical microscopy. • A novel experiment was designed to visualize the reaction front into crystal bulk. • Fractional conversion was calculated and compared with TGA-experiments. - Abstract: Simulation of gas–solid reactions occurring in industrial processes requires a robust kinetic model to be applicable in a wide range of complicated reaction conditions. However, in literature it is often seen that even the same reaction under specific controlled conditions is interpreted with different kinetic models. In the present work, a phenomenological model based on nucleation and nuclei growth processes is presented to study the kinetics of the dehydration reaction of lithium sulfate monohydrate single crystals. The two elementary processes of the reaction, nucleation and nuclei growth, are characterized and quantified as a function of temperature by using optical microscopy experiments. The in-situ measured characteristics of the dehydration reaction provided confirmatory evidence that the rate of nucleation obeys an exponential law and the rate of nuclei growth is approximately constant. With knowledge acquired from the optical observations as inputs of the kinetic model, the fractional conversion of the dehydration reaction was calculated and compared with experimental results from thermogravimetric analysis (TGA). A satisfactory comparison was found both in isothermal and non-isothermal conditions. It is demonstrated that this knowledge-based model has a great potential to represent the gas–solid reaction kinetics in a wide range of process conditions regarding temperature, pressure and particle geometry.
SF-FDTD analysis of a predictive physical model for parallel aligned liquid crystal devices
Márquez, Andrés.; Francés, Jorge; Martínez, Francisco J.; Gallego, Sergi; Alvarez, Mariela L.; Calzado, Eva M.; Pascual, Inmaculada; Beléndez, Augusto
2017-08-01
Recently we demonstrated a novel and simplified model enabling to calculate the voltage dependent retardance provided by parallel aligned liquid crystal devices (PA-LCoS) for a very wide range of incidence angles and any wavelength in the visible. To our knowledge it represents the most simplified approach still showing predictive capability. Deeper insight into the physics behind the simplified model is necessary to understand if the parameters in the model are physically meaningful. Since the PA-LCoS is a black-box where we do not have information about the physical parameters of the device, we cannot perform this kind of analysis using the experimental retardance measurements. In this work we develop realistic simulations for the non-linear tilt of the liquid crystal director across the thickness of the liquid crystal layer in the PA devices. We consider these profiles to have a sine-like shape, which is a good approximation for typical ranges of applied voltage in commercial PA-LCoS microdisplays. For these simulations we develop a rigorous method based on the split-field finite difference time domain (SF-FDTD) technique which provides realistic retardance values. These values are used as the experimental measurements to which the simplified model is fitted. From this analysis we learn that the simplified model is very robust, providing unambiguous solutions when fitting its parameters. We also learn that two of the parameters in the model are physically meaningful, proving a useful reverse-engineering approach, with predictive capability, to probe into internal characteristics of the PA-LCoS device.
Next generation data harmonization
Armstrong, Chandler; Brown, Ryan M.; Chaves, Jillian; Czerniejewski, Adam; Del Vecchio, Justin; Perkins, Timothy K.; Rudnicki, Ron; Tauer, Greg
2015-05-01
Analysts are presented with a never ending stream of data sources. Often, subsets of data sources to solve problems are easily identified but the process to align data sets is time consuming. However, many semantic technologies do allow for fast harmonization of data to overcome these problems. These include ontologies that serve as alignment targets, visual tools and natural language processing that generate semantic graphs in terms of the ontologies, and analytics that leverage these graphs. This research reviews a developed prototype that employs all these approaches to perform analysis across disparate data sources documenting violent, extremist events.
Modeling thermo-optic effect in large mode area double cladding photonic crystal fibers
Coscelli, Enrico; Cucinotta, Annamaria
2014-02-01
The impact of thermally-induced refractive index changes on the single-mode (SM) properties of large mode area (LMA) photonic crystal fibers are thoroughly investigated by means of a full-vector modal solver with integrated thermal model. Three photonic crystal fiber designs are taken into account, namely the 19-cell core fiber, the large-pitch fiber (LPF) and the distributed modal filtering (DMF) fiber, to assess the effects of the interplay between thermal effects and the high-order mode (HOM) suppression mechanisms exploited in order to obtain effectively SM guiding. The results have shown significant differences in the way the SM regime is changed by the increase of heat load, providing useful hints for the design of LMA fibers for high power lasers.
Uniform angular overlap model interpretation of the crystal field effect in U(5+) fluoride compounds
Energy Technology Data Exchange (ETDEWEB)
Gajek, Z.; Mulak, J. (W. Trzebiatowski Inst. of Low Temperature and Structure Research, Polish Academy of Sciences, Wroclaw (Poland))
1990-11-01
The uniform interpretation of the crystal field effect in three different U(5+) fluoride compounds: CsUF{sub 6}, {alpha}-UF{sub 5} and {beta}-UF{sub 5} within the angular overlap model (AOM) is given. Some characteristic relations between the AOM parameters and their distance dependencies resulting from ab initio calculations are introduced and examined from a phenomenological point of view. The traditional simplest approach with only one independent parameter, i.e. e{sub {sigma}} with e{sub {pi}}:e{sub {sigma}} = 0.32 and e{sub {delta}} = 0, is shown to provide a consistent interpretation of the crystal field effect of the whole class of the compounds. The parameters obtained for one compound are easily and successfully extrapolated to others. The specificity and importance of the e{sub {delta}} parameter for 5f{sup 1} systems is discussed. (orig.).
Numerical computation of the linear stability of the diffusion model for crystal growth simulation
Energy Technology Data Exchange (ETDEWEB)
Yang, C.; Sorensen, D.C. [Rice Univ., Houston, TX (United States); Meiron, D.I.; Wedeman, B. [California Institute of Technology, Pasadena, CA (United States)
1996-12-31
We consider a computational scheme for determining the linear stability of a diffusion model arising from the simulation of crystal growth. The process of a needle crystal solidifying into some undercooled liquid can be described by the dual diffusion equations with appropriate initial and boundary conditions. Here U{sub t} and U{sub a} denote the temperature of the liquid and solid respectively, and {alpha} represents the thermal diffusivity. At the solid-liquid interface, the motion of the interface denoted by r and the temperature field are related by the conservation relation where n is the unit outward pointing normal to the interface. A basic stationary solution to this free boundary problem can be obtained by writing the equations of motion in a moving frame and transforming the problem to parabolic coordinates. This is known as the Ivantsov parabola solution. Linear stability theory applied to this stationary solution gives rise to an eigenvalue problem of the form.
Garcia, J.; Arcila, M.; Benito, B.; Eraso, J.; García, R.; Gomez Capera, A.; Pagani, M.; Pinho, R.; Rendon, H.; Torres, Y.
2013-05-01
Latin America is a seismically active region with complex tectonic settings that make the creation of hazard models challenging. Over the past two decades PSHA studies have been completed for this region in the context of global (Shedlock, 1999), regional (Dimaté et al., 1999) and national initiatives. Currently different research groups are developing new models for various nations. The Global Earthquake Model (GEM), an initiative aiming at the creation of a large global community working collaboratively on building hazard and risk models using open standards and tools, is promoting the collaboration between different national projects and groups so as to facilitate the creation of harmonized regional models. The creation of a harmonized hazard model can follow different approaches, varying from a simple patching of available models to a complete homogenisation of basic information and the subsequent creation of a completely new PSHA model. In this contribution we describe the process and results of a first attempt aiming at the creation of a community based model covering the Caribbean and Central America regions. It consists of five main steps: 1- Identification and collection of available PSHA input models; 2- Analysis of the consistency, transparency and reproducibility of each model; 3- Selection (if more then a model exists for the same region); 4- Representation of the models in a standardized format and incorporation of new knowledge from recent studies; 5- Proposal(s) of harmonization We consider some PHSA studies completed over the latest twenty years in the region comprising the Caribbean (CAR), Central America (CAM) and northern South America (SA), we illustrate a tentative harmonization of the seismic source geometries models and we discuss the steps needed toward a complete harmonisation of the models. Our will is to have a model based on best practices and high standards created though a combination of knowledge and competences coming from the
In-situ Spectroscopic Studies and Modelling of Crystallization Processes of Sulphuric Acid Catalysts
DEFF Research Database (Denmark)
Oehlers, C.; Fehrmann, Rasmus; Masters, Stephen Grenville
1996-01-01
Deactivation of commercial and prototype sulphuric acid catalysts has been investigated in-situ by ESR spectroscopy. The influence of support pore structure,and the chemical composition of the catalyst and the gas phase was dicussed.A statistical lattice model was applied to describe the crystall......Deactivation of commercial and prototype sulphuric acid catalysts has been investigated in-situ by ESR spectroscopy. The influence of support pore structure,and the chemical composition of the catalyst and the gas phase was dicussed.A statistical lattice model was applied to describe...
Linear and nonlinear modeling of light propagation in hollow-core photonic crystal fiber
DEFF Research Database (Denmark)
Roberts, John; Lægsgaard, Jesper
2009-01-01
Hollow core photonic crystal fibers (HC-PCFs) find applications which include quantum and non-linear optics, gas detection and short high-intensity laser pulse delivery. Central to most applications is an understanding of the linear and nonlinear optical properties. These require careful modeling....... The intricacies of modeling various forms of HC-PCF are reviewed. An example of linear dispersion engineering, aimed at reducing and flattening the group velocity dispersion, is then presented. Finally, a study of short high intensity pulse delivery using HC-PCF in both dispersive and nonlinear (solitonic...
Modeling the Color Image and Video Quality on Liquid Crystal Displays with Backlight Dimming
DEFF Research Database (Denmark)
Korhonen, Jari; Mantel, Claire; Burini, Nino
2013-01-01
Objective image and video quality metrics focus mostly on the digital representation of the signal. However, the display characteristics are also essential for the overall Quality of Experience (QoE). In this paper, we use a model of a backlight dimming system for Liquid Crystal Display (LCD......) and show how the modeled image can be used as an input to quality assessment algorithms. For quality assessment, we propose an image quality metric, based on Peak Signal-to-Noise Ratio (PSNR) computation in the CIE L*a*b* color space. The metric takes luminance reduction, color distortion and loss...
Angular overlap model analysis of the D 2d crystal field effect in uranium (4+) compounds
Gajek, Z.; Hubert, S.; Krupa, J. C.
1988-12-01
Recent interpretations of the D 2d crystal field of U 4+ in β-ThCl 4, α, β-ThBr 4, ThSiO 4 and UCl 4 are discussed in terms of the simplified one-, two- and three-parameter versions of the Angular Overlap Model which are shown to be a handy tool in a trial interpretation of the effect. The variation of the CF parameters with a small D 2 distortion of the coordination is well reproduced by the model.
Directory of Open Access Journals (Sweden)
Yang J.
2015-01-01
Full Text Available By combining the nonlinear finite element analysis techniques and crystal plasticity theory, the macroscopic mechanical behaviour of crystalline material, the texture evolution and earing-type characteristics are simulated accurately. In this work, a crystal plasticity model exhibiting deformation twinning is introduced based on crystal plasticity theory and saturation-type hardening laws for FCC metal Fe-22Mn-0.6C TWIP steel. Based on the CPFE model and parameters which have been determined for TWIP steel, a simplified finite element model for deep drawing is promoted by using crystal plasticity constitutive model. The earing characteristics in typical deep-drawing process are simulated well. Further, the drawing forces are calculated and compared to the experimental results from reference. Meanwhile, the impacts of drawing coefficient and initial texture on the earing characteristics are investigated for controlling the earing.
Probabilistic aspects of harmonic emission of large offshore wind farms
Energy Technology Data Exchange (ETDEWEB)
Jensen, Christian F. [Energinet.dk, Fredericia (Denmark); Bak, Claus L. [Aalborg Univ. (Denmark). Dept. of Energy Technology; Kocewiak, Lukasz; Hjerrild, Jesper [DONG Energy, Skaerbaek (Denmark); Berthelsen, Kasper K. [Aalborg Univ. (Denmark). Dept. of Mathematical Sciences
2011-07-01
In this article, a new probabilistic method of assessment of harmonic emission of large offshore wind farms is presented. Based on measurements from the British wind farm Burbo Banks, probability density functions are estimated for the dominating low order harmonic currents injected by a single turbine. The degree and type of dependence between the harmonic emission and the operating point of a single turbine is established. A model of Burbo Banks, suitable for harmonic load flow studies, is created in DIgSILENT Power Factory along with a DPL-script that deals with the probabilistic issues of the harmonic emission. The simulated harmonic distortion at the PCC is compared to measurement. This reveals some difficulties regarding harmonic load flow studies. The harmonic background distortion in the grid to where the wind farms is connected must be included in the study. Furthermore, a very detailed representation of the frequency dependent short circuit impedance must be used before sufficiently accurate results can be obtained from the model. (orig.)
Tissue Harmonic Synthetic Aperture Imaging
DEFF Research Database (Denmark)
Rasmussen, Joachim
The main purpose of this PhD project is to develop an ultrasonic method for tissue harmonic synthetic aperture imaging. The motivation is to advance the field of synthetic aperture imaging in ultrasound, which has shown great potentials in the clinic. Suggestions for synthetic aperture tissue...... system complexity compared to conventional synthetic aperture techniques. In this project, SASB is sought combined with a pulse inversion technique for 2nd harmonic tissue harmonic imaging. The advantages in tissue harmonic imaging (THI) are expected to further improve the image quality of SASB...
International Nuclear Information System (INIS)
Yu, Guangbin; Tang, Chaolong; Song, Jinhui; Lu, Wenqiang
2014-01-01
Based on conductivity characterization of single crystal zinc oxide (ZnO) micro/nanobelt (MB/NB), we further investigate the physical mechanism of nonlinear intrinsic resistance-length characteristic using finite element method. By taking the same parameters used in experiment, a model of nonlinear anisotropic resistance change with single crystal MB/NB has been deduced, which matched the experiment characterization well. The nonlinear resistance-length comes from the different electron moving speed in various crystal planes. As the direct outcome, crystallography of the anisotropic semiconducting MB/NB has been identified, which could serve as a simple but effective method to identify crystal growth direction of single crystal semiconducting or conductive nanomaterial
International Nuclear Information System (INIS)
Duque, C.M.; Mora-Ramos, M.E.; Duque, C.A.
2013-01-01
The calculation of the second and third harmonic generation coefficients is carried out within the framework of the effective mass approximation in two-dimensional GaAs quantum discs under the combined effect of an external magnetic field and parabolic and inverse square confining potentials. Due to the electric dipole selection rules, the system is shown to have second harmonic generation coefficient identically zero for all the values of incident frequency. The generation of third optical harmonics is significantly dependent on the values of the different input parameters, with the presence of resonant peak blueshifts associated with the magnitudes of the parabolic confinement and the applied magnetic field. -- Highlights: ► One-electron conduction states in a two-dimensional quantum dot. ► Magnetic field and an inverse square repulsive potential. ► Generation of second harmonics is always null. ► Magnetic field induces a blueshift of the resonant peaks. ► The inverse square potential induces a reduction of the peak intensities
Energy Technology Data Exchange (ETDEWEB)
Duque, C.M. [Instituto de Física, Universidad de Antioquia, AA 1226 Medellín (Colombia); Mora-Ramos, M.E. [Instituto de Física, Universidad de Antioquia, AA 1226 Medellín (Colombia); Facultad de Ciencias, Universidad Autónoma del Estado de Morelos, Ave, Universidad 1001, CP 62209 Cuernavaca, Morelos (Mexico); Duque, C.A., E-mail: cduque@fisica.udea.edu.co [Instituto de Física, Universidad de Antioquia, AA 1226 Medellín (Colombia)
2013-06-15
The calculation of the second and third harmonic generation coefficients is carried out within the framework of the effective mass approximation in two-dimensional GaAs quantum discs under the combined effect of an external magnetic field and parabolic and inverse square confining potentials. Due to the electric dipole selection rules, the system is shown to have second harmonic generation coefficient identically zero for all the values of incident frequency. The generation of third optical harmonics is significantly dependent on the values of the different input parameters, with the presence of resonant peak blueshifts associated with the magnitudes of the parabolic confinement and the applied magnetic field. -- Highlights: ► One-electron conduction states in a two-dimensional quantum dot. ► Magnetic field and an inverse square repulsive potential. ► Generation of second harmonics is always null. ► Magnetic field induces a blueshift of the resonant peaks. ► The inverse square potential induces a reduction of the peak intensities.
Energy Technology Data Exchange (ETDEWEB)
Mora Barajas, M.A.; Banuelos Sanchez, P. [Universidad de las Americas Puebla (Mexico)]. E-mail: marco.morabs@udlap.mx; pedro.banuelos@udlap.mx
2010-04-15
Many household electrical appliances like televisions, video recorders and computers are sources of voltage and current harmonics, which increase power losses and contaminate the AC power line. These harmonics can cause serious problems in both, utilities and electrical equipment connected to the same AC line. This paper shows a mathematical analysis of harmonics content on the electrical current for a circuit representing a non linear residential load. A comparative harmonic distortion study produced by the residential loads on the electrical power lines, measured experimentally, is also shown. [Spanish] Muchos de los aparatos electricos que tenemos en casa como televisores, videograbadoras y computadoras, generan armonicos de voltaje y de corriente que incrementan las perdidas de potencia y contaminan las lineas de suministro electrico, pudiendo ocasionar severos danos tanto a las redes de energia como a los equipos que de ellas se alimentan. En este articulo se muestra un analisis matematico del contenido armonico en la corriente de un circuito que representa a una carga residencial no lineal. Ademas, a partir de mediciones electricas realizadas de manera experimental, se presente un estudio comparativo de la contaminacion armonica que este tipo de cargas introduce a las lineas de suministro electrico.
Green Fluorescent Protein as a Model for Protein Crystal Growth Studies
Agena, Sabine; Smith, Lori; Karr, Laurel; Pusey, Marc
1998-01-01
Green fluorescent protein (GFP) from jellyfish Aequorea Victoria has become a popular marker for e.g. mutagenesis work. Its fluorescent property, which originates from a chromophore located in the center of the molecule, makes it widely applicable as a research too]. GFP clones have been produced with a variety of spectral properties, such as blue and yellow emitting species. The protein is a single chain of molecular weight 27 kDa and its structure has been determined at 1.9 Angstrom resolution. The combination of GFP's fluorescent property, the knowledge of its several crystallization conditions, and its increasing use in biophysical and biochemical studies, all led us to consider it as a model material for macromolecular crystal growth studies. Initial preparations of GFP were from E.coli with yields of approximately 5 mg/L of culture media. Current yields are now in the 50 - 120 mg/L range, and we hope to further increase this by expression of the GFP gene in the Pichia system. The results of these efforts and of preliminary crystal growth studies will be presented.
Crystal structure of the binder phase in a model HfC-TiC-Ni material
International Nuclear Information System (INIS)
Heiligers, Christiane; Neethling, Johannes H.
2008-01-01
The crystal structure of the binder phase in a model HfC-TiC-Ni sample produced by hot pressing is investigated. The nature of the binder depends on the amount of Hf and Ti that remains in solution with Ni after cooling. Four different crystal structures are identified by analysis of electron diffraction patterns obtained using transmission electron microscopy techniques and the composition of the phases determined by energy dispersive X-ray spectrometry. Three of the phases are cubic; Ni, Ni 3 (Ti,Hf) and Ni 23 (Ti,Hf) 6 with lattice parameters of 3.52 ± 0.05, 3.52 ± 0.03 and 10.70 ± 0.40 A, respectively. The hexagonal phase is an intermetallic Ni 3 Ti phase, with lattice parameters of a = b = 5.00 ± 0.20 A and c = 8.16 ± 0.20 A. The crystal structures are confirmed by simulations of the electron diffraction patterns using JEMS software
Modeling and Optimization of Optical Half Adder in Two Dimensional Photonic Crystals
Sonth, Mahesh V.; Soma, Savita; Gowre, Sanjaykumar C.; Biradar, Nagashettappa
2018-05-01
The output of photonic integrated devices is enhanced using crystal waveguides and cavities but optimization of these devices is a topic of research. In this paper, optimization of the optical half adder in two-dimensional (2-D) linear photonic crystals using four symmetric T-shaped waveguides with 180° phase shift inputs is proposed. The input section of a T-waveguide acts as a beam splitter, and the output section acts as a power combiner. The constructive and destructive interference phenomenon will provide an output optical power. Output port Cout will receive in-phase power through the 180° phase shifter cavity designed near the junction. The optical half adder is modeled in a 2-D photonic crystal using the finite difference time domain method (FDTD). It consists of a cubic lattice with an array of 39 × 43 silicon rods of radius r 0.12 μm and 0.6 μm lattice constant a. The extinction ratio r e of 11.67 dB and 12.51 dB are achieved at output ports using the RSoft FullWAVE-6.1 software package.
Moonage Daydream: Reassessing the Simple Model for Lunar Magma Ocean Crystallization
Rapp, J. F.; Draper, D. S.
2016-01-01
Details of the differentiation of a global-scale lunar magma ocean (LMO) remain enigmatic, as the Moon is not simply composed of highlands anorthosite and a suite of mare basalts as inferred from early studies. Results from recent orbital missions, and the increasingly detailed study of lunar samples, have revealed a much larger range of lithologies, from relatively MgO-rich and "purest anorthosite" discovered on the lunar far side by the M3 instrument on Chandraayan-1 to more exotic lithologies such as Si-rich domes and spinel-rich clasts distributed globally. To understand this increasingly complex geology, we must understand the initial formation and evolution of the LMO, and the composition of the cumulates this differentiation could have produced. Several attempts at modelling such a crystallization sequence have been made, and have raised as many questions as they have answered. We present results from our ongoing experimental simulations of magma ocean crystallization, investigating two end-member bulk compositions (TWM and LPUM) under fully fractional crystallization conditions. These simulations represent melting of the entire silicate portion of the Moon, as an end-member starting point from which to begin assessing the evolution of the lunar interior and formation of the lunar crust.
Modeling Textural Processes during Self-Assembly of Plant-Based Chiral-Nematic Liquid Crystals
Directory of Open Access Journals (Sweden)
Yogesh K. Murugesan
2010-12-01
Full Text Available Biological liquid crystalline polymers are found in cellulosic, chitin, and DNA based natural materials. Chiral nematic liquid crystalline orientational order is observed frozen-in in the solid state in plant cell walls and is known as a liquid crystal analogue characterized by a helicoidal plywood architecture. The emergence of the plywood architecture by directed chiral nematic liquid crystalline self assembly has been postulated as the mechanism that leads to optimal cellulose fibril organization. In natural systems, tissue growth and development takes place in the presence of inclusions and secondary phases leaving behind characteristic defects and textures, which provide a unique testing ground for the validity of the liquid crystal self-assembly postulate. In this work, a mathematical model, based on the Landau-de Gennes theory of liquid crystals, is used to simulate defect textures arising in the domain of self assembly, due to presence of secondary phases representing plant cells, lumens and pit canals. It is shown that the obtained defect patterns observed in some plant cell walls are those expected from a truly liquid crystalline phase. The analysis reveals the nature and magnitude of the viscoelastic material parameters that lead to observed patterns in plant-based helicoids through directed self-assembly. In addition, the results provide new guidance to develop biomimetic plywoods for structural and functional applications.
Generalized Harmonic Functions and the Dewetting of Thin Films
International Nuclear Information System (INIS)
Auchmuty, Giles; Kloucek, Petr
2007-01-01
This paper describes the solvability of Dirichlet problems for Laplace's equation when the boundary data is not smooth enough for the existence of a weak solution in H 1 Ω. Scales of spaces of harmonic functions and of boundary traces are defined and the solutions are characterized as limits of classical harmonic functions in special norms. The generalized harmonic functions, and their norms, are defined using series expansions involving harmonic Steklov eigenfunctions on the domain. It is shown that the usual trace operator has a continuous extension to an isometric isomorphism of specific spaces. This provides a characterization of the generalized solutions of harmonic Dirichlet problems. Numerical simulations of a model problem are described. This problem is related to the dewetting of thin films and the associated phenomenology is described
Heptinstall, David; Bouvet de Maisonneuve, Caroline; Neuberg, Jurgen; Taisne, Benoit; Collinson, Amy
2016-04-01
Heat flow models can bring new insights into the thermal and rheological evolution of volcanic 3 systems. We shall investigate the thermal processes and timescales in a crystallizing, static 4 magma column, with a heat flow model of Soufriere Hills Volcano (SHV), Montserrat. The latent heat of crystallization is initially computed with MELTS, as a function of pressure and temperature for an andesitic melt (SHV groundmass starting composition). Three fractional crystallization simulations are performed; two with initial pressures of 34MPa (runs 1 & 2) and one of 25MPa (run 3). Decompression rate was varied between 0.1MPa/° C (runs 1 & 3) and 0.2MPa/° C (run 2). Natural and experimental matrix glass compositions are accurately reproduced by all MELTS runs. The cumulative latent heat released for runs 1, 2 and 3 differs by less than 9% (8.69E5 J/kg*K, 9.32E5 J/kg*K, and 9.49E5 J/kg*K respectively). The 2D axisymmetric conductive cooling simulations consider a 30m-diameter conduit that extends from the surface to a depth of 1500m (34MPa). The temporal evolution of temperature is closely tracked at depths of 10m, 750m and 1400m in the centre of the conduit, at the conduit walls, and 20m from the walls into the host rock. Following initial cooling by 7-15oC at 10m depth inside the conduit, the magma temperature rebounds through latent heat release by 32-35oC over 85-123 days to a maximum temperature of 1002-1005oC. At 10m depth, it takes 4.1-9.2 years for the magma column to cool by 108-131oC and crystallize to 75wt%, at which point it cannot be easily remobilized. It takes 11-31.5 years to reach the same crystallinity at 750-1400m depth. We find a wide range in cooling timescales, particularly at depths of 750m or greater, attributed to the initial run pressure and the dominant latent heat producing crystallizing phase, Albite-rich Plagioclase Feldspar. Run 1 is shown to cool fastest and run 3 cool the slowest, with surface emissivity having the strongest cooling
Statistical mechanical model of gas adsorption in porous crystals with dynamic moieties.
Simon, Cory M; Braun, Efrem; Carraro, Carlo; Smit, Berend
2017-01-17
Some nanoporous, crystalline materials possess dynamic constituents, for example, rotatable moieties. These moieties can undergo a conformation change in response to the adsorption of guest molecules, which qualitatively impacts adsorption behavior. We pose and solve a statistical mechanical model of gas adsorption in a porous crystal whose cages share a common ligand that can adopt two distinct rotational conformations. Guest molecules incentivize the ligands to adopt a different rotational configuration than maintained in the empty host. Our model captures inflections, steps, and hysteresis that can arise in the adsorption isotherm as a signature of the rotating ligands. The insights disclosed by our simple model contribute a more intimate understanding of the response and consequence of rotating ligands integrated into porous materials to harness them for gas storage and separations, chemical sensing, drug delivery, catalysis, and nanoscale devices. Particularly, our model reveals design strategies to exploit these moving constituents and engineer improved adsorbents with intrinsic thermal management for pressure-swing adsorption processes.
Modelling irradiation-induced softening in BCC iron by crystal plasticity approach
International Nuclear Information System (INIS)
Xiao, Xiazi; Terentyev, Dmitry; Yu, Long; Song, Dingkun; Bakaev, A.; Duan, Huiling
2015-01-01
Crystal plasticity model (CPM) for BCC iron to account for radiation-induced strain softening is proposed. CPM is based on the plastically-driven and thermally-activated removal of dislocation loops. Atomistic simulations are applied to parameterize dislocation-defect interactions. Combining experimental microstructures, defect-hardening/absorption rules from atomistic simulations, and CPM fitted to properties of non-irradiated iron, the model achieves a good agreement with experimental data regarding radiation-induced strain softening and flow stress increase under neutron irradiation. - Highlights: • A stress- and thermal-activated defect absorption model is proposed for the dislocation-loop interaction. • A temperature-dependent plasticity theory is proposed for the irradiation-induced strain softening of irradiated BCC metals. • The numerical results of the model match with the corresponding experimental data.
Modelling irradiation-induced softening in BCC iron by crystal plasticity approach
Energy Technology Data Exchange (ETDEWEB)
Xiao, Xiazi [State Key Laboratory for Turbulence and Complex System, Department of Mechanics and Engineering Science, College of Engineering, Peking University, Beijing 100871 (China); CAPT, HEDPS and IFSA Collaborative Innovation Center of MoE, Peking University, Beijing 100871 (China); Terentyev, Dmitry, E-mail: dterenty@SCKCEN.BE [Structural Material Group, Institute of Nuclear Materials Science, SCK-CEN, Mol (Belgium); Yu, Long; Song, Dingkun [State Key Laboratory for Turbulence and Complex System, Department of Mechanics and Engineering Science, College of Engineering, Peking University, Beijing 100871 (China); Bakaev, A. [Structural Material Group, Institute of Nuclear Materials Science, SCK-CEN, Mol (Belgium); Duan, Huiling, E-mail: hlduan@pku.edu.cn [State Key Laboratory for Turbulence and Complex System, Department of Mechanics and Engineering Science, College of Engineering, Peking University, Beijing 100871 (China); CAPT, HEDPS and IFSA Collaborative Innovation Center of MoE, Peking University, Beijing 100871 (China)
2015-11-15
Crystal plasticity model (CPM) for BCC iron to account for radiation-induced strain softening is proposed. CPM is based on the plastically-driven and thermally-activated removal of dislocation loops. Atomistic simulations are applied to parameterize dislocation-defect interactions. Combining experimental microstructures, defect-hardening/absorption rules from atomistic simulations, and CPM fitted to properties of non-irradiated iron, the model achieves a good agreement with experimental data regarding radiation-induced strain softening and flow stress increase under neutron irradiation. - Highlights: • A stress- and thermal-activated defect absorption model is proposed for the dislocation-loop interaction. • A temperature-dependent plasticity theory is proposed for the irradiation-induced strain softening of irradiated BCC metals. • The numerical results of the model match with the corresponding experimental data.
Prediction of Metastasis Using Second Harmonic Generation
2016-07-01
small but statistically significant difference in average F/B of treated US patients versus untreated Dutch patients. Fig. 1. Display of all...predictive ability of models incorporating F/B using a multivariate linear model, but this time applying the analysis to the entire ER+ and ER- cohort. As...AWARD NUMBER: W81XWH-15-1-0040 TITLE: Prediction of Metastasis Using Second Harmonic Generation PRINCIPAL INVESTIGATOR: Edward Brown
Second harmonic generation microscopy
DEFF Research Database (Denmark)
Brüggemann, Dagmar Adeline; Brewer, Jonathan R.; Risbo, Jens
2010-01-01
Myofibers and collagen show non-linear optical properties enabling imaging using second harmonic generation (SHG) microscopy. The technique is evaluated for use as a tool for real-time studies of thermally induced changes in thin samples of unfixed and unstained pork. The forward and the backward...... scattered SHG light reveal complementary features of the structures of myofibers and collagen fibers. Upon heating the myofibers show no structural changes before reaching a temperature of 53 °C. At this temperature the SHG signal becomes extinct. The extinction of the SHG at 53 °C coincides with a low......-temperature endotherm peak observable in the differential scanning calorimetry (DSC) thermograms. DSC analysis of epimysium, the connective tissue layer that enfold skeletal muscles, produces one large endotherm starting at 57 °C and peaking at 59.5 °C. SHG microscopy of collagen fibers reveals a variability of thermal...
Azimuthal anisotropy: The higher harmonics
International Nuclear Information System (INIS)
Poskanzer, Arthur M.; STAR Collaboration
2004-01-01
We report the first observations of the fourth harmonic (v 4 ) in the azimuthal distribution of particles at RHIC. The measurement was done taking advantage of the large elliptic flow generated at RHIC. The integrated v 4 is about a factor of 10 smaller than v 2 . For the sixth (v 6 ) and eighth (v 8 ) harmonics upper limits on the magnitudes are reported
Harmonic Series Meets Fibonacci Sequence
Chen, Hongwei; Kennedy, Chris
2012-01-01
The terms of a conditionally convergent series may be rearranged to converge to any prescribed real value. What if the harmonic series is grouped into Fibonacci length blocks? Or the harmonic series is arranged in alternating Fibonacci length blocks? Or rearranged and alternated into separate blocks of even and odd terms of Fibonacci length?
Tuvan Throat Singing and Harmonics
Ruiz, Michael J.; Wilken, David
2018-01-01
Tuvan throat singing, also called overtone singing, provides for an exotic demonstration of the physics of harmonics as well as introducing an Asian musical aesthetic. A low fundamental is sung and the singer skillfully alters the resonances of the vocal system to enhance an overtone (harmonic above the fundamental). The result is that the…
Model for determining vapor equilibrium rates in the hanging drop method for protein crystal growth
Baird, James K.; Frieden, Richard W.; Meehan, E. J., Jr.; Twigg, Pamela J.; Howard, Sandra B.; Fowlis, William A.
1987-01-01
An engineering analysis of the rate of evaporation of solvent in the hanging drop method of protein crystal growth is presented. Results are applied to 18 drop and well arrangements commonly encountered in the laboratory. The chemical nature of the salt, drop size and shape, drop concentration, well size, well concentration, and temperature are taken into account. The rate of evaporation increases with temperature, drop size, and the salt concentration difference between the drop and the well. The evaporation in this model possesses no unique half-life. Once the salt in the drop achieves 80 percent of its final concentration, further evaporation suffers from the law of diminishing returns.
Comparison of modeled and measured performance of a GSO crystal as gamma detector
Energy Technology Data Exchange (ETDEWEB)
Parno, D.S., E-mail: dparno@uw.edu [Carnegie Mellon University, Department of Physics, Pittsburgh, PA 15213 (United States); University of Washington, Center for Experimental Nuclear Physics and Astrophysics and Department of Physics, Seattle, WA 98195 (United States); Friend, M. [Carnegie Mellon University, Department of Physics, Pittsburgh, PA 15213 (United States); High Energy Accelerator Research Organization (KEK), Tsukuba, Ibaraki (Japan); Mamyan, V.; Benmokhtar, F. [Carnegie Mellon University, Department of Physics, Pittsburgh, PA 15213 (United States); Camsonne, A. [Thomas Jefferson National Accelerator Facility, Newport News, VA 23606 (United States); Franklin, G.B. [Carnegie Mellon University, Department of Physics, Pittsburgh, PA 15213 (United States); Paschke, K. [University of Virginia, Department of Physics, Charlottesville, VA 22904 (United States); Quinn, B. [Carnegie Mellon University, Department of Physics, Pittsburgh, PA 15213 (United States)
2013-11-11
We have modeled, tested, and installed a large, cerium-activated Gd{sub 2}SiO{sub 5} crystal scintillator for use as a detector of gamma rays. We present the measured detector response to two types of incident photons: nearly monochromatic photons up to 40 MeV, and photons from a continuous Compton backscattering spectrum up to 200 MeV. Our GEANT4 simulations, developed to determine the analyzing power of the Compton polarimeter in Hall A of Jefferson Lab, reproduce the measured spectra well.
Phase-field-crystal model for magnetocrystalline interactions in isotropic ferromagnetic solids
Faghihi, Niloufar; Provatas, Nikolas; Elder, K. R.; Grant, Martin; Karttunen, Mikko
2013-09-01
An isotropic magnetoelastic phase-field-crystal model to study the relation between morphological structure and magnetic properties of pure ferromagnetic solids is introduced. Analytic calculations in two dimensions were used to determine the phase diagram and obtain the relationship between elastic strains and magnetization. Time-dependent numerical simulations in two dimensions were used to demonstrate the effect of grain boundaries on the formation of magnetic domains. It was shown that the grain boundaries act as nucleating sites for domains of reverse magnetization. Finally, we derive a relation for coercivity versus grain misorientation in the isotropic limit.
The optical interface of a photonic crystal: Modeling an opal with a stratified effective index
Maurin, Isabelle; Moufarej, Elias; Laliotis, Athanasios; Bloch, Daniel
2014-01-01
An artificial opal is a compact arrangement of transparent spheres, and is an archetype of a three-dimensional photonic crystal. Here, we describe the optics of an opal using a flexible model based upon a stratified medium whose (effective) index is governed by the opal density in a small planar slice of the opal. We take into account the effect of the substrate and assume a well- controlled number of layers, as it occurs for an opal fabricated by Langmuir-Blodgett deposition. The calculation...
Comparison of modeled and measured performance of a GSO crystal as gamma detector
International Nuclear Information System (INIS)
Parno, D.S.; Friend, M.; Mamyan, V.; Benmokhtar, F.; Camsonne, A.; Franklin, G.B.; Paschke, K.; Quinn, B.
2013-01-01
We have modeled, tested, and installed a large, cerium-activated Gd 2 SiO 5 crystal scintillator for use as a detector of gamma rays. We present the measured detector response to two types of incident photons: nearly monochromatic photons up to 40 MeV, and photons from a continuous Compton backscattering spectrum up to 200 MeV. Our GEANT4 simulations, developed to determine the analyzing power of the Compton polarimeter in Hall A of Jefferson Lab, reproduce the measured spectra well