Sample records for range electronic interactions

  1. Interaction of a relativistic electron beam with radiation in the THz frequency range (United States)

    Sung, Chieh

    The ability to generate a train of microbunches that are only typically tens of femtosecond wide and are separated by a picosecond is a topic of contemporary interest in the field of free electron lasers and plasma based accelerators. Moreover the usefulness of the high gradients present in plasma accelerators will depend on the ability to obtain mono-energetic relativistic electrons. This means that in addition to being prebunched on a scale shorter than the plasma wavelength the externally injected electron beam must be phase-locked to the accelerating plasma wave structure. In this thesis we investigate two techniques, Free Electron Laser interaction (FEL) and the Inverse Free Electron Laser interaction (IFEL), by which a medium energy electron beam can be prebunched into a series of microbunches with the same periodicity as a plasma wave and is phase locked to it. Using full-scale, 3-D simulations we show in this thesis that when a relativistic electron beam and an electromagnetic wave propagate collinearly through a magnetic undulator, FEL and IFEL interactions have the capability to form electron microbunches with periodicity 300-100 mum (1-3 THz range), which contain 50% of electrons within a small fraction of the ponderomotive buckets. Such a bunched beam is suitable for injection into plasma densities in the range 1016-1017 cm-3, respectively. Microbunching using the FEL mechanism requires a narrowband THz radiation source to act as a seed whereas the IFEL mechanism requires, in addition, such a source to be high power. In this thesis the generation of THz radiation in the Neptune Laboratory by mixing of two CO2 laser lines in a non-collinearly phase matched GaAs at room temperature is described A high-power THz pulse with up to 2 MW of peak power in a 250 ps pulse was generated using a TW class CO2 laser pulse. Such high power THz radiation is needed for the IFEL approach to microbunching. We also produced a high repetition rate THz source tunable in the

  2. Effects of long-range disorder and electronic interactions on the optical properties of graphene quantum dots (United States)

    Altıntaş, A.; ćakmak, K. E.; Güçlü, A. D.


    We theoretically investigate the effects of long-range disorder and electron-electron interactions on the optical properties of hexagonal armchair graphene quantum dots consisting of up to 10 806 atoms. The numerical calculations are performed using a combination of tight-binding, mean-field Hubbard, and configuration interaction methods. Imperfections in the graphene quantum dots are modeled as a long-range random potential landscape, giving rise to electron-hole puddles. We show that, when the electron-hole puddles are present, the tight-binding method gives a poor description of the low-energy absorption spectra compared to mean-field and configuration interaction calculation results. As the size of the graphene quantum dot is increased, the universal optical conductivity limit can be observed in the absorption spectrum. When disorder is present, the calculated absorption spectrum approaches the experimental results for isolated monolayers of graphene sheets.

  3. Long-range interactions and the sign of natural amplitudes in two-electron systems

    NARCIS (Netherlands)

    Giesbertz, K.J.H.; Van Leeuwen, R.

    In singlet two-electron systems, the natural occupation numbers of the one-particle reduced density matrix are given as squares of the natural amplitudes which are defined as the expansion coefficients of the two-electron wave function in a natural orbital basis. In this work, we relate the sign of

  4. Effect of Long-Range Coulomb Interaction on NMR Shift in Massless Dirac Electrons of Organic Conductor (United States)

    Suzumura, Yoshikazu


    The nuclear magnetic resonance (NMR) shift, χα, at low temperatures is examined for massless Dirac electrons in the organic conductor, α-(BEDT-TTF)2I3, where α [= A (= A'), B, and C] denotes the sites of the four molecules in the unit cell. The Dirac cone exists within an energy of 0.01 eV between the conduction and valence bands. The magnetic response function is calculated by taking account of the long-range Coulomb interaction and electron doping. Calculating the interaction within the first order in the perturbation, the chemical potential is determined self-consistently, and the self-energy and vertex corrections are taken to satisfy the Ward identity. The site-dependent χα is calculated at low temperatures of 0.0002 χ B. The relevance of the shift to the experiment is discussed.

  5. The impact of long-range electron-hole interaction on the charge separation yield of molecular photocells (United States)

    Nemati Aram, Tahereh; Ernzerhof, Matthias; Asgari, Asghar; Mayou, Didier


    We discuss the effects of charge carrier interaction and recombination on the operation of molecular photocells. Molecular photocells are devices where the energy conversion process takes place in a single molecular donor-acceptor complex attached to electrodes. Our investigation is based on the quantum scattering theory, in particular on the Lippmann-Schwinger equation; this minimizes the complexity of the problem while providing useful and non-trivial insight into the mechanism governing photocell operation. In this study, both exciton pair creation and dissociation are treated in the energy domain, and therefore there is access to detailed spectral information, which can be used as a framework to interpret the charge separation yield. We demonstrate that the charge carrier separation is a complex process that is affected by different parameters, such as the strength of the electron-hole interaction and the non-radiative recombination rate. Our analysis helps to optimize the charge separation process and the energy transfer in organic solar cells and in molecular photocells.

  6. Electron-electron interactions in disordered systems

    CERN Document Server

    Efros, AL


    ``Electron-Electron Interactions in Disordered Systems'' deals with the interplay of disorder and the Coulomb interaction. Prominent experts give state-of-the-art reviews of the theoretical and experimental work in this field and make it clear that the interplay of the two effects is essential, especially in low-dimensional systems.

  7. Electron-excited molecule interactions

    Energy Technology Data Exchange (ETDEWEB)

    Christophorou, L.G. (Oak Ridge National Lab., TN (USA) Tennessee Univ., Knoxville, TN (USA). Dept. of Physics)


    In this paper the limited but significant knowledge to date on electron scattering from vibrationally/rotationally excited molecules and electron scattering from and electron impact ionization of electronically excited molecules is briefly summarized and discussed. The profound effects of the internal energy content of a molecule on its electron attachment properties are highlighted focusing in particular on electron attachment to vibrationally/rotationally and to electronically excited molecules. The limited knowledge to date on electron-excited molecule interactions clearly shows that the cross sections for certain electron-molecule collision processes can be very different from those involving ground state molecules. For example, optically enhanced electron attachment studies have shown that electron attachment to electronically excited molecules can occur with cross sections 10{sup 6} to 10{sup 7} times larger compared to ground state molecules. The study of electron-excited molecule interactions offers many experimental and theoretical challenges and opportunities and is both of fundamental and technological significance. 54 refs., 15 figs.

  8. Characteristic energy range of electron scattering due to plasmaspheric hiss (United States)

    Ma, Q.; Li, W.; Thorne, R. M.; Bortnik, J.; Reeves, G. D.; Kletzing, C. A.; Kurth, W. S.; Hospodarsky, G. B.; Spence, H. E.; Baker, D. N.; Blake, J. B.; Fennell, J. F.; Claudepierre, S. G.; Angelopoulos, V.


    We investigate the characteristic energy range of electron flux decay due to the interaction with plasmaspheric hiss in the Earth's inner magnetosphere. The Van Allen Probes have measured the energetic electron flux decay profiles in the Earth's outer radiation belt during a quiet period following the geomagnetic storm that occurred on 7 November 2015. The observed energy of significant electron decay increases with decreasing L shell and is well correlated with the energy band corresponding to the first adiabatic invariant μ = 4-200 MeV/G. The electron diffusion coefficients due to hiss scattering are calculated at L = 2-6, and the modeled energy band of effective pitch angle scattering is also well correlated with the constant μ lines and is consistent with the observed energy range of electron decay. Using the previously developed statistical plasmaspheric hiss model during modestly disturbed periods, we perform a 2-D Fokker-Planck simulation of the electron phase space density evolution at L = 3.5 and demonstrate that plasmaspheric hiss causes the significant decay of 100 keV-1 MeV electrons with the largest decay rate occurring at around 340 keV, forming anisotropic pitch angle distributions at lower energies and more flattened distributions at higher energies. Our study provides reasonable estimates of the electron populations that can be most significantly affected by plasmaspheric hiss and the consequent electron decay profiles.

  9. Long-range interaction of anisotropic systems

    KAUST Repository

    Zhang, Junyi


    The first-order electrostatic interaction energy between two far-apart anisotropic atoms depends not only on the distance between them but also on their relative orientation, according to Rayleigh-Schrödinger perturbation theory. Using the first-order interaction energy and the continuum model, we study the long-range interaction between a pair of parallel pristine graphene sheets at zero temperature. The asymptotic form of the obtained potential density, &epsi:(D) &prop: ?D ?3 ?O(D?4), is consistent with the random phase approximation and Lifshitz theory. Accordingly, neglectance of the anisotropy, especially the nonzero first-order interaction energy, is the reason why the widely used Lennard-Jones potential approach and dispersion corrections in density functional theory give a wrong asymptotic form ε(D) &prop: ?D?4. © EPLA, 2015.

  10. Effective interaction in two-dimensional electron systems (United States)

    Suwa, Takeshi; Takayanagi, Kazuo; Lipparini, Enrico


    A fully microscopic derivation is proposed for an effective interaction operator between electrons in the two-dimensional electron gas (2DEG), which represents multiple-scattering processes in the medium. The obtained interaction features short-range behaviors between electrons, and is presented in a simple form which allows applications in various systems. Short-range correlation in the 2DEG is discussed in detail in terms of the effective interaction with special emphasis on the nonlocal aspect of the correlation.

  11. Short-Range Correlation Models in Electronic Structure Theory (United States)

    Goldey, Matthew Bryant

    Correlation methods within electronic structure theory focus on recovering the exact electron-electron interaction from the mean-field reference. For most chemical systems, including dynamic correlation, the correlation of the movement of electrons proves to be sufficient, yet exact methods for capturing dynamic correlation inherently scale polynomially with system size despite the locality of the electron cusp. This work explores a new family of methods for enhancing the locality of dynamic correlation methodologies with an aim toward improving accuracy and scalability. The introduction of range-separation into ab initio wavefunction methods produces short-range correlation methodologies, which can be supplemented with much faster approximate methods for long-range interactions. First, I examine attenuation of second-order Moller-Plesset perturbation theory (MP2) in the aug-cc-pVDZ basis. MP2 treats electron correlation at low computational cost, but suffers from basis set superposition error (BSSE) and fundamental inaccuracies in long-range contributions. The cost differential between complete basis set (CBS) and small basis MP2 restricts system sizes where BSSE can be removed. Range-separation of MP2 could yield more tractable and/or accurate forms for short- and long-range correlation. Retaining only short-range contributions proves to be effective for MP2 in the small aug-cc-pVDZ (aDZ) basis. Using one range-separation parameter within either the complementary error function (erfc) or a sum of two error functions (terfc), superior behavior is obtained versus both MP2/aDZ and MP2/CBS for inter- and intra-molecular test sets. Attenuation of the long-range helps to cancel both BSSE and intrinsic MP2 errors. Direct scaling of the MP2 correlation energy (SMP2) proves useful as well. The resulting SMP2/aDZ, MP2(erfc, aDZ), and MP2(terfc, aDZ) methods perform far better than MP2/aDZ across systems with hydrogen-bonding, dispersion, and mixed interactions at a

  12. Electron-molecule interactions and their applications

    CERN Document Server

    Christophorou, L G


    Electron-Molecule Interactions and Their Applications, Volume 2 provides a balanced and comprehensive account of electron-molecule interactions in dilute and dense gases and liquid media. This book consists of six chapters. Chapter 1 deals with electron transfer reactions, while Chapter 2 discusses electron-molecular positive-ion recombination. The electron motion in high-pressure gases and electron-molecule interactions from single- to multiple-collision conditions is deliberated in Chapter 3. In Chapter 4, knowledge on electron-molecule interactions in gases is linked to that on similar proc

  13. Short Rayleigh Range Free Electron Laser Amplifiers

    CERN Document Server

    Yu, L H; Murphy, J B; Rose, J; Shaftan, T V; Wang, X J; Watanabe, T


    An important requirement for a high average power laser system is a manageable power density on the first optical element. One possibility to achieve this is a single pass amplifier which generates a short Rayleigh range (SRL) light beam. We present design parameters and calculated performances for several SRL configurations. These include a simulation of the optically guided (pinched) MW class FEL [1], the scalloped beam FEL amplifier [2] and high gain TOK amplifiers we propose to explore at our SDL facility.

  14. Short range correlations in a one dimensional electron gas


    Tas, Murat; Tomak, Mehmet


    We use the SSTL (Singwi, Sjolander, Tosi, Land) approximation to investigate the short--range correlations in a one dimensional electron gas, for the first time. Although SSTL is introduced to better satisfy the compressibility sum rule in three dimensions, the widely used STLS (Singwi, Tosi, Land, Sjolander) approximation turns out to be more successful in the case of the one dimensional electron gas.


    Directory of Open Access Journals (Sweden)

    O. Zhuran


    Full Text Available This article examines trends in the development of teaching methods and problems faced by educational institutions and teachers in the development of interactive tutorials. The article highlights the priority areas of development in this field.

  16. Nanoelectromechanical Heat Engine Based on Electron-Electron Interaction. (United States)

    Vikström, A; Eriksson, A M; Kulinich, S I; Gorelik, L Y


    We theoretically show that a nanoelectromechanical system can be mechanically actuated by a heat flow through it via an electron-electron interaction. In contrast to most known actuation mechanisms in similar systems, this new mechanism does not involve an electronic current nor external ac fields. Instead, the mechanism relies on deflection-dependent tunneling rates and a heat flow which is mediated by an electron-electron interaction while an electronic current through the device is prohibited by, for instance, a spin-valve effect. Therefore, the system resembles a nanoelectromechanical heat engine. We derive a criterion for the mechanical instability and estimate the amplitude of the resulting self-sustained oscillations. Estimations show that the suggested phenomenon can be studied using available experimental techniques.

  17. Electron-phonon interaction spectra in beryllium

    Energy Technology Data Exchange (ETDEWEB)

    Najdyuk, Yu.G.; Shklyarevskij, O.I. (AN Ukrainskoj SSR, Kharkov. Fiziko-Tekhnicheskij Inst. Nizkikh Temperatur)


    Micro-contact (MC) method was used to investigate spectra of electron-phonon interaction (EPI) in berillium. MC spectra and the known dependences of phonon state density in this metal have been compared in detail. It is shown that the MC spectra can be used for refining the berillium phonon spectrum. The EPI integral parameter has been determined in the free electron model.

  18. The Electron Transport Chain: An Interactive Simulation (United States)

    Romero, Chris; Choun, James


    This activity provides students an interactive demonstration of the electron transport chain and chemiosmosis during aerobic respiration. Students use simple, everyday objects as hydrogen ions and electrons and play the roles of the various proteins embedded in the inner mitochondrial membrane to show how this specific process in cellular…

  19. Quantum correlations in a long range interaction spin chain (United States)

    Li, Bo; Wang, Yan-Shen


    We propose a new type of long range interaction spin chain. The quantum correlations such as quantum discord, entanglement, and structure factor are investigated in the thermal state with considering them both in zero temperature and finite temperature. Based on our results, we compare the differences and show the relations between the three types of quantum correlations in this long range interaction model.

  20. Noncovalent Interactions in Organic Electronic Materials

    KAUST Repository

    Ravva, Mahesh Kumar


    In this chapter, we provide an overview of how noncovalent interactions, determined by the chemical structure of π-conjugated molecules and polymers, govern essential aspects of the electronic, optical, and mechanical characteristics of organic semiconductors. We begin by describing general aspects of materials design, including the wide variety of chemistries exploited to control the electronic and optical properties of these materials. We then discuss explicit examples of how the study of noncovalent interactions can provide deeper chemical insights that can improve the design of new generations of organic electronic materials.

  1. Infinite matter properties and zero-range limit of non-relativistic finite-range interactions

    Energy Technology Data Exchange (ETDEWEB)

    Davesne, D. [Université de Lyon, Université Lyon 1, CNRS/IN2P3, Institut de Physique Nucléaire de Lyon, UMR 5822, F-69622 Villeurbanne cedex (France); Becker, P., E-mail: [Université de Lyon, Université Lyon 1, CNRS/IN2P3, Institut de Physique Nucléaire de Lyon, UMR 5822, F-69622 Villeurbanne cedex (France); Pastore, A. [Department of Physics, University of York, Heslington, York, Y010 5DD (United Kingdom); Navarro, J. [IFIC (CSIC-Universidad de Valencia), Apartado Postal 22085, E-46.071-Valencia (Spain)


    We discuss some infinite matter properties of two finite-range interactions widely used for nuclear structure calculations, namely Gogny and M3Y interactions. We show that some useful informations can be deduced for the central, tensor and spin–orbit terms from the spin–isospin channels and the partial wave decomposition of the symmetric nuclear matter equation of state. We show in particular that the central part of the Gogny interaction should benefit from the introduction of a third Gaussian and the tensor parameters of both interactions can be deduced from special combinations of partial waves. We also discuss the fact that the spin–orbit of the M3Y interaction is not compatible with local gauge invariance. Finally, we show that the zero-range limit of both families of interactions coincides with the specific form of the zero-range Skyrme interaction extended to higher momentum orders and we emphasize from this analogy its benefits.

  2. Study of electron-positron interactions

    Energy Technology Data Exchange (ETDEWEB)

    Abashian, A.; Gotow, K.; Philonen, L.


    For the past seven years, this group has been interested in the study of tests of the Standard Model of Electroweak interactions. The program has centered about the AMY experiment which examines the nature of the final state products in electron-positron collisions in the center of mass energy range near 60 GeV. Results of these measurements have shown a remarkable consistency with the predictions of the minimal model of 3 quark and lepton generations and single charged and neutral intermediate bosons. No new particles or excited states have been observed nor has any evidence for departures in cross sections or angular asymmetries from expectations been observed. These conclusions have been even more firmly established by the higher energy results from the LEP and SLC colliders at center of mass energies of about 90 GeV. Our focus is shifting to the neutrino as a probe to electroweak interactions. The relative merit of attempting to observe neutrinos from point sources versus observing neutrinos generally is not easy to predict. The improved ability to interpret is offset by the probably episodic nature of the emission and irreproducibility of the results. In this phase of development, it is best to be sensitive to both sources of neutrinos. As a second phase of our program at Virginia Tech, we are studying the feasibility of detecting cosmic ray neutrinos in a proposed experiment which we have called NOVA. the results of the test setup will be instrumental in developing an optimum design. A third program we are involved in is the MEGA experiment at Los Alamos, an experiment to place a limit on the rate of muon decay to electron plus photon which is forbidden by the Standard Model.

  3. Electron-electron Interaction and Thermoelectricity in Graphene (United States)

    Ghahari, Fereshte; Zuev, Yuri; Forsythe, Carlos; Watanabe, Kenji; Taniguchi, Takashi; Kim, Philip


    In this presentation, we report thermoelectric power (TEP) measurements on graphene samples deposited on hexagonal boron nitride substrates where drastic suppression of disorder is achieved. Our results show that at high temperatures where the inelastic scattering rate due to electron-electron (e-e) interactions is higher than the disorder induced elastic scattering rate, the measured TEP deviates from the Mott relation, and can be explained by a non-relativistic hydrodynamic flow of electrons. We also investigated TEP in the quantum Hall regime at a high magnetic fields, where we observed symmetry broken integer quantum Hall due to the strong e-e interactions. The field dependence of TEP at these states reveals the important role that exchange interactions play.

  4. Characteristics of different frequency ranges in scanning electron microscope images

    Energy Technology Data Exchange (ETDEWEB)

    Sim, K. S., E-mail:; Nia, M. E.; Tan, T. L.; Tso, C. P.; Ee, C. S. [Faculty of Engineering and Technology, Multimedia University, 75450 Melaka (Malaysia)


    We demonstrate a new approach to characterize the frequency range in general scanning electron microscope (SEM) images. First, pure frequency images are generated from low frequency to high frequency, and then, the magnification of each type of frequency image is implemented. By comparing the edge percentage of the SEM image to the self-generated frequency images, we can define the frequency ranges of the SEM images. Characterization of frequency ranges of SEM images benefits further processing and analysis of those SEM images, such as in noise filtering and contrast enhancement.

  5. Electron-electron Interactions in ABC-stacked Multilayer Graphene (United States)

    Zhang, Fan; MacDonald, Allan


    The electronic band structures of ABC-stacked multilayer graphene systems are obtained by the tight-binding calculation and the density function theory. We predict that the electron- electron interactions drive the neutral graphene multilayer systems to pseudospin magnets in which the charge density contribution spontaneously shifts to either the top or the bottom layers, based on the HF and PRG calculations. We show that the spin and valley degrees of freedom enhance the instabilities. We investigate the influence on the broken symmetry phase by the trigonal warping, the external electric field and the number of coupled graphene layers.

  6. Microscopic effective interaction between electrons: Application to sodium clusters (United States)

    Lipparini, E.; Serra, Ll.; Takayanagi, K.


    The effects of short-range electronic correlations on the properties of sodium clusters are studied using the Brueckner g matrix as an effective interaction which describes the scattering of two electrons in the presence of a many-electron medium. The associated cluster Hamiltonian is solved within the Hartree-Fock approximation for the ground state and the dipole plasmon resonance is studied using the self-consistent random-phase approximation. Effects due to ionic core electrons are considered within the pseudojellium model of metal cluster, which goes beyond jellium by using ionic pseudo-Hamiltonians.

  7. Studying electron-PAG interactions using electron-induced fluorescence (United States)

    Narasimhan, Amrit; Grzeskowiak, Steven; Ostrander, Jonathan; Schad, Jonathon; Rebeyev, Eliran; Neisser, Mark; Ocola, Leonidas E.; Denbeaux, Gregory; Brainard, Robert L.


    In extreme ultraviolet (EUV) lithography, 92 eV photons are used to expose photoresists. Typical EUV resists are organic-based and chemically amplified using photoacid generators (PAGs). Upon exposure, PAGs produce acids which catalyze reactions that result in changes in solubility. In EUV lithography, photo- and secondary electrons (energies of 10- 80 eV) play a large role in PAG acid-production. Several mechanisms for electron-PAG interactions (e.g. electron trapping, and hole-initiated chemistry) have been proposed. The aim of this study is to explore another mechanism - internal excitation - in which a bound PAG electron can be excited by receiving energy from another energetic electron, causing a reaction that produces acid. This paper explores the mechanism of internal excitation through the analogous process of electron-induced fluorescence, in which an electron loses energy by transferring that energy to a molecule and that molecule emits a photon rather than decomposing. We will show and quantify electron-induced fluorescence of several fluorophores in polymer films to mimic resist materials, and use this information to refine our proposed mechanism. Relationships between the molecular structure of fluorophores and fluorescent quantum yield may aid in the development of novel PAGs for EUV lithography.

  8. 3D Simulations of Ultra-small MOSFETs with Real-space Treatment of the ElectronElectron and Electron-ion Interactions


    Gross, W. J.; Vasileska, D.; Ferry, D. K.


    We present a 3D Ensemble Monte Carlo particle-based simulator with a novel realspace treatment of the short-range electronelectron and electron-ion interactions. By using a corrected Coulomb force in conjunction with a proper cutoff range, the shortrange portion of the force is properly accounted for, and the ‘double counting’ of the long-range interaction is eliminated. The proposed method naturally incorporates the multi-ion contributions, local distortions in the scatteri...

  9. Long-range interactions in dilute granular systems

    NARCIS (Netherlands)

    Müller, M.K


    In this thesis, on purpose, we focussed on the most challenging, longest ranging potentials. We analyzed granular media of low densities obeying 1/r long-range interaction potentials between the granules. Such systems are termed granular gases and differ in their behavior from ordinary gases by

  10. Entanglement Growth in Quench Dynamics with Variable Range Interactions

    Directory of Open Access Journals (Sweden)

    J. Schachenmayer


    Full Text Available Studying entanglement growth in quantum dynamics provides both insight into the underlying microscopic processes and information about the complexity of the quantum states, which is related to the efficiency of simulations on classical computers. Recently, experiments with trapped ions, polar molecules, and Rydberg excitations have provided new opportunities to observe dynamics with long-range interactions. We explore nonequilibrium coherent dynamics after a quantum quench in such systems, identifying qualitatively different behavior as the exponent of algebraically decaying spin-spin interactions in a transverse Ising chain is varied. Computing the buildup of bipartite entanglement as well as mutual information between distant spins, we identify linear growth of entanglement entropy corresponding to propagation of quasiparticles for shorter-range interactions, with the maximum rate of growth occurring when the Hamiltonian parameters match those for the quantum phase transition. Counterintuitively, the growth of bipartite entanglement for long-range interactions is only logarithmic for most regimes, i.e., substantially slower than for shorter-range interactions. Experiments with trapped ions allow for the realization of this system with a tunable interaction range, and we show that the different phenomena are robust for finite system sizes and in the presence of noise. These results can act as a direct guide for the generation of large-scale entanglement in such experiments, towards a regime where the entanglement growth can render existing classical simulations inefficient.


    Energy Technology Data Exchange (ETDEWEB)



    To facilitate the study of collisions between 10 GeV polarized electrons and 100 GeV/u heavy ions or 250 GeV polarized protons at luminosities in the 10{sup 33} cm{sup -2} sec{sup -1} range (e-p case), adding a 10 GeV electron storage ring to the existing RHIC complex has been proposed. The interaction region of this electron-ion collider eRHIC has to provide the required low-beta focusing, while simultaneously accommodating the synchrotron radiation fan generated by beam separation close to the interaction point, which is particularly challenging. The latest design status of the eRHIC interaction region will be presented.

  12. Long-range interactions in lattice field theory

    Energy Technology Data Exchange (ETDEWEB)

    Rabin, J.M.


    Lattice quantum field theories containing fermions can be formulated in a chirally invariant way provided long-range interactions are introduced. It is established that in weak-coupling perturbation theory such a lattice theory is renormalizable when the corresponding continuum theory is, and that the continuum theory is indeed recovered in the perturbative continuum limit. In the strong-coupling limit of these theories one is led to study an effective Hamiltonian describing a Heisenberg antiferromagnet with long-range interactions. Block-spin renormalization group methods are used to find a critical rate of falloff of the interactions, approximately as inverse distance squared, which separates a nearest-neighbor-antiferromagnetic phase from a phase displaying identifiable long-range effects. A duality-type symmetry is present in some block-spin calculations.

  13. Long-range interaction between heterogeneously charged membranes. (United States)

    Jho, Y S; Brewster, R; Safran, S A; Pincus, P A


    Despite their neutrality, surfaces or membranes with equal amounts of positive and negative charge can exhibit long-range electrostatic interactions if the surface charge is heterogeneous; this can happen when the surface charges form finite-size domain structures. These domains can be formed in lipid membranes where the balance of the different ranges of strong but short-ranged hydrophobic interactions and longer-ranged electrostatic repulsion result in a finite, stable domain size. If the domain size is large enough, oppositely charged domains in two opposing surfaces or membranes can be strongly correlated by the electrostatic interactions; these correlations give rise to an attractive interaction of the two membranes or surfaces over separations on the order of the domain size. We use numerical simulations to demonstrate the existence of strong attractions at separations of tens of nanometers. Large line tensions result in larger domains but also increase the charge density within the domain. This promotes correlations and, as a result, increases the intermembrane attraction. On the other hand, increasing the salt concentration increases both the domain size and degree of domain anticorrelation, but the interactions are ultimately reduced due to increased screening. The result is a decrease in the net attraction as salt concentration is increased. © 2011 American Chemical Society

  14. Energy transport in the presence of long-range interactions (United States)

    Bagchi, Debarshee


    We study energy transport in the paradigmatic Hamiltonian mean-field (HMF) model and other related long-range interacting models using molecular dynamics simulations. We show that energy diffusion in the HMF model is subdiffusive in nature, which confirms a recently obtained intriguing result that, despite being globally interacting, this model is a thermal insulator in the thermodynamic limit. Surprisingly, when additional nearest-neighbor interactions are introduced to the HMF model, an energy superdiffusion is observed. We show that these results can be consistently explained by studying energy localization due to thermally generated intrinsic localized excitation modes (discrete breathers) in nonlinear discrete systems. Our analysis for the HMF model can also be readily extended to more generic long-range interacting models where the interaction strength decays algebraically with the (shortest) distance between two lattice sites. This reconciles many of the apparently counterintuitive results presented recently [C. Olivares and C. Anteneodo, Phys. Rev. E 94, 042117 (2016), 10.1103/PhysRevE.94.042117; D. Bagchi, Phys. Rev. E 95, 032102 (2017), 10.1103/PhysRevE.95.032102] concerning energy transport in two such long-range interacting models.

  15. Many-Body Localization with Long-Range Interactions (United States)

    Nandkishore, Rahul M.; Sondhi, S. L.


    Many-body localization (MBL) has emerged as a powerful paradigm for understanding nonequilibrium quantum dynamics. Folklore based on perturbative arguments holds that MBL arises only in systems with short-range interactions. Here, we advance nonperturbative arguments indicating that MBL can arise in systems with long-range (Coulomb) interactions, through a mechanism we dub "order enabled localization." In particular, we show using bosonization that MBL can arise in one-dimensional systems with ˜r interactions, a problem that exhibits charge confinement. We also argue that (through the Anderson-Higgs mechanism) MBL can arise in two-dimensional systems with log r interactions, and speculate that our arguments may even extend to three-dimensional systems with 1 /r interactions. Our arguments are asymptotic (i.e., valid up to rare region corrections), yet they open the door to investigation of MBL physics in a wide array of long-range interacting systems where such physics was previously believed not to arise.

  16. Many-Body Localization with Long-Range Interactions

    Directory of Open Access Journals (Sweden)

    Rahul M. Nandkishore


    Full Text Available Many-body localization (MBL has emerged as a powerful paradigm for understanding nonequilibrium quantum dynamics. Folklore based on perturbative arguments holds that MBL arises only in systems with short-range interactions. Here, we advance nonperturbative arguments indicating that MBL can arise in systems with long-range (Coulomb interactions, through a mechanism we dub “order enabled localization.” In particular, we show using bosonization that MBL can arise in one-dimensional systems with ∼r interactions, a problem that exhibits charge confinement. We also argue that (through the Anderson-Higgs mechanism MBL can arise in two-dimensional systems with logr interactions, and speculate that our arguments may even extend to three-dimensional systems with 1/r interactions. Our arguments are asymptotic (i.e., valid up to rare region corrections, yet they open the door to investigation of MBL physics in a wide array of long-range interacting systems where such physics was previously believed not to arise.

  17. Helioseismology with long-range dark matter-baryon interactions

    DEFF Research Database (Denmark)

    Lopes, I.; Panci, Paolo; Silk, J.


    the agreement between the best solar model and the helioseismic data without being excluded by direct detection experiments. In particular, the LUX detector will soon be able to either constrain or confirm our best-fit solar model in the presence of a dark sector with long-range interactions that reconcile......Assuming the existence of a primordial asymmetry in the dark sector, we study how long-range dark matter (DM)-baryon interactions, induced by the kinetic mixing of a new U(1) gauge boson and a photon, affect the evolution of the Sun and, in turn, the sound speed the profile obtained from...

  18. Effective electron-electron and electron-phonon interactions in the Hubbard-Holstein model

    Energy Technology Data Exchange (ETDEWEB)

    Aprea, G. [INFM-CNR SMC Center, and Dipartimento di Fisica, Universita di Roma ' La Sapienza' , piazzale Aldo Moro 5, I-00185 Rome (Italy); Di Castro, C. [INFM-CNR SMC Center, and Dipartimento di Fisica, Universita di Roma ' La Sapienza' , piazzale Aldo Moro 5, I-00185 Rome (Italy); Grilli, M. [INFM-CNR SMC Center, and Dipartimento di Fisica, Universita di Roma ' La Sapienza' , piazzale Aldo Moro 5, I-00185 Rome (Italy)]. E-mail; Lorenzana, J. [INFM-CNR SMC Center, and Dipartimento di Fisica, Universita di Roma ' La Sapienza' , piazzale Aldo Moro 5, I-00185 Rome (Italy)


    We investigate the interplay between the electron-electron and the electron-phonon interaction in the Hubbard-Holstein model. We implement the flow-equation method to investigate within this model the effect of correlation on the electron-phonon effective coupling and, conversely, the effect of phonons in the effective electron-electron interaction. Using this technique we obtain analytical momentum-dependent expressions for the effective couplings and we study their behavior for different physical regimes. In agreement with other works on this subject, we find that the electron-electron attraction mediated by phonons in the presence of Hubbard repulsion is peaked at low transferred momenta. The role of the characteristic energies involved is also analyzed.

  19. Non-diffracting multi-electron vortex beams balancing their electron-electron interactions. (United States)

    Mutzafi, Maor; Kaminer, Ido; Harari, Gal; Segev, Mordechai


    The wave-like nature of electrons has been known for almost a century, but only in recent years has the ability to shape the wavefunction of EBeams (Electron-Beams) become experimentally accessible. Various EBeam wavefunctions have been demonstrated, such as vortex, self-accelerating, Bessel EBeams etc. However, none has attempted to manipulate multi-electron beams, because the repulsion between electrons rapidly alters the beam shape. Here, we show how interference effects of the quantum wavefunction describing multiple electrons can be used to exactly balance both the repulsion and diffraction-broadening. We propose non-diffracting wavepackets of multiple electrons, which can also carry orbital angular momentum. Such wavefunction shaping facilitates the use of multi-electron beams in electron microscopy with higher current without compromising on spatial resolution. Simulating the quantum evolution in three-dimensions and time, we show that imprinting such wavefunctions on electron pulses leads to shape-preserving multi-electrons ultrashort pulses. Our scheme applies to any beams of charged particles, such as protons and ion beams.Vortex electron beams are generated using single electrons but their low beam-density is a limitation in electron microscopy. Here the authors propose a scheme for the realization of non-diffracting electron beams by shaping wavepackets of multiple electrons and including electron-electron interactions.

  20. Properties of Fermi liquids with a finite range interaction

    Energy Technology Data Exchange (ETDEWEB)

    Nozieres, P. (Institut Max von Laue - Paul Langevin (ILL), 38 - Grenoble (France))


    Following a suggestion of Khodel' and Shaginyan (KS), it is shown that a Hartree Fock description of Fermi liquids can lead to very strange results when the interaction has long range. For instance, the sharp drop of particle distribution at the Fermi level can be smeared over a finite k-range, with a flat plateau in the quasiparticle energy. In practice, such an effect appears as an artefact of the Hartree Fock approximation. The KS effect occurs only for an attraction, in which case it is hidden by superconductivity. Moreover, the enhanced quasiparticle collision rate makes the Hartree Fock approximation untenable. Finally, screening of a strong long range interaction is such that the instability threshold cannot be reached.

  1. Electron scattering from neon via effective range theory

    Energy Technology Data Exchange (ETDEWEB)

    Fedus, Kamil, E-mail: [Institute of Physics, Faculty of Physics, Astronomy and Informatics, Nicolaus Copernicus University, Torun (Poland)


    Elastic cross-sections for electron scattering on neon from 0 energy up to 16 eV are analyzed by an analytical approach to the modified effective range theory (MERT). It is shown that energy and angular variations of elastic differential, integral and momentum transfer cross sections can be accurately parameterized by six MERT coefficients up to the energy threshold for the first Feshbach resonance. MERT parameters are determined empirically by numerical comparison with large collection of available experimental data of elastic total (integral) cross-sections. The present analysis is validated against numerous electron beams and swarm experiments. The comparison of derived MERT parameters with those found for other noble gases, helium, argon and krypton, is done. The derived scattering length (for the s-partial wave) in neon, 0.227a0, agrees well with recent theories; it is small but, differently from Ar and Kr, still positive. Analogue parameters for the p-wave and the d-wave are negative and positive respectively for all the four gases compared. (author)

  2. Profile Monitors for Wide Multiplicity Range Electron Beams

    CERN Document Server

    Buonomo, B; Quintieri, L


    The DAFNE Beam Test Facility (BTF) provides electron and positron beams in a wide range of intensity, from single particle up to 1010 particles per pulse, and energy, from a few tens of MeV up to 800 MeV. The pulse time width can be adjusted between 1 and 10 ns and the maximum repetition rate is 50 Hz. The large range of operation of the facility requires the implementation of different beam profile and multiplicity monitors. In the single particle operation mode the beam spot profile and position are measured by a x-y scintillating fiber system with millimetric resolution and multi-anode PMT readout. From a few tens up to 106-107 particles per pulse, a silicon chamber made of two 9.5x9.5 cm2 wide 400μm thick silicon strip detectors organized in a x-y configuration with a pitch of 121μm has been developed. Once calibrated, the system can be used also as an intensity monitor. The description of the devices and the results obtained during the data taking periods of several experiments at the...

  3. Gas–Electron Interaction in the ETEM

    DEFF Research Database (Denmark)


    Imaging in a differential pumped environmental TEM (ETEM) results in general in a degradation of the image quality. Scattering of electrons by gas molecules in the pressurized volume between the pole pieces blurs the image and decreases the signal-to-noise ratio of the acquired images. The somewhat...... simple picture of a plane wave interacting with the sample of interest is no longer valid. Furthermore, the exit wave from the sample is altered by scattering events taking place after the sample in the direction of propagation. In this chapter, the effect of the increased gas pressure between the pole...... pieces in an aberration-corrected highresolution transmission electron microscope is discussed in order to shine some light on the additional phenomena occurring in ETEM compared to conventional HRTEM. Both direct effects on the image quality and more indirect effects rising from gas ionization...

  4. Interaction of electron neutrino with LSD detector (United States)

    Ryazhskaya, O. G.; Semenov, S. V.


    The interaction of electron neutrino flux, originating in the rotational collapse mechanism on the first stage of Supernova burst, with the LSD detector components, such as 56Fe (a large amount of this metal is included in as shielding material) and liquid scintillator barNnH2n+2, is being investigated. Both charged and neutral channels of neutrino reaction with 12barN and 56Fe are considered. Experimental data, giving the possibility to extract information for nuclear matrix elements calculation are used. The number of signals, produced in LSD by the neutrino pulse of Supernova 1987A is determined. The obtained results are in good agreement with experimental data.

  5. Three methods for estimating a range of vehicular interactions (United States)

    Krbálek, Milan; Apeltauer, Jiří; Apeltauer, Tomáš; Szabová, Zuzana


    We present three different approaches how to estimate the number of preceding cars influencing a decision-making procedure of a given driver moving in saturated traffic flows. The first method is based on correlation analysis, the second one evaluates (quantitatively) deviations from the main assumption in the convolution theorem for probability, and the third one operates with advanced instruments of the theory of counting processes (statistical rigidity). We demonstrate that universally-accepted premise on short-ranged traffic interactions may not be correct. All methods introduced have revealed that minimum number of actively-followed vehicles is two. It supports an actual idea that vehicular interactions are, in fact, middle-ranged. Furthermore, consistency between the estimations used is surprisingly credible. In all cases we have found that the interaction range (the number of actively-followed vehicles) drops with traffic density. Whereas drivers moving in congested regimes with lower density (around 30 vehicles per kilometer) react on four or five neighbors, drivers moving in high-density flows respond to two predecessors only.

  6. Interacting Flatland Electrons Never Stop Surprising (United States)

    Shayegan, Mansour


    I will present the highlights of several new magneto-transport experiments that probe the physics of interacting two-dimensional (2D) electrons (or holes) at high magnetic fields and low temperatures. These include: (1) observation of rare fractional quantum Hall states at even-denominator (1/2) filling factor in 2D hole systems at an unusual crossing of the two lowest Landau levels; (2) tuning and measuring the shape and anisotropy of the composite fermion (CF) Fermi contours, and (3) data suggesting that CFs themselves can be interacting and form their own fractional quantum Hall and Wigner solid states. I will also discuss a bilayer experiment where the CFs in one layer are used to probe an electron Wigner solid in the other layer. (Work done in collaboration with Yang Liu, D. Kamburov, M.A. Mueed, S. Hasdemir, I. Jo, H. Deng, L.N. Pfeiffer, K.W. West, and K.W. Baldwin. Supported by the NSF, DOE, Keck, and Moore Foundations.)

  7. Properties of Fermi liquids with a finite range interaction (United States)

    Nozières, Philippe


    Following a suggestion of Khodel' and Shaginyan (KS), it is shown that a Hartree Fock description of Fermi liquids can lead to very strange results when the interaction has long range. For instance, the sharp drop of particle distribution at the Fermi level can be smeared over a finite k-range, with a flat plateau in the quasiparticle energy. In practice, such an effect appears as an artefact of the Hartree Fock approximation. The KS effect occurs only for an attraction, in which case it is hidden by superconductivity. Moreover, the enhanced quasiparticle collision rate makes the Hartree Fock approximation untenable. Finally, screening of a strong long range interaction is such that the instability threshold cannot be reached. Partant d'une suggestion de Khodel' et Shaginyan (KS), on montre que la description d'un liquide de Fermi en Hartree Fock peut conduire à des résultats très étranges quand la portée de l'interaction est grande. Par exemple, la discontinuité de la distribution des particules au niveau de Fermi est étalée sur une bande de k finie, avec un plateau de l'énergie des quasiparticules. En fait, cet état est une conséquence de l'approximation de Hartree Fock. Il se produit seulement pour une attraction, auquel cas il est masqué par la supraconductivité. De plus, le renforcement des collisions entre quasiparticules rend l'approximation de Hartree Fock inutilisable. Enfin, l'écrantage d'une interaction forte et à longue portée ne permet pas d'atteindre le seuil d'instabilité.

  8. Constraining nonstandard neutrino interactions with electrons (United States)

    Forero, D. V.; Guzzo, M. M.


    We update the phenomenological constraints of the nonstandard neutrino interactions (NSNI) with electrons including in the analysis, for the first time, data from LAMPF, Krasnoyarsk, and the latest Texono observations. We assume that NSNI modify the cross section of elastic scattering of (anti)neutrinos off electrons, using reactor and accelerator data, and the cross section of the electron-positron annihilation, using the four LEP experiments, in particular, new data from DELPHI. We find more restrictive allowed regions for the NSNI parameters: -0.11<ɛeeeR<0.05 and -0.02<ɛeeeL<0.09 (90% C.L.). We also recalculate the parameters of tauonic flavor obtaining -0.35<ɛττeR<0.50 and -0.51<ɛττeL<0.34 (90% C.L.). Although more severe than the limits already present in the literature, our results indicate that NSNI are allowed by the present data as a subleading effect, and the standard electroweak model continues consistent with the experimental panorama at 90% C.L. Further improvement on this picture will deserve a lot of engagement of upcoming experiments.

  9. Electron scattering on the short-range potential of crystal lattice defects in gallium nitride

    Energy Technology Data Exchange (ETDEWEB)

    Malyk, Orest [Semiconductor Electronics Department, Lviv Polytechnic National University, Bandera Street 12, 79013 Lviv (Ukraine)


    The processes of the charge carrier scattering on the short-range potential caused by interaction with polar and nonpolar optical phonons, piezoelectric and acoustic phonons, static strain, neutral and ionized impurities in wurtzite n-GaN with impurity concentration 4 x 10{sup 16}-2 x 10{sup 19} cm{sup -3} are considered. The temperature dependences of electron mobility in the range 40-500 K are calculated. (copyright 2012 WILEY-VCH Verlag GmbH and Co. KGaA, Weinheim) (orig.)

  10. Electron-electron interactions in graphene field-induced quantum dots in a high magnetic field

    DEFF Research Database (Denmark)

    Orlof, A.; Shylau, Artsem; Zozoulenko, I. V.


    We study the effect of electron-electron interaction in graphene quantum dots defined by an external electrostatic potential and a high magnetic field. To account for the electron-electron interaction, we use the Thomas-Fermi approximation and find that electron screening causes the formation...

  11. Observation of prethermalization in long-range interacting spin chains (United States)

    Neyenhuis, Brian; Zhang, Jiehang; Hess, Paul W.; Smith, Jacob; Lee, Aaron C.; Richerme, Phil; Gong, Zhe-Xuan; Gorshkov, Alexey V.; Monroe, Christopher


    Although statistical mechanics describes thermal equilibrium states, these states may or may not emerge dynamically for a subsystem of an isolated quantum many-body system. For instance, quantum systems that are near-integrable usually fail to thermalize in an experimentally realistic time scale, and instead relax to quasi-stationary prethermal states that can be described by statistical mechanics, when approximately conserved quantities are included in a generalized Gibbs ensemble (GGE). We experimentally study the relaxation dynamics of a chain of up to 22 spins evolving under a long-range transverse-field Ising Hamiltonian following a sudden quench. For sufficiently long-range interactions, the system relaxes to a new type of prethermal state that retains a strong memory of the initial conditions. However, the prethermal state in this case cannot be described by a standard GGE; it rather arises from an emergent double-well potential felt by the spin excitations. This result shows that prethermalization occurs in a broader context than previously thought, and reveals new challenges for a generic understanding of the thermalization of quantum systems, particularly in the presence of long-range interactions. PMID:28875166

  12. Prototype system for proton beam range measurement based on gamma electron vertex imaging

    Energy Technology Data Exchange (ETDEWEB)

    Lee, Han Rim [Neutron Utilization Technology Division, Korea Atomic Energy Research Institute, 111, Daedeok-daero 989beon-gil, Yuseong-gu, Daejeon 34057 (Korea, Republic of); Kim, Sung Hun; Park, Jong Hoon [Department of Nuclear Engineering, Hanyang University, Seongdong-gu, Seoul 04763 (Korea, Republic of); Jung, Won Gyun [Heavy-ion Clinical Research Division, Korean Institute of Radiological & Medical Sciences, Seoul 01812 (Korea, Republic of); Lim, Hansang [Department of Electronics Convergence Engineering, Kwangwoon University, Seoul 01897 (Korea, Republic of); Kim, Chan Hyeong, E-mail: [Department of Nuclear Engineering, Hanyang University, Seongdong-gu, Seoul 04763 (Korea, Republic of)


    In proton therapy, for both therapeutic effectiveness and patient safety, it is very important to accurately measure the proton dose distribution, especially the range of the proton beam. For this purpose, recently we proposed a new imaging method named gamma electron vertex imaging (GEVI), in which the prompt gammas emitting from the nuclear reactions of the proton beam in the patient are converted to electrons, and then the converted electrons are tracked to determine the vertices of the prompt gammas, thereby producing a 2D image of the vertices. In the present study, we developed a prototype GEVI system, including dedicated signal processing and data acquisition systems, which consists of a beryllium plate (= electron converter) to convert the prompt gammas to electrons, two double-sided silicon strip detectors (= hodoscopes) to determine the trajectories of those converted electrons, and a plastic scintillation detector (= calorimeter) to measure their kinetic energies. The system uses triple coincidence logic and multiple energy windows to select only the events from prompt gammas. The detectors of the prototype GEVI system were evaluated for electronic noise level, energy resolution, and time resolution. Finally, the imaging capability of the GEVI system was tested by imaging a {sup 90}Sr beta source, a {sup 60}Co gamma source, and a 45-MeV proton beam in a PMMA phantom. The overall results of the present study generally show that the prototype GEVI system can image the vertices of the prompt gammas produced by the proton nuclear interactions.

  13. Variable range of the RKKY interaction in edged graphene

    DEFF Research Database (Denmark)

    Duffy, J M; Gorman, P D; Power, S R


    The indirect exchange interaction is one of the key factors in determining the overall alignment of magnetic impurities embedded in metallic host materials. In this work we examine the range of this interaction in magnetically doped graphene systems in the presence of armchair edges using...... a combination of analytical and numerical Green function approaches. We consider both a semi-infinite sheet of graphene with a single armchair edge, and also quasi-one-dimensional armchair-edged graphene nanoribbons (GNRs). While we find signals of the bulk decay rate in semi-infinite graphene and signals...... of the expected one-dimensional decay rate in GNRs, we also find an unusually rapid decay for certain instances in both, which manifests itself whenever the impurities are located at sites which are a multiple of three atoms from the edge. This decay behavior emerges from both the analytic and numerical...

  14. Ab initio electron propagators in molecules with strong electron-phonon interaction: II. Electron Green's function. (United States)

    Dahnovsky, Yuri


    Ab initio electron propagator methods are developed to study electronic properties of molecular systems with strong electron-electron and electron-phonon interactions. For the calculation of electron Green's functions we apply a canonical small polaron transformation that intrinsically contains strong electron-phonon effects. In the transformed Hamiltonian, the energy levels for the noninteracting particles are shifted down by the relaxation (solvation) energies. The Coulomb integrals are also renormalized by the electron-phonon interaction. For certain values of the electron-phonon coupling constants, the renormalized Coulomb integrals can be negative which implies the attraction between two electrons. Within the small polaron transformation we develop a diagrammatic technique for the calculation of electron Green's function in which the electron-phonon interaction is already included into the multiple phonon correlation functions. Since the decoupling of the phonon correlation functions is impossible, and therefore, a Wick's theorem for such correlation functions is invalid, there is no Dyson equation for the electron Green's function. To find the electron Green's function, we use different approximations. One of them is a link-cluster approximation that includes diagonal transitions for the renormalized zeroth Green's function. In the linked-cluster approach the Dyson equation is derived in the most general case, where the self-energy operator is an arbitrary functional (not only in the Hartree-Fock approximation). It is shown that even a Hartree-Fock electron (hole) is not a particle any longer. It is a quasiparticle with a finite lifetime that depends on energy of particle and hole states in different ways. As a consequence of this, a standard description of a Hartree-Fock approximation in terms of wave functions becomes inappropriate in this problem. To challenge the linked-cluster approximation we develop a different approach: a sequential propagation

  15. Thioarsenides: A case for long-range Lewis acid-base-directed van der Waals interactions

    Energy Technology Data Exchange (ETDEWEB)

    Gibbs, Gerald V.; Wallace, Adam F.; Downs, R. T.; Ross, Nancy L.; Cox, David F.; Rosso, Kevin M.


    Electron density distributions, bond paths, Laplacian and local energy density properties have been calculated for a number of As4Sn (n = 3,4,5) thioarsenide molecular crystals. On the basis of the distributions, the intramolecular As-S and As-As interactions classify as shared bonded interactions and the intermolecular As-S, As-As and S-S interactions classify as closed-shell van der Waals bonded interactions. The bulk of the intermolecular As-S bond paths link regions of locally concentrated electron density (Lewis base regions) with aligned regions of locally depleted electron density (Lewis acid regions) on adjacent molecules. The paths are comparable with intermolecular paths reported for several other molecular crystals that link aligned Lewis base and acid regions in a key-lock fashion, interactions that classified as long range Lewis acid-base directed van der Waals interactions. As the bulk of the intermolecular As-S bond paths (~70%) link Lewis acid-base regions on adjacent molecules, it appears that molecules adopt an arrangement that maximizes the number of As-S Lewis acid-base intermolecular bonded interactions. The maximization of the number of Lewis acid-base interactions appears to be connected with the close-packed array adopted by molecules: distorted cubic close-packed arrays are adopted for alacránite, pararealgar, uzonite, realgar and β-AsS and the distorted hexagonal close-packed arrays adopted by α- and β-dimorphite. A growth mechanism is proposed for thioarsenide molecular crystals from aqueous species that maximizes the number of long range Lewis acid-base vdW As-S bonded interactions with the resulting directed bond paths structuralizing the molecules as a molecular crystal.

  16. Thioarsenides: a case for long-range Lewis acid-base-directed van der Waals interactions (United States)

    Gibbs, G. V.; Wallace, A. F.; Downs, R. T.; Ross, N. L.; Cox, D. F.; Rosso, K. M.


    Electron density distributions, bond paths, Laplacian and local-energy density properties have been calculated for a number of As4S n ( n = 3, 4 and 5) thioarsenide molecular crystals. On the basis of the distributions, the intramolecular As-S and As-As interactions classify as shared bonded interactions, and the intermolecular As-S, As-As and S-S interactions classify as closed-shell van der Waals (vdW) bonded interactions. The bulk of the intermolecular As-S bond paths link regions of locally concentrated electron density (Lewis-base regions) with aligned regions of locally depleted electron density (Lewis-acid regions) on adjacent molecules. The paths are comparable with intermolecular paths reported for several other molecular crystals that link aligned Lewis base and acid regions in a key-lock fashion, interactions that classified as long-range Lewis acid-base-directed vdW interactions. As the bulk of the intermolecular As-S bond paths (~70%) link Lewis acid-base regions on adjacent molecules, it appears that molecules adopt an arrangement that maximizes the number of As-S Lewis acid-base intermolecular bonded interactions. The maximization of the number of Lewis acid-base interactions appears to be connected with the close-packed array adopted by molecules: distorted cubic close-packed arrays are adopted for alacránite, pararealgar, uzonite, realgar and β-AsS and the distorted hexagonal close-packed arrays adopted by α- and β-dimorphite. A growth mechanism is proposed for thioarsenide molecular crystals from aqueous species that maximizes the number of long-range Lewis acid-base vdW As-S bonded interactions with the resulting directed bond paths structuralizing the molecules as a molecular crystal.

  17. Wide-Range Probing of Dzyaloshinskii-Moriya Interaction (United States)

    Kim, Duck-Ho; Yoo, Sang-Cheol; Kim, Dae-Yun; Min, Byoung-Chul; Choe, Sug-Bong


    The Dzyaloshinskii-Moriya interaction (DMI) in magnetic objects is of enormous interest, because it generates built-in chirality of magnetic domain walls (DWs) and topologically protected skyrmions, leading to efficient motion driven by spin-orbit torques. Because of its importance for both potential applications and fundamental research, many experimental efforts have been devoted to DMI investigation. However, current experimental probing techniques cover only limited ranges of the DMI strength and have specific sample requirements. Thus, there are no versatile methods to quantify DMI over a wide range of values. Here, we present such an experimental scheme, which is based on the angular dependence of asymmetric DW motion. This method can be used to determine values of DMI much larger than the maximum strength of the external magnetic field strength, which demonstrates that various DMI strengths can be quantified with a single measurement setup. This scheme may thus prove essential to DMI-related emerging fields in nanotechnology.

  18. Designing tangible interaction using short-range RFID

    Directory of Open Access Journals (Sweden)

    Kjetil Nordby


    Full Text Available Short-range Radio Frequency IDentification (SR-RFID technology embedded in mobile phones offers interaction design practitioners the potential to design new forms of mobile experiences. The article presents a design oriented research study that seeks to develop affordances specifically in support of such practice. To do so the authors draw on Activity Theory. They present three levels of SR-RFID related design affordances: need related design affordances, instrumental design affordances and operational design affordances. Included also is what they label ‘RFID based Tap and Hold’; a term used so as to frame tangible interaction on SR-RFID. A generative and descriptive model of Tap and Hold is proposed, as is a set of input techniques derived from the Tap and Hold model. Overall, the study suggests opening out from functional views of SR-RFID to ones that view it as a technology applicable for designers exploring potential new interactions. This is important since such work may be used to support the generation of new designs, an area often overlooked in research on RFID.

  19. Two-electron atom with a screened interaction


    Downing, C. A.


    We present analytical solutions to a quantum-mechanical three-body problem in three dimensions, which describes a helium-like two-electron atom. Similarly to Hooke's atom, the Coulombic electron-nucleus interaction potentials are replaced by harmonic potentials. The electron-electron interaction potential is taken to be both screened (decaying faster than the inverse of the interparticle separation) and regularized (in the limit of zero separation). We reveal the exactly solvable few-electron...

  20. Fractional dynamics of coupled oscillators with long-range interaction. (United States)

    Tarasov, Vasily E; Zaslavsky, George M


    We consider a one-dimensional chain of coupled linear and nonlinear oscillators with long-range powerwise interaction. The corresponding term in dynamical equations is proportional to 1//n-m/alpha+1. It is shown that the equation of motion in the infrared limit can be transformed into the medium equation with the Riesz fractional derivative of order alpha, when 0coupled oscillators and show how their synchronization can appear as a result of bifurcation, and how the corresponding solutions depend on alpha. The presence of a fractional derivative also leads to the occurrence of localized structures. Particular solutions for fractional time-dependent complex Ginzburg-Landau (or nonlinear Schrodinger) equation are derived. These solutions are interpreted as synchronized states and localized structures of the oscillatory medium.

  1. Stable swarming using adaptive long-range interactions (United States)

    Gorbonos, Dan; Gov, Nir S.


    Sensory mechanisms in biology, from cells to humans, have the property of adaptivity, whereby the response produced by the sensor is adapted to the overall amplitude of the signal, reducing the sensitivity in the presence of strong stimulus, while increasing it when it is weak. This property is inherently energy consuming and a manifestation of the nonequilibrium nature of living organisms. We explore here how adaptivity affects the effective forces that organisms feel due to others in the context of a uniform swarm, in both two and three dimensions. The interactions between the individuals are taken to be attractive and long-range and of power-law form. We find that the effects of adaptivity inside the swarm are dramatic, where the effective forces decrease (or remain constant) with increasing swarm density. Linear stability analysis demonstrates how this property prevents collapse (Jeans instability), when the forces are adaptive. Adaptivity therefore endows swarms with a natural mechanism for self-stabilization.

  2. Dynamic response of a two-dimensional electron gas: Effect of short-range correlations in the ladder approximation (United States)

    Takayanagi, K.; Lipparini, E.


    The Dyson equation for the particle-hole Green's function, including exchange matrix elements, has been solved exactly for the effective interaction between two electrons in a two-dimensional electron gas. The effective interaction is obtained numerically by solving the Bethe-Goldstone integral equation in a two-dimensional electron gas. The effect of short-range correlations on static and dynamic dielectric functions is studied. Results are compared with the normal random-phase approximation, local-field theories, and recent quantum Monte Carlo results.

  3. The range and intensity of backscattered electrons for use in the creation of high fidelity electron beam lithography patterns. (United States)

    Czaplewski, David A; Holt, Martin V; Ocola, Leonidas E


    We present a set of universal curves that predict the range and intensity of backscattered electrons which can be used in conjunction with electron beam lithography to create high fidelity nanoscale patterns. The experimental method combines direct write dose, backscattered dose, and a self-reinforcing pattern geometry to measure the dose provided by backscattered electrons to a nanoscale volume on the substrate surface at various distances from the electron source. Electron beam lithography is used to precisely control the number and position of incident electrons on the surface of the material. Atomic force microscopy is used to measure the height of the negative electron beam lithography resist. Our data shows that the range and the intensity of backscattered electrons can be predicted using the density and the atomic number of any solid material, respectively. The data agrees with two independent Monte Carlo simulations without any fitting parameters. These measurements are the most accurate electron range measurements to date.

  4. The range and intensity of backscattered electrons for use in the creation of high fidelity electron beam lithography patterns (United States)

    Czaplewski, David A.; Holt, Martin V.; Ocola, Leonidas E.


    We present a set of universal curves that predict the range and intensity of backscattered electrons which can be used in conjunction with electron beam lithography to create high fidelity nanoscale patterns. The experimental method combines direct write dose, backscattered dose, and a self-reinforcing pattern geometry to measure the dose provided by backscattered electrons to a nanoscale volume on the substrate surface at various distances from the electron source. Electron beam lithography is used to precisely control the number and position of incident electrons on the surface of the material. Atomic force microscopy is used to measure the height of the negative electron beam lithography resist. Our data shows that the range and the intensity of backscattered electrons can be predicted using the density and the atomic number of any solid material, respectively. The data agrees with two independent Monte Carlo simulations without any fitting parameters. These measurements are the most accurate electron range measurements to date.

  5. A hybrid version of the SCAN functional including long-range dispersion interactions (United States)

    Ko, Hsin-Yu; Calegari Andrade, Marcos F.; Santra, Biswajit; Selloni, Annabella; Car, Roberto

    The recently developed meta-GGA density functional, called SCAN (strongly constrained and appropriately normed), provides an accurate description of the electronic structure in a broad class of systems characterized by different bonding interactions, including intermediate range van-der-Waals (vdW) bonding. Here we consider a hybrid version of the SCAN functional with inclusion of long-range vdW interactions via a re-parameterized Tkatchenko-Scheffler scheme. Calculations for the S22 molecular database, ice hexamer clusters, and bulk ice Ih indicate that this functional further improves the description of vdW and hydrogen bonding interactions. This work has been supported by the Department of Energy under Grants No. DE-SC0008626.

  6. D-state Rydberg electrons interacting with ultracold atoms

    Energy Technology Data Exchange (ETDEWEB)

    Krupp, Alexander Thorsten


    This thesis was established in the field of ultracold atoms where the interaction of highly excited D-state electrons with rubidium atoms was examined. This work is divided into two main parts: In the first part we study D-state Rydberg molecules resulting from the binding of a D-state Rydberg electron to a ground state rubidium atom. We show that we can address specific rovibrational molecular states by changing our laser detuning and thus create perfectly aligned axial or antialigned toroidal molecules, in good agreement with our theoretical calculations. Furthermore the influence of the electric field on the Rydberg molecules was investigated, creating novel states which show a different angular dependence and alignment. In the second part of this thesis we excite single D-state Rydberg electrons in a Bose-Einstein condensate. We study the lifetime of these Rydberg electrons, the change of the shape of our condensate and the atom losses in the condensate due to this process. Moreover, we observe quadrupolar shape oscillations of the whole condensate created by the consecutive excitation of Rydberg atoms and compare all results to previous S-state measurements. In the outlook we propose a wide range of further experiments including the proposal of imaging a single electron wavefunction by the imprint of its orbit into the Bose-Einstein condensate.

  7. Signature of electron-phonon interaction in high temperature superconductors

    Directory of Open Access Journals (Sweden)

    Vinod Ashokan


    Full Text Available The theory of thermal conductivity of high temperature superconductors (HTS based on electron and phonon line width (life times formulation is developed with Quantum dynamical approach of Green's function. The frequency line width is observed as an extremely sensitive quantity in the transport phenomena of HTS as a collection of large number of scattering processes. The role of resonance scattering and electron-phonon interaction processes is found to be most prominent near critical temperature. The theory successfully explains the spectacular behaviour of high Tc superconductors in the vicinity of transition temperature. A successful agreement between theory and experiment has been obtained by analyzing the thermal conductivity data for the sample La1.8Sr0.2CuO4 in the temperature range 0 − 200K. The theory is equally and successfully applicable to all other high Tc superconductors.

  8. A study of effective atomic numbers and electron densities of some vitamins for electron, H, He and C ion interactions (United States)

    Büyükyıldız, M.


    The radiological properties of some vitamins such as Retinol, Beta-carotene, Riboflavin, Niacin, Niacinamide, Pantothenic acid, Pyridoxine, Pyridoxamine, Pyridoxal, Biotin, Folic acid, Ascorbic acid, Cholecalciferol, Alpha-tocopherol, Gamma-tocopherol, Phylloquinone have been investigated with respect to total electron interaction and some heavy charged particle interaction as means of effective atomic numbers (Z_{eff}) and electron densities (N_{eff}) for the first time. Calculations were performed for total electron interaction and heavy ions such as H, He and C ion interactions in the energy region 10keV-10MeV by using a logarithmic interpolation method. Variations in Z_{eff}'s and N_{eff}'s of given vitamins have been studied according to the energy of electron or heavy charged particles, and significant variations have been observed for all types of interaction in the given energy region. The maximum values of Z_{eff} have been found in the different energy regions for different interactions remarkably and variations in N_{eff} seem approximately to be the same with variation in Z_{eff} for the given vitamins as expected. Z_{eff} values of some vitamins were plotted together and compared with each other for electron, H, He and C interactions and the ratios of Z_{eff}/ have been changed in the range of 0.25-0.36, 0.20-0.36, 0.22-0.35 and 0.20-0.35 for electron, H, He and C interactions, respectively.

  9. An effective attractive electron-electron interaction and high-Tc superconductivity

    Energy Technology Data Exchange (ETDEWEB)

    Howson, M.A.; Porter, J.; Morgan, G.J. (Dept. of Physics, Univ. of Leeds (UK))


    The repulsive Coulomb interaction is usually seen as opposing the attractive phonon mediated interaction giving rise to superconductivity. Here we show how the vertex part for electron-electron scattering can lead to an effective attractive Coulomb interaction. We then solve the Eliashberg equations with this effective vertex correction and calculate Tc for a model density of states as we vary the strength of the interaction and the effective mass of the electrons. (orig.).

  10. High Efficiency Electron-Laser Interactions in Tapered Helical Undulators (United States)

    Duris, Joseph Patrick

    Efficient coupling of relativistic electron beams with high power radiation lies at the heart of advanced accelerator and light source research and development. The inverse free electron laser is a stable accelerator capable of harnessing very high intensity laser electric fields to efficiently transfer large powers from lasers to electron beams. In this dissertation, we first present the theoretical framework to describe the interaction, and then apply our improved understanding of the IFEL to the design and numerical study of meter-long, GeV IFELs for compact light sources. The central experimental work of the dissertation is the UCLA BNL helical inverse free electron laser experiment at the Accelerator Test Facility in Brookhaven National Laboratory which used a strongly tapered 54cm long, helical, permanent magnet undulator and a several hundred GW CO2 laser to accelerate electrons from 52 to 106MeV, setting new records for inverse free electron laser energy gain (54MeV) and average accelerating gradient (100MeV/m). The undulator design and fabrication as well as experimental diagnostics are presented. In order to improve the stability and quality of the accelerated electron beam, we redesigned the undulator for a slightly reduced output energy by modifying the magnet gap throughout the undulator, and we used this modified undulator to demonstrated capture of >25% of the injected beam without prebunching. In the study of heavily loaded GeV inverse free electron lasers, we show that a majority of the power may be transferred from a laser to the accelerated electron beam. Reversing the process to decelerate high power electron beams, a mechanism we refer to as tapering enhanced stimulated superradiant amplification, offers a clear path to high power light sources. We present studies of radiation production for a wide range of wavelengths (10mum, 13nm, and 0.3nm) using this method and discuss the design for a deceleration experiment using the same undulator used

  11. Long-Range Photoinduced Electron Transfer Through a DNA Helix (United States)

    Murphy, C. J.; Arkin, M. R.; Jenkins, Y.; Ghatlia, N. D.; Bossmann, S. H.; Turro, N. J.; Barton, J. K.


    Rapid photoinduced electron transfer is demonstrated over a distance of greater than 40 angstroms between metallointercalators that are tethered to the 5' termini of a 15-base pair DNA duplex. An oligomeric assembly was synthesized in which the donor is Ru(phen)_2dppz^2+ (phen, phenanthroline, and dppz, dipyridophenazine) and the acceptor is Rh(phi)_2phen^3+ (phi, phenanthrenequinone diimine). These metal complexes are intercalated either one or two base steps m from the helix termini. Although the ruthenium-modified oligonucleotide hybridized to an unmodified complement luminesces intensely, the ruthenium-modified oligomer hybridized to the rhodium-modified oligomer shows no detectable luminescence. Time-resolved studies point to a lower limit of 109 per second for the quenching rate. No quenching was observed upon metallation of two complementary octamers by Ru(phen)_32+ and Rh(phen)_33+ under conditions where the phen complexes do not intercalate. The stacked aromatic heterocycles of the DNA duplex therefore serve as an efficient medium for coupling electron donors and acceptors over very long distances.

  12. Long-range photoinduced electron transfer through a DNA helix

    Energy Technology Data Exchange (ETDEWEB)

    Murphy, C.J.; Arkin, M.R.; Jenkins, Y.; Barton, J.K. (California Institute of Technology, Pasadena, CA (United States)); Ghatlia, N.D.; Bossmann, S.H.; Turro, N.J. (Columbia Univ., New York, NY (United States))


    Rapid photoinduced electron transfer is demonstrated over a distance of greater than 40 angstroms between metallointercalators that are tethered to the 5' termini of a 15-base pair DNA duplex. An oligomeric assembly was synthesized in which the donor is Ru(phen)[sub 2]dppz[sup 2+] (phen, phenanthroline, and dppz, dipyridophenazine) and the acceptor is Rh(phi)[sub 2]phen[sup 3+] (phi, phenanthrenequinone diimine). These metal complexes are intercalated either one or two base steps in from the helix termini. Although the ruthenium-modified oligonucleotide hybridized to an unmodified complement luminesces intensely, the ruthenium-modified oligomer hybridized to the rhodium-modified oligomer shows no detectable luminescence. Time-resolved studies point to a lower limit of 10[sup 9] per second for the quenching rate. No quenching was observed upon metallation of two complementary octamers by Ru(phen)[sub 3][sup 2+] and Rh(phen)[sub 3][sup 3+] under conditions where the phen complexes do not intercalate. The stacked aromatic heterocycles of the DNA duplex therefore serve as an efficient medium for coupling electron donors and acceptors over very long distances.

  13. Relativistic electron mirrors from high intensity laser nanofoil interactions

    Energy Technology Data Exchange (ETDEWEB)

    Kiefer, Daniel


    The reflection of a laser pulse from a mirror moving close to the speed of light could in principle create an X-ray pulse with unprecedented high brightness owing to the increase in photon energy and accompanying temporal compression by a factor of 4γ{sup 2}, where γ is the Lorentz factor of the mirror. While this scheme is theoretically intriguingly simple and was first discussed by A. Einstein more than a century ago, the generation of a relativistic structure which acts as a mirror is demanding in many different aspects. Recently, the interaction of a high intensity laser pulse with a nanometer thin foil has raised great interest as it promises the creation of a dense, attosecond short, relativistic electron bunch capable of forming a mirror structure that scatters counter-propagating light coherently and shifts its frequency to higher photon energies. However, so far, this novel concept has been discussed only in theoretical studies using highly idealized interaction parameters. This thesis investigates the generation of a relativistic electron mirror from a nanometer foil with current state-of-the-art high intensity laser pulses and demonstrates for the first time the reflection from those structures in an experiment. To achieve this result, the electron acceleration from high intensity laser nanometer foil interactions was studied in a series of experiments using three inherently different high power laser systems and free-standing foils as thin as 3nm. A drastic increase in the electron energies was observed when reducing the target thickness from the micrometer to the nanometer scale. Quasi-monoenergetic electron beams were measured for the first time from ultrathin (≤5nm) foils, reaching energies up to ∝35MeV. The acceleration process was studied in simulations well-adapted to the experiments, indicating the transition from plasma to free electron dynamics as the target thickness is reduced to the few nanometer range. The experience gained from those

  14. Enzymatic cellulose oxidation is linked to lignin by long-range electron transfer

    DEFF Research Database (Denmark)

    Westereng, Bjorge; Cannella, David; Wittrup Agger, Jane


    cell walls. Electron transfer was confirmed by electron paramagnetic resonance spectroscopy showing that LPMO activity on cellulose changes the level of unpaired electrons in the lignin. The discovery of a long-range electron transfer mechanism links the biodegradation of cellulose and lignin and sheds...

  15. Pelletron-based MeV-range electron beam recirculation

    CERN Document Server

    Crawford, A C; Sharapa, A N; Shemyakin, A


    In this paper we describe the successful recirculation of a DC electron beam at energies 1-1.5 MeV and currents up to 0.7 A with typical relative losses of 5-20x10 sup - sup 6. Currents of 200 mA were maintained for periods of up to five hours without a single breakdown. We found that the aperture-limiting diaphragm in the gun anode significantly increased the stability of the recirculation. We also found that the stability depended strongly on vacuum pressure in the beamline. The performance of the collector with transverse magnetic fields was found to be adequate for beam currents up to 0.6 A, which is in agreement with our low-energy bench test results. (author)

  16. Experimental studies of electron-phonon interactions in gallium nitride

    CERN Document Server

    Stanton, N M


    This thesis presents an experimental investigation of the electron-phonon interaction in GaN. Bulk epilayers, grown by MBE, and AIGaN/GaN heterostructure grown by MOCVD, have been studied. The energy relaxation rate for hot electrons has been measured over a wide range of temperatures, allowing both acoustic and optic phonon emission to be studied in GaN epilayers. Direct phonon measurements, both studying the emission and absorption processes, have been performed. Detection of phonons emitted when hot electrons relax their excess energy complements the measurements of relaxation rates. Absorption of acoustic phonons by the epilayers, using both fixed and extended metal film phonon sources, allowed investigation into the effectiveness of the 2k sub F cutoff in the low mobility layers. The experimental findings are compared with the predictions of theory. AIGaN/GaN heterostructures were characterised and measurements of the energy relaxation rate in the temperature range 4K-40K obtained. Excellent agreement wi...

  17. Charge ordering and long-range interactions in layered transition metal oxides


    Stojkovic, Branko P.; Yu, Z. G.; Bishop, A. R.; Neto, A. H. Castro; Gronbech-Jensen, Niels


    We study the competition between long-range and short-range interactions among holes within the spin density wave picture of layered transition metal oxides. We focus on the problem of charge ordering and the charge phase diagram. We show that the main interactions are the long-range Coulomb interaction and a dipolar short-range interaction generated by the short-range antiferromagnetic fluctuations. We find four different phases depending on the strength of the dipolar interaction and the de...

  18. Climate change, aboveground-belowground interactions, and species range shifts

    NARCIS (Netherlands)

    Putten, van der W.H.


    Changes in climate, land use, fire incidence, and ecological connections all may contribute to current species' range shifts. Species shift range individually, and not all species shift range at the same time and rate. This variation causes community reorganization in both the old and new ranges. In

  19. Effective Interaction in Polarized Two-dimensional Electron Systems (United States)

    Suwa, Takeshi; Takayanagi, Kazuo; Lipparini, Enrico


    Multiple scattering processes in two-dimensional electron systems with an arbitrary spin polarization are expressed as a spin-dependent effective interaction operator, which allows applications in various two-dimensional electron systems. Effects of the spin polarization on the correlation energy and the pair correlation function are discussed in detail in connection with the polarization-dependence of the effective interaction.

  20. Electron dynamics controlled via self-interaction

    CERN Document Server

    Tamburini, Matteo; Di Piazza, Antonino


    The dynamics of an electron in a strong laser field can be significantly altered by radiation reaction. This usually results in a strongly damped motion, with the electron losing a large fraction of its initial energy. Here we show that the electron dynamics in a bichromatic laser pulse can be indirectly controlled by a comparatively small radiation reaction force through its interplay with the Lorentz force. By changing the relative phase between the two frequency components of the bichromatic laser field, an ultrarelativistic electron bunch colliding head-on with the laser pulse can be deflected in a controlled way, with the deflection angle being independent of the initial electron energy. The effect is predicted to be observable with intensities available at upcoming laser facilities.

  1. Stopping-Power and Range Tables for Electrons, Protons, and Helium Ions (United States)

    SRD 124 Stopping-Power and Range Tables for Electrons, Protons, and Helium Ions (Web, free access)   The databases ESTAR, PSTAR, and ASTAR calculate stopping-power and range tables for electrons, protons, or helium ions. Stopping-power and range tables can be calculated for electrons in any user-specified material and for protons and helium ions in 74 materials.

  2. Dynamics of interacting electrons under effect of a Morse potential (United States)

    dos Santos, J. L. L.; Sales, M. O.; Neto, A. Ranciaro; de Moura, F. A. B. F.


    We consider interacting electrons moving in a nonlinear Morse lattice. We set the initial conditions as follows: electrons were initially localized at the center of the chain and a solitonic deformation was produced by an impulse excitation on the center of the chain. By solving quantum and classical equations for this system numerically, we found that a fraction of electronic wave function was trapped by the solitonic excitation, and trapping specificities depend on the degree of interaction among electrons. Also, there is evidence that the effective electron velocity depends on Coulomb interaction and electron-phonon coupling in a nontrivial way. This association is explained in detail along this work. In addition, we briefly discuss the dependence of our results with the type of initial condition we choose for the electrons and lattice.

  3. Enzymatic cellulose oxidation is linked to lignin by long-range electron transfer (United States)

    Westereng, Bjørge; Cannella, David; Wittrup Agger, Jane; Jørgensen, Henning; Larsen Andersen, Mogens; Eijsink, Vincent G.H.; Felby, Claus


    Enzymatic oxidation of cell wall polysaccharides by lytic polysaccharide monooxygenases (LPMOs) plays a pivotal role in the degradation of plant biomass. While experiments have shown that LPMOs are copper dependent enzymes requiring an electron donor, the mechanism and origin of the electron supply in biological systems are only partly understood. We show here that insoluble high molecular weight lignin functions as a reservoir of electrons facilitating LPMO activity. The electrons are donated to the enzyme by long-range electron transfer involving soluble low molecular weight lignins present in plant cell walls. Electron transfer was confirmed by electron paramagnetic resonance spectroscopy showing that LPMO activity on cellulose changes the level of unpaired electrons in the lignin. The discovery of a long-range electron transfer mechanism links the biodegradation of cellulose and lignin and sheds new light on how oxidative enzymes present in plant degraders may act in concert. PMID:26686263

  4. Chiral Topological Superconductors Enhanced by Long-Range Interactions (United States)

    Viyuela, Oscar; Fu, Liang; Martin-Delgado, Miguel Angel


    We study the phase diagram and edge states of a two-dimensional p -wave superconductor with long-range hopping and pairing amplitudes. New topological phases and quasiparticles different from the usual short-range model are obtained. When both hopping and pairing terms decay with the same exponent, one of the topological chiral phases with propagating Majorana edge states gets significantly enhanced by long-range couplings. On the other hand, when the long-range pairing amplitude decays more slowly than the hopping, we discover new topological phases where propagating Majorana fermions at each edge pair nonlocally and become gapped even in the thermodynamic limit. Remarkably, these nonlocal edge states are still robust, remain separated from the bulk, and are localized at both edges at the same time. The inclusion of long-range effects is potentially applicable to recent experiments with magnetic impurities and islands in 2D superconductors.

  5. Writing an Electronic Astronomy Book with Interactive Curricular Material (United States)

    Thompson, Kristen L.; Belloni, Mario; Christian, Wolfgang


    With the rise of tablets, the past few years have seen an increase in the demand for quality electronic textbooks. Unfortunately, most of the current offerings do not exploit the accessibility and interactivity that electronic books can deliver. In this poster, we discuss how we are merging our curriculum development projects (Physlets, Easy Java/JavaScript Simulations, and Open Source Physics) with the EPUB electronic book format to develop an interactive textbook for use in a one-semester introductory astronomy course. The book, Astronomy: An Interactive Introduction, combines the narrative, equations, and images of a traditional astronomy text with new JavaScript simulations.

  6. Electron-electron interactions in the chemical bond:``1/3” Effect in ...

    Indian Academy of Sciences (India)

    The prominent ``1/3” effect observed in the Hall effect plateaus of twodimensional electron gas (2DEG) systems has been postulated to indicating 1/3 fractional charge quasiparticle excitations arising from electron-electron interactions. Tunneling shot-noise experiments on 2DEF exhibiting fractional quantum Hall effect ...

  7. Electron acceleration via high contrast laser interacting with submicron clusters

    Energy Technology Data Exchange (ETDEWEB)

    Zhang Lu; Chen Liming; Wang Weiming; Yan Wenchao; Yuan Dawei; Mao Jingyi; Wang Zhaohua; Liu Cheng; Shen Zhongwei; Li Yutong; Dong Quanli; Lu Xin; Ma Jinglong; Wei Zhiyi [Beijing National Laboratory of Condensed Matter Physics, Institute of Physics, CAS, Beijing 100080 (China); Faenov, Anatoly; Pikuz, Tatiana [Joint Institute for High Temperature of the Russian Academy of Sciences, Izhorskaya 13/19, Moscow 127412 (Russian Federation); Quantum Beams Science Directorate, JAEA, Kizugawa, Kyoto (Japan); Li Dazhang [Beijing National Laboratory of Condensed Matter Physics, Institute of Physics, CAS, Beijing 100080 (China); Institute of High Energy Physics, CAS, Beijing 100049 (China); Sheng Zhengming [Department of Physics, Shanghai Jiao Tong University, Shanghai 200240 (China); Zhang Jie [Beijing National Laboratory of Condensed Matter Physics, Institute of Physics, CAS, Beijing 100080 (China); Department of Physics, Shanghai Jiao Tong University, Shanghai 200240 (China)


    We experimentally investigated electron acceleration from submicron size argon clusters-gas target irradiated by a 100 fs, 10 TW laser pulses having a high-contrast. Electron beams are observed in the longitudinal and transverse directions to the laser propagation. The measured energy of the longitudinal electron reaches 600 MeV and the charge of the electron beam in the transverse direction is more than 3 nC. A two-dimensional particle-in-cell simulation of the interaction has been performed and it shows an enhancement of electron charge by using the cluster-gas target.

  8. Long-range magnetostatic interactions in arrays of nanowires

    CERN Document Server

    Raposo, V; González, J M; Vázquez, M


    Experimental measurements and micromagnetic simulations of the hysteresis loops of arrays of cobalt nanowires are compared here. Arrays of cobalt nanowires (200 nm in diameter) were electrodeposited into the pores of alumina membranes (thickness 60 mu m). Their hysteresis loops along the axial direction of nanowires were measured using vibrating sample magnetometry. Micromagnetic simulations were performed considering dipolar interaction between nanowires leading to similar hysteresis loops as those obtained experimentally.

  9. Unraveling the role of secondary electrons upon their interaction with photoresist during EUV exposure (United States)

    Pollentier, Ivan; Vesters, Yannick; Jiang, Jing; Vanelderen, Pieter; de Simone, Danilo


    The interaction of 91.6eV EUV photons with photoresist is very different to that of optical lithography at DUV wavelength. The latter is understood quite well and it is known that photons interact with the resist in a molecular way through the photoacid generator (PAG) of the chemically amplified resist (CAR). In EUV however, the high energy photons interact with the matter on atomic scale, resulting in the generation of secondary electrons. It is believed that these secondary electrons in their turn are responsible in chemical modification and lead to switching reactions that enable resist local dissolution. However, details of the interaction are still unclear, e.g. which reaction an electron with a given energy can initiate. In this work we have introduced a method to measure the chemical interaction of the secondary electrons with the EUV resist. The method is based on electron gun exposures of low energy electrons (range 1eV to 80eV) in the photoresist. The chemical interaction is then measured by Residual Gas Analysis (RGA), which can analyze out of the outgassing which and how much reaction products are generated. In this way a `chemical yield' can be quantified as function of electron energy. This method has been successfully applied to understand the interaction of secondary electrons on the traditional CAR materials. The understanding was facilitated by testing different compositions of an advanced EUV CAR, where resp. polymer only, polymer+PAG, and polymer+PAG+quencher are tested with the electron gun. It was found that low energy electrons down to 3-4eV can activate PAG dissociation, which can lead to polymer deprotection. However it was observed too that energy electrons of 12eV and higher can do direct deprotection even in absence of the PAG. In addition, testing suggests that electrons can generate also other chemical changes on the polymer chain that could lead to cross-linking.

  10. Interactive Electronic Technical Manuals (IETMs) Annotated Bibliography (United States)


    Apparently, one topic was mostly neglected: how to visualize and interact with link markers. The paper presents an overview of pragmatic historical...retrieval, information extraction, speech understanding, and machine translation. Part IV, “ Pragmatics ”, covers reference resolution and discourse...structures like the use of labels (Move A to 1), descriptors (Move triangular bar to triangular slot) and anaphora (Move This There). It has been found that

  11. The world of long-range interactions: A bird’s eye view (United States)

    Gupta, Shamik; Ruffo, Stefano


    In recent years, studies of long-range interacting (LRI) systems have taken center stage in the arena of statistical mechanics and dynamical system studies, due to new theoretical developments involving tools from as diverse a field as kinetic theory, non-equilibrium statistical mechanics, and large deviation theory, but also due to new and exciting experimental realizations of LRI systems. In the first, introductory, Section 1, we discuss the general features of long-range interactions, emphasizing in particular the main physical phenomenon of non-additivity, which leads to a plethora of distinct effects, both thermodynamic and dynamic, that are not observed with short-range interactions: Ensemble inequivalence, slow relaxation, broken ergodicity. In Section 2, we discuss several physical systems with long-range interactions: mean-field spin systems, self-gravitating systems, Euler equations in two dimensions, Coulomb systems, one-component electron plasma, dipolar systems, free-electron lasers. In Section 3, we discuss the general scenario of dynamical evolution of generic LRI systems. In Section 4, we discuss an illustrative example of LRI systems, the Kardar-Nagel spin system, which involves discrete degrees of freedom, while in Section 5, we discuss a paradigmatic example involving continuous degrees of freedom, the so-called Hamiltonian mean-field (HMF) model. For the former, we demonstrate the effects of ensemble inequivalence and slow relaxation, while for the HMF model, we emphasize in particular the occurrence of the so-called quasistationary states (QSSs) during relaxation towards the Boltzmann-Gibbs equilibrium state. The QSSs are non-equilibrium states with lifetimes that diverge with the system size, so that in the thermodynamic limit, the systems remain trapped in the QSSs, thereby making the latter the effective stationary states. In Section 5, we also discuss an experimental system involving atoms trapped in optical cavities, which may be modelled

  12. Phonons, electronic charge response and electron-phonon interaction in the high-temperature superconductors (United States)

    Falter, Claus


    We investigate the complete phonon dispersion, the phonon induced electronic charge response and the corresponding self-consistent change of the crystal potential an electron feels as a direct measure of the electron-phonon interaction in the high-temperature superconductors within a microscopic model in the framework of linear response theory. Moreover, dielectric and infrared properties are calculated. The experimentally observed strong renormalization of the in-plane oxygen bond-stretching modes which appears upon doping in the high-temperature superconductors is discussed. It is shown that the characteristic softening, indicating a strong nonlocal electron-phonon interaction, is most likely a generic effect of the CuO plane and is driven by a nonlocal coupling of the displaced ions to the localized charge-fluctuations at the Cu and the Oxy ions. At hand of the oxygen bond-stretching modes it is illustrated how lattice-, charge- and spin-degrees of freedom may act synergetically for anisotropic pairing in the high-temperature superconductors. The different behaviour of these modes during the insulator-metal transition via the underdoped phase is calculated and from a comparison of these generic modes in the different phases conclusions about the electronic state are drawn. For the non-cuprate potassium doped high-temperature superconductor Ba-Bi-O also a very strong and anisotropic renormalization of the oxygen bond-stretching modes is predicted. In another investigation c-axis polarized infrared- and Raman-active modes of the HTSC's are calculated in terms of charge fluctuations and anisotropic dipole-fluctuations. Mode assignments discussed controversially in the literature are proposed. Finally, interlayer phonons propagating along the c-axis and their accompanying charge response are investigated. Depending on the strength of the interlayer coupling calculations are performed ranging from the static, adiabatic response regime to the non-adiabatic regime

  13. Interacting electrons theory and computational approaches

    CERN Document Server

    Martin, Richard M; Ceperley, David M


    Recent progress in the theory and computation of electronic structure is bringing an unprecedented level of capability for research. Many-body methods are becoming essential tools vital for quantitative calculations and understanding materials phenomena in physics, chemistry, materials science and other fields. This book provides a unified exposition of the most-used tools: many-body perturbation theory, dynamical mean field theory and quantum Monte Carlo simulations. Each topic is introduced with a less technical overview for a broad readership, followed by in-depth descriptions and mathematical formulation. Practical guidelines, illustrations and exercises are chosen to enable readers to appreciate the complementary approaches, their relationships, and the advantages and disadvantages of each method. This book is designed for graduate students and researchers who want to use and understand these advanced computational tools, get a broad overview, and acquire a basis for participating in new developments.

  14. Designing Interactive Electronic Module in Chemistry Lessons (United States)

    Irwansyah, F. S.; Lubab, I.; Farida, I.; Ramdhani, M. A.


    This research aims to design electronic module (e-module) oriented to the development of students’ chemical literacy on the solution colligative properties material. This research undergoes some stages including concept analysis, discourse analysis, storyboard design, design development, product packaging, validation, and feasibility test. Overall, this research undertakes three main stages, namely, Define (in the form of preliminary studies); Design (designing e-module); Develop (including validation and model trial). The concept presentation and visualization used in this e-module is oriented to chemical literacy skills. The presentation order carries aspects of scientific context, process, content, and attitude. Chemists and multi media experts have done the validation to test the initial quality of the products and give a feedback for the product improvement. The feasibility test results stated that the content presentation and display are valid and feasible to be used with the value of 85.77% and 87.94%. These values indicate that this e-module oriented to students’ chemical literacy skills for the solution colligative properties material is feasible to be used.

  15. Spin Relaxation in GaAs: Importance of Electron-Electron Interactions

    Directory of Open Access Journals (Sweden)

    Gionni Marchetti


    Full Text Available We study spin relaxation in n-type bulk GaAs, due to the Dyakonov–Perel mechanism, using ensemble Monte Carlo methods. Our results confirm that spin relaxation time increases with the electronic density in the regime of moderate electronic concentrations and high temperature. We show that the electron-electron scattering in the non-degenerate regime significantly slows down spin relaxation. This result supports predictions by Glazov and Ivchenko. Most importantly, our findings highlight the importance of many-body interactions for spin dynamics: we show that only by properly taking into account electron-electron interactions within the simulations, results for the spin relaxation time—with respect to both electron density and temperature—will reach good quantitative agreement with corresponding experimental data. Our calculations contain no fitting parameters.

  16. Interaction of electrons with light metal hydrides in the transmission electron microscope. (United States)

    Wang, Yongming; Wakasugi, Takenobu; Isobe, Shigehito; Hashimoto, Naoyuki; Ohnuki, Somei


    Transmission electron microscope (TEM) observation of light metal hydrides is complicated by the instability of these materials under electron irradiation. In this study, the electron kinetic energy dependences of the interactions of incident electrons with lithium, sodium and magnesium hydrides, as well as the constituting element effect on the interactions, were theoretically discussed, and electron irradiation damage to these hydrides was examined using in situ TEM. The results indicate that high incident electron kinetic energy helps alleviate the irradiation damage resulting from inelastic or elastic scattering of the incident electrons in the TEM. Therefore, observations and characterizations of these materials would benefit from increased, instead decreased, TEM operating voltage. © The Author 2014. Published by Oxford University Press on behalf of The Japanese Society of Microscopy. All rights reserved. For permissions, please e-mail:

  17. Electromagnetic interactions between a fast electron beam and metamaterial cloaks (United States)

    Xu, Jinying; Dong, Yunxia; Zhang, Xiangdong


    Relativistic energy loss and photon emission in the interaction of ideal and nonideal metamaterial cloaks with an external electron beam are studied based on the classical electrodynamics. The effects of various imperfect parameters on the efficiency of the cloak are emphasized. The energy-loss spectra and the photon emission for such structures with the different combinations of electron velocity and impact parameter are calculated. It is shown that the efficiency of nonideal electromagnetic cloaks and the effect of various nonideal parameters on the cloak invisibility can be exhibited in the electron energy loss spectroscopy. This means that the properties of cloak can be explored by scanning transmission electron microscopy.

  18. Laser interactions with high brightness electron beams (United States)

    Malton, Stephen P.

    The International Linear Collider will be a high-precision machine to study the next energy frontier in particle physics. At the TeV energy scale, the ILC is expected to deliver luminosities in excess of 1034 cni" 2s_1. In order to achieve this, beam conditions must be monitored throughout the machine. Measurment of the beam emittance is essential to ensuring that the high luminosity can be provided at the interaction point. At the de sign beam sizes in the ILC beam delivery system, the Laserwire provides a non-invasive real-time method of measuring the emittance by the method of inverse Compton scattering. The prototype Laserwire at the PETRA stor age ring has produced consistent results with measured beam sizes of below 100 /nn. The Energy Recovery Linac Prototype (ERLP) is a technology testbed for the 4th Generation Light Source (4GLS). Inverse Compton scattering can be used in the ERLP as a proof of concept for a proposed 4GLS upgrade, and to produce soft X-rays for condensed matter experiments. The design constraints for the main running mode of the ERLP differ from those required for inverse Compton scattering. Suitable modifications to the optical lattice have been developed under the constraint that no new magnetic structures may be introduced, and the resulting photon distributions are described.

  19. High dynamic range isotope ratio measurements using an analog electron multiplier

    Czech Academy of Sciences Publication Activity Database

    Williams, P.; Lorinčík, Jan; Franzreb, K.; Herwig, R.


    Roč. 45, č. 1 (2013), s. 549-552 ISSN 0142-2421 R&D Projects: GA MŠk ME 894 Institutional support: RVO:67985882 Keywords : Isotope ratios * electron multiplier * dynamic range Subject RIV: JA - Electronics ; Optoelectronics, Electrical Engineering Impact factor: 1.393, year: 2013

  20. Possible interaction between thermal electrons and vibrationally excited N2 in the lower E-region

    Directory of Open Access Journals (Sweden)

    K.-I. Oyama


    Full Text Available As one of the tasks to find the energy source(s of thermal electrons, which elevate(s electron temperature higher than neutral temperature in the lower ionosphere E-region, energy distribution function of thermal electron was measured with a sounding rocket at the heights of 93–131 km by the applying second harmonic method. The energy distribution function showed a clear hump at the energy of ~0.4 eV. In order to find the reason of the hump, we conducted laboratory experiment. We studied difference of the energy distribution functions of electrons in thermal energy range, which were measured with and without EUV radiation to plasma of N2/Ar and N2/O2 gas mixture respectively. For N2/Ar gas mixture plasma, the hump is not clearly identified in the energy distribution of thermal electrons. On the other hand for N2/O2 gas mixture, which contains vibrationally excited N2, a clear hump is found when irradiated by EUV. The laboratory experiment seems to suggest that the hump is produced as a result of interaction between vibrationally excited N2 and thermal electrons, and this interaction is the most probable heating source for the electrons of thermal energy range in the lower E-region. It is also suggested that energy distribution of the electrons in high energy part may not be Maxwellian, and DC probe measures the electrons which are non Maxwellian, and therefore "electron temperature" is calculated higher.

  1. The Range of 1-3 keV Electrons in Solid Oxygen and Carbon Monoxide

    DEFF Research Database (Denmark)

    Oehlenschlæger, M.; Andersen, H.H.; Schou, Jørgen


    The range of 1-3 keV electrons in films of solid oxygen and carbon monoxide has been measured by a mirror substrate method. The technique used here is identical to the one previously used for range measurements in solid hydrogen and nitrogen. The range in oxygen is slightly shorter than that in n......The range of 1-3 keV electrons in films of solid oxygen and carbon monoxide has been measured by a mirror substrate method. The technique used here is identical to the one previously used for range measurements in solid hydrogen and nitrogen. The range in oxygen is slightly shorter than...... that in nitrogen whereas the range in carbon monoxide is about 20% larger than that in the nitrogen....

  2. Comment on "Many-body localization in Ising models with random long-range interactions" (United States)

    Maksymov, Andrii O.; Rahman, Noah; Kapit, Eliot; Burin, Alexander L.


    This Comment is dedicated to the investigation of many-body localization in a quantum Ising model with long-range power-law interactions r-α, relevant for a variety of systems ranging from electrons in Anderson insulators to spin excitations in chains of cold atoms. It has earlier been argued [arXiv:cond-mat/0611387 (2005); Phys. Rev. B 91, 094202 (2015), 10.1103/PhysRevB.91.094202] that this model obeys the dimensional constraint suggesting the delocalization of all finite-temperature states in the thermodynamic limit for α ≤2 d in a d -dimensional system. This expectation conflicts with the recent numerical studies of the specific interacting spin model of Li et al. [Phys. Rev. A 94, 063625 (2016), 10.1103/PhysRevA.94.063625]. To resolve this controversy we reexamine the model of Li et al. [Phys. Rev. A 94, 063625 (2016), 10.1103/PhysRevA.94.063625] and demonstrate that the infinite-temperature states there obey the dimensional constraint. The earlier developed scaling theory for the critical system size required for delocalization is extended to small exponents 0 ≤α ≤d . The disagreements between the two works are explained by the nonstandard selection of investigated states in the ordered phase in the work of Li et al. [Phys. Rev. A 94, 063625 (2016)10.1103/PhysRevA.94.063625].

  3. Temperature dependence of electron density and electron-electron interactions in monolayer epitaxial graphene grown on SiC (United States)

    Liu, Chieh-Wen; Chuang, Chiashain; Yang, Yanfei; Elmquist, Randolph E.; Ho, Yi-Ju; Lee, Hsin-Yen; Liang, Chi-Te


    We report carrier density measurements and electron-electron (e-e) interactions in monolayer epitaxial graphene grown on SiC. The temperature (T)-independent carrier density determined from the Shubnikov-de Haas (SdH) oscillations clearly demonstrates that the observed logarithmic temperature dependence of the Hall slope in our system must be due to e-e interactions. Since the electron density determined from conventional SdH measurements does not depend on e-e interactions based on Kohn’s theorem, SdH experiments appear to be more reliable compared with the classical Hall effect when one studies the T dependence of the carrier density in the low T regime. On the other hand, the logarithmic T dependence of the Hall slope δR xy /δB can be used to probe e-e interactions even when the conventional conductivity method is not applicable due to strong electron-phonon scattering.

  4. Probing Nanoscale Electronic and Magnetic Interaction with Scanning Tunneling Spectroscopy

    DEFF Research Database (Denmark)

    Bork, Jakob

    This thesis is concerned with fundamental research into electronic and magnetic interaction on the nanoscale. From small metallic and magnetic islands and layers to single atoms. The research revolves around magnetic interaction probed through the spectroscopic capabilities of the scanning....... This is related to research in correlated electron materials such as studies of phase transitions in heavy fermion compounds and magnetic interaction in spintronic research. The capping of cobalt islands on Cu(111) with silver is investigated with STM and photoemission spectroscopy. It is shown that at low...... coverage the silver preferably nucleates on top of the bilayer high cobalt islands compared to directly on the Cu(111) substrate. Furthermore, the silver forms a combination of a reconstruction and a Moire pattern which is investigated with low-energy electron diraction and spectroscopic STM mapping at 6...

  5. Scanning tunneling spectroscopy on electron-boson interactions in superconductors

    CERN Document Server

    Schackert, Michael Peter


    This work describes the experimental study of electron-boson interactions in superconductors by means of inelastic electron tunneling spectroscopy performed with a scanning tunneling microscope (STM) at temperatures below 1 K. This new approach allows the direct measurement of the Eliashberg function of conventional superconductors as demonstrated on lead (Pb) and niobium (Nb). Preparative experiments on unconventional iron-pnictides are presented in the end.

  6. Valence electronic structure of cobalt phthalocyanine from an optimally tuned range-separated hybrid functional (United States)

    Brumboiu, Iulia Emilia; Prokopiou, Georgia; Kronik, Leeor; Brena, Barbara


    We analyse the valence electronic structure of cobalt phthalocyanine (CoPc) by means of optimally tuning a range-separated hybrid functional. The tuning is performed by modifying both the amount of short-range exact exchange (α ) included in the hybrid functional and the range-separation parameter (γ ), with two strategies employed for finding the optimal γ for each α . The influence of these two parameters on the structural, electronic, and magnetic properties of CoPc is thoroughly investigated. The electronic structure is found to be very sensitive to the amount and range in which the exact exchange is included. The electronic structure obtained using the optimal parameters is compared to gas-phase photo-electron data and GW calculations, with the unoccupied states additionally compared with inverse photo-electron spectroscopy measurements. The calculated spectrum with tuned γ , determined for the optimal value of α = 0.1 , yields a very good agreement with both experimental results and with GW calculations that well-reproduce the experimental data.

  7. Electron scattering on the short-range potential in narrow gap Cd {sub x}Hg{sub 1-x}Te

    Energy Technology Data Exchange (ETDEWEB)

    Malyk, O.P. [Lviv Polytechnic National University, Semiconductor Electronics Department, Bandera Street 12, 79013 Lviv (Ukraine)]. E-mail:


    Models of electron scattering on the short-range potential caused by the interaction with polar and nonpolar optical phonons, piezoelectric and acoustic phonons, ionized and neutral impurities in the narrow gap solid solution Cd {sub x}Hg{sub 1-x}Te (x = 0, 0.08, 0.17, 0.26 and 0.36) are proposed. The temperature dependences of electron mobility in temperature range 4.2-300 K are calculated.

  8. Time-of-flight electron spectrometer for a broad range of kinetic energies

    Energy Technology Data Exchange (ETDEWEB)

    Kothe, Alexander; Metje, Jan; Wilke, Martin; Moguilevski, Alexandre; Engel, Nicholas; Al-Obaidi, Ruba; Richter, Clemens; Golnak, Ronny; Kiyan, Igor Yu.; Aziz, Emad F. [Joint Ultrafast Dynamics Lab in Solutions and at Interfaces (JULiq), Helmholtz-Zentrum Berlin fuer Materialien und Energie (HZB), Albert-Einstein-Str. 15, 12489 Berlin (Germany) and Freie Universitaet Berlin, Fachbereich Physik, Arnimallee 14, 14195 Berlin (Germany)


    A newly constructed time-of-flight electron spectrometer of the magnetic bottle type is characterized for electron detection in a broad range of kinetic energies. The instrument is designed to measure the energy spectra of electrons generated from liquids excited by strong laser fields and photons in the range of extreme ultra violet and soft X-rays. Argon inner shell electrons were recorded to calibrate the spectrometer and investigate its characteristics, such as energy resolution and collection efficiency. Its energy resolution {Delta}E/E of 1.6% allows resolving the Ar 2p spin orbit structure at kinetic energies higher than 100 eV. The collection efficiency is determined and compared to that of the spectrometer in its field-free configuration.

  9. Inelastic electron interaction (attachment/ionization) with deoxyribose (United States)

    Ptasińska, S.; Denifl, S.; Scheier, P.; Märk, T. D.


    We have investigated experimentally the formation of anions and cations of deoxyribose sugar (C5H10O4) via inelastic electron interaction (attachment/ionization) using a monochromatic electron beam in combination with a quadrupole mass spectrometer. The ion yields were measured as a function of the incident electron energy between about 0 and 20 eV. As in the case of other biomolecules (nucleobases and amino acids), low energy electron attachment leads to destruction of the molecule via dissociative electron attachment reactions. In contrast to the previously investigated biomolecules dehydrogenation is not the predominant reaction channel for deoxyribose; the anion with the highest dissociative electron attachment (DEA) cross section of deoxyribose is formed by the release of neutral particles equal to two water molecules. Moreover, several of the DEA reactions proceed already with "zero energy" incident electrons. In addition, the fragmentation pattern of positively charged ions of deoxyribose also indicates strong decomposition of the molecule by incident electrons. For sugar the relative amount of fragment ions compared to that of the parent cation is about an order of magnitude larger than in the case of nucleobases. We determined an ionization energy value for C5H10O4+ of 10.51±0.11 eV, which is in good agreement with ab initio calculations. For the fragment ion C5H6O2+ we obtained a threshold energy lower than the ionization energy of the parent molecular ion. All of these results have important bearing for the question of what happens in exposure of living tissue to ionizing radiation. Energy deposition into irradiated cells produces electrons as the dominant secondary species. At an early time after irradiation these electrons exist as ballistic electrons with an initial energy distribution up to several tens of electron volts. It is just this energy regime for which we find in the present study rather characteristic differences in the outcome of electron

  10. Stochastic Coulomb interactions in space charge limited electron emission

    NARCIS (Netherlands)

    Nijkerk, M.D.; Kruit, P.


    A Monte Carlo simulation tool, which was used to evaluate the influence of discrete space charge effects on self-consistent calculations of cathode-ray tube optics, was discussed. It was found that interactions in the space charge cloud affect the electron trajectories such that the velocity

  11. Interaction of ultrarelativistic electron and proton bunches with dense plasmas

    CERN Document Server

    Rukhadze, A A


    Here we discuss the possibility of employment of ultrarelativistic electron and proton bunches for generation of high plasma wakefields in dense plasmas due to the Cherenkov resonance plasma-bunch interaction. We estimate the maximum amplitude of such a wake and minimum system length at which the maximum amplitude can be generated at the given bunch parameters.

  12. Tunable Electron-Electron Interactions in LaAlO_{3}/SrTiO_{3} Nanostructures

    Directory of Open Access Journals (Sweden)

    Guanglei Cheng


    Full Text Available The interface between the two complex oxides LaAlO_{3} and SrTiO_{3} has remarkable properties that can be locally reconfigured between conducting and insulating states using a conductive atomic force microscope. Prior investigations of “sketched” quantum dot devices revealed a phase in which electrons form pairs, implying a strongly attractive electron-electron interaction. Here, we show that these devices with strong electron-electron interactions can exhibit a gate-tunable transition from a pair-tunneling regime to a single-electron (Andreev bound state tunneling regime where the interactions become repulsive. The electron-electron interaction sign change is associated with a Lifshitz transition where the d_{xz} and d_{yz} bands start to become occupied. This electronically tunable electron-electron interaction, combined with the nanoscale reconfigurability of this system, provides an interesting starting point towards solid-state quantum simulation.

  13. Electromagnetic Structure and Electron Acceleration in Shock-Shock Interaction (United States)

    Nakanotani, Masaru; Matsukiyo, Shuichi; Hada, Tohru; Mazelle, Christian X.


    A shock-shock interaction is investigated by using a one-dimensional full particle-in-cell simulation. The simulation reproduces the collision of two symmetrical high Mach number quasi-perpendicular shocks. The basic structure of the shocks and ion dynamics is similar to that obtained by previous hybrid simulations. The new aspects obtained here are as follows. Electrons are already strongly accelerated before the two shocks collide through multiple reflection. The reflected electrons self-generate waves upstream between the two shocks before they collide. The waves far upstream are generated through the right-hand resonant instability with the anomalous Doppler effect. The waves generated near the shock are due to firehose instability and have much larger amplitudes than those due to the resonant instability. The high-energy electrons are efficiently scattered by the waves so that some of them gain large pitch angles. Those electrons can be easily reflected at the shock of the other side. The accelerated electrons form a power-law energy spectrum. Due to the accelerated electrons, the pressure of upstream electrons increases with time. This appears to cause the deceleration of the approaching shock speed. The accelerated electrons having sufficiently large Larmor radii are further accelerated through the similar mechanism working for ions when the two shocks are colliding.

  14. Electron-phonon interaction in strongly correlated systems (United States)

    Moskalenko, V. A.


    By a canonical transformation, the Hubbard model, supplemented with the Holstein interaction of localized electrons and nondispersive optical phonons, is transformed into a model where the hoppings of polarons from one lattice site into another are possible and are accompanied by the hoppings of an unbounded number of phonons. This, together with the fact that strong one-site interactions of electrons are inherent in the Hubbard model, leads to the necessity of introducing a new diagram technique based on irreducible one-site multi-particle Green’s functions or Kubo cumulants. The presence of phonons leads to renormalization of single-particle and multi-particle Green’s functions. The Dyson equation for the renormalized electron Green’s function is obtained. However, we did not manage to obtain the Dyson equation for the phonon functions due to the multiplicity of phonons taking part in the hopping. The validity of the theorem of connected diagrams is proved.


    Energy Technology Data Exchange (ETDEWEB)

    Phaneuf, Ronald A. [UNR


    The objective of this research is a deeper understanding of the complex multi-electron interactions that govern inelastic processes involving positive ions in plasma environments, such as those occurring in stellar cares and atmospheres, x-ray lasers, thermonuclear fusion reactors and materials-processing discharges. In addition to precision data on ionic structure and transition probabilities, high resolution quantitative measurements of ionization test the theoretical methods that provide critical input to computer codes used for plasma modeling and photon opacity calculations. Steadily increasing computational power and a corresponding emphasis on simulations gives heightened relevance to precise and accurate benchmark data. Photons provide a highly selective probe of the internal electronic structure of atomic and molecular systems, and a powerful means to better understand more complex electron-ion interactions.

  16. Long-ranged interactions in bcc NbMoTaW high-entropy alloys

    NARCIS (Netherlands)

    Kormann, F.H.W.; Ruban, A.V.; Sluiter, M.H.F.


    We reveal that in a prototypical bcc high-entropy alloy NbMoTaW chemical interactions are long ranged and highly frustrated. We show that this is the reason that bcc solid solutions in NbMoTaW can persist to low temperatures. The ab initio-computed long-ranged interactions strongly impact

  17. Charge Ordering and Long-Range Interactions in Layered Transition Metal Oxides

    Energy Technology Data Exchange (ETDEWEB)

    Stojkovic, B.P.; Yu, Z.G.; Bishop, A.R.; Gro/nbech-Jensen, N. [Theoretical Division and Center for Nonlinear Studies, Los Alamos National Laboratory, Los Alamos, New Mexico 87545 (United States); Neto, A.H. [Department of Physics, University of California, Riverside, California 92521 (United States)


    We study the competition between long-range and short-range interactions among holes within a continuum formulation of the spin density wave picture of layered transition metal oxides. We focus on the problem of charge ordering and the charge phase diagram. The main interactions are the long-range Coulomb interaction and a magnetic dipolar short-range interaction generated by short-range antiferromagnetic fluctuations. Four different phases depending on the strength of the dipolar interaction and the density of holes exist: Wigner crystal, diagonal stripes, horizontal-vertical stripes (loops). and a glassy-clumped phase. The effect of temperature, disorder, and lattice effects on these phases are discussed. {copyright} {ital 1999} {ital The American Physical Society}

  18. Controlling electron quantum dot qubits by spin-orbit interactions

    Energy Technology Data Exchange (ETDEWEB)

    Stano, P.


    Single electron confined in a quantum dot is studied. A special emphasis is laid on the spin properties and the influence of spin-orbit interactions on the system. The study is motivated by a perspective exploitation of the spin of the confined electron as a qubit, a basic building block of in a foreseen quantum computer. The electron is described using the single band effective mass approximation, with parameters typical for a lateral electrostatically defined quantum dot in a GaAs/AlGaAs heterostructure. The stemming data for the analysis are obtained by numerical methods of exact diagonalization, however, all important conclusions are explained analytically. The work focuses on three main areas -- electron spectrum, phonon induced relaxation and electrically and magnetically induced Rabi oscillations. It is shown, how spin-orbit interactions influence the energy spectrum, cause finite spin relaxation and allow for all-electrical manipulation of the spin qubit. Among the main results is the discovery of easy passages, where the spin relaxation is unusually slow and the qubit is protected against parasitic electrical fields connected with manipulation by resonant electromagnetic fields. The results provide direct guide for manufacturing quantum dots with much improved properties, suitable for realizing single electron spin qubits. (orig.)

  19. Probing the role of long-range interactions in the dynamics of a long-range Kitaev chain (United States)

    Dutta, Anirban; Dutta, Amit


    We study the role of long-range interactions (more precisely, the long-range superconducting gap term) on the nonequilibrium dynamics considering a long-range p -wave superconducting chain in which the superconducting term decays with distance between two sites in a power-law fashion characterized by an exponent α . We show that the Kibble-Zurek scaling exponent, dictating the power-law decay of the defect density in the final state reached following a slow (in comparison to the time scale associated with the minimum gap in the spectrum of the Hamiltonian) quenching of the chemical potential μ across a quantum critical point, depends nontrivially on the exponent α as long as α 2 , we find that the exponent saturates to the corresponding well-known value of 1 /2 expected for the short-range model. Furthermore, studying the dynamical quantum phase transitions manifested in the nonanalyticities in the rate function of the return possibility I (t ) in subsequent temporal evolution following a sudden change in μ , we show the existence of a new region; in this region, we find three instants of cusp singularities in I (t ) associated with a single sector of Fisher zeros. Notably, the width of this region shrinks as α increases and vanishes in the limit α →2 , indicating that this special region is an artifact of the long-range nature of the Hamiltonian.

  20. Ranges and limits of the electron-phonon coupling constant of ...

    African Journals Online (AJOL)

    A simplified study of the effect of including self energy and vertex corrections to the BCS critical temperature Tc expression is carried out her to identify the possible ranges and limits of the electron-phonon coupling constant λ in superconductivity. The results show that the inclusion of the self energy will reduce the BCS Tc to ...

  1. Effect of electron-electron interaction on cyclotron resonance in high-mobility InAs/AlSb quantum wells

    Energy Technology Data Exchange (ETDEWEB)

    Krishtopenko, S. S., E-mail:; Gavrilenko, V. I. [Institute for Physics of Microstructures, Russian Academy of Sciences, 603950 Nizhny Novgorod, GSP-105 (Russian Federation); Lobachevsky State University, 23 Prospekt Gagarina, 603950 Nizhny Novgorod (Russian Federation); Ikonnikov, A. V. [Institute for Physics of Microstructures, Russian Academy of Sciences, 603950 Nizhny Novgorod, GSP-105 (Russian Federation); Orlita, M. [Laboratoire National des Champs Magnétiques Intenses (LNCMI-G), CNRS, 25 rue des Martyrs, B.P. 166, 38042 Grenoble (France); Sadofyev, Yu. G. [P.N. Lebedev Physical Institute, Russian Academy of Sciences, Moscow 119991, GSP-1, 53 Leninskiy Prospect (Russian Federation); Goiran, M. [Laboratoire National des Champs Magnétiques Intenses (LNCMI-T), CNRS, 143 Avenue de Rangueil, 31400 Toulouse (France); Teppe, F.; Knap, W. [Laboratoire Charles Coulomb (L2C), UMR CNRS 5221, GIS-TERALAB, Universite Montpellier II, 34095 Montpellier (France)


    We report observation of electron-electron (e-e) interaction effect on cyclotron resonance (CR) in InAs/AlSb quantum well heterostructures. High mobility values allow us to observe strongly pronounced triple splitting of CR line at noninteger filling factors of Landau levels ν. At magnetic fields, corresponding to ν > 4, experimental values of CR energies are in good agreement with single-electron calculations on the basis of eight-band k ⋅ p Hamiltonian. In the range of filling factors 3 < ν < 4 pronounced, splitting of CR line, exceeding significantly the difference in single-electron CR energies, is discovered. The strength of the splitting increases when occupation of the partially filled Landau level tends to a half, being in qualitative agreement with previous prediction by MacDonald and Kallin [Phys. Rev. B 40, 5795 (1989)]. We demonstrate that such behaviour of CR modes can be quantitatively described if one takes into account both electron correlations and the mixing between conduction and valence bands in the calculations of matrix elements of e-e interaction.

  2. Ab initio MCDHF calculations of electron-nucleus interactions (United States)

    Bieroń, Jacek; Froese Fischer, Charlotte; Fritzsche, Stephan; Gaigalas, Gediminas; Grant, Ian P.; Indelicato, Paul; Jönsson, Per; Pyykkö, Pekka


    We present recent advances in the development of atomic ab initio multiconfiguration Dirac-Hartree-Fock theory, implemented in the GRASP relativistic atomic structure code. For neutral atoms, the deviations of properties calculated within the Dirac-Hartree-Fock (DHF) method (based on independent particle model of an atomic cloud) are usually dominated by electron correlation effects, i.e. the non-central interactions of individual electrons. We present the recent advances in accurate calculations of electron correlation effects in small, medium, and heavy neutral atoms. We describe methods of systematic development of multiconfiguration expansions leading to systematic, controlled improvement of the accuracy of the ab initio calculations. These methods originate from the concept of the complete active space (CAS) model within the DHF theory, which, at least in principle, permits fully relativistic calculations with full account of electron correlation effects. The calculations within the CAS model on currently available computer systems are feasible only for very light systems. For heavier atoms or ions with more than a few electrons, restrictions have to be imposed on the multiconfiguration expansions. We present methods and tools, which are designed to extend the numerical calculations in a controlled manner, where multiconfiguration expansions account for all leading electron correlation effects. We show examples of applications of the GRASP code to calculations of hyperfine structure constants, but the code may be used for calculations of arbitrary bound-state atomic properties. In recent years it has been applied to calculations of atomic and ionic spectra (transition energies and rates), to determinations of nuclear electromagnetic moments, as well as to calculations related to interactions of bound electrons with nuclear electromagnetic moments leading to violations of discrete symmetries.

  3. Surface treatment by the ion flow from electron beam generated plasma in the forevacuum pressure range

    Directory of Open Access Journals (Sweden)

    Klimov Aleksandr


    Full Text Available The paper presents research results of peculiarities of gas ion flows usage and their generation from large plasma formation (>50 obtained by electron beam ionization of gas in the forevacuum pressure range. An upgraded source was used for electron beam generation, which allowed obtaining ribbon electron beam with no transmitting magnetic field. Absence of magnetic field in the area of ion flow formation enables to obtain directed ion flows without distorting their trajectories. In this case, independent control of current and ion energy is possible. The influence of electron beam parameters on the parameters of beam plasma and ion flow – current energy and density – was determined. The results of alumina ceramics treatment with a beam plasma ions flow are given.

  4. Temperature-Dependent Electron-Electron Interaction in Graphene on SrTiO3. (United States)

    Ryu, Hyejin; Hwang, Jinwoong; Wang, Debin; Disa, Ankit S; Denlinger, Jonathan; Zhang, Yuegang; Mo, Sung-Kwan; Hwang, Choongyu; Lanzara, Alessandra


    The electron band structure of graphene on SrTiO3 substrate has been investigated as a function of temperature. The high-resolution angle-resolved photoemission study reveals that the spectral width at Fermi energy and the Fermi velocity of graphene on SrTiO3 are comparable to those of graphene on a BN substrate. Near the charge neutrality, the energy-momentum dispersion of graphene exhibits a strong deviation from the well-known linearity, which is magnified as temperature decreases. Such modification resembles the characteristics of enhanced electron-electron interaction. Our results not only suggest that SrTiO3 can be a plausible candidate as a substrate material for applications in graphene-based electronics but also provide a possible route toward the realization of a new type of strongly correlated electron phases in the prototypical two-dimensional system via the manipulation of temperature and a proper choice of dielectric substrates.

  5. Gold nanoparticle assisted assembly of a heme protein for enhancement of long-range interfacial electron transfer

    DEFF Research Database (Denmark)

    Jensen, Palle Skovhus; Chi, Qijin; Grumsen, Flemming Bjerg


    -defined stoichiometry. The systems were investigated in homogeneous solution and at liquid/solid interface. Conjugation of cyt c results in a small but consistent broadening of the nanoparticle plasmon band. This phenomenon can be explained in terms of long-range electronic interactions between the gold nanoparticle...... and characterization of water-soluble gold nanoparticles (AuNPs) with core diameter 3-4 nm and their application for the enhancement of long-range interfacial ET of a heme protein. Gold nanoparticles were electrostatically conjugated with cyt c to form nanoparticle-protein hybrid ET systems with well...... and the protein molecule. When the nanoparticle-protein conjugates are assembled on Au(111) surfaces, long-range interfacial ET across a physical distance of over 50 A via the nanoparticle becomes feasible. Moreover, significant enhancement of the interfacial ET rate by more than an order of magnitude compared...

  6. The electron-atom interaction in partially ionized dense plasmas

    Energy Technology Data Exchange (ETDEWEB)

    Omarbakiyeva, Yu A; Ramazanov, T S; Roepke, G [IETP, Al Farabi Kazakh National University, Tole Bi 96a, Almaty 050012 (Kazakhstan)], E-mail:


    The electron-atom interaction is considered in dense partially ionized plasmas. The separable potential is constructed from scattering data using effective radius theory. Parameters of the interaction potential were obtained from phase shifts, scattering length and effective radius. The binding energy of the electron in the H{sup -} ion is determined for the singlet channel on the basis of the reconstructed separable potential. In dense plasmas, the influence of the Pauli exclusion principle on the phase shifts and the binding energy is considered. Due to the Pauli blocking, the binding energy vanishes at the Mott density. At that density the behavior of the phase shifts is drastically changed. This leads to modifications of macroscopic properties such as composition and transport coefficients.

  7. Analysis of Exchange Interaction and Electron Delocalization as Intramolecular Determinants of Intermolecular Electron-Transfer Kinetics. (United States)

    Bominaar, E. L.; Achim, C.; Borshch, S. A.; Girerd, J.-J.; Münck, E.


    During the past decades, spectroscopic characterization of exchange interactions and electron delocalization has developed into a powerful tool for the recognition of metal clusters in metalloproteins. By contrast, the biological relevance of these interactions has received little attention thus far. This paper presents a theoretical study in which this problem is addressed. The rate constant for intermolecular electron-transfer reactions which are essential in many biological processes is investigated. An expression is derived for the dependence of the rate constant for self-exchange on the delocalization degree of the mixed-valence species. This result allows us to rationalize published kinetic data. In the simplest case of electron transfer from an exchange-coupled binuclear mixed-valence donor to a diamagnetic acceptor, the rate constant is evaluated, taking into account spin factors and exchange energies in the initial and final state. The theoretical analysis indicates that intramolecular spin-dependent electron delocalization (double exchange) and Heisenberg-Dirac-van Vleck (HDvV) exchange have an important impact on the rate constant for intermolecular electron transfer. This correlation reveals a novel relationship between magnetochemistry and electrochemistry. Contributions to the electron transfer from the ground and excited states of the exchange-coupled dimer have been evaluated. For clusters in which these states have different degrees of delocalization, the excited-state contributions to electron transfer may become dominant at potentials which are less reductive than the potential at which the rate constant for the transfer from the ground state is maximum. The rate constant shows a steep dependence on HDvV exchange, which suggests that an exchange-coupled cluster can act as a molecular switch for exchange-controlled electron gating. The relevance of this result is discussed in the context of substrate specificity of electron-transfer reactions in

  8. Equilibrium properties of quantum spin systems with nonadditive long-range interactions. (United States)

    Mori, Takashi


    We study equilibrium states of quantum spin systems with nonadditive long-range interactions by adopting an appropriate scaling of the interaction strength, i.e., the so-called Kac prescription. In classical spin systems, it is known that the equilibrium free energy is obtained by minimizing the free-energy functional over the coarse-grained magnetization. Here we show that it is also true for quantum spin systems. From this observation, it is found that when the canonical ensemble and the microcanonical ensemble are not equivalent in some parameter region, it is not necessarily justified to replace the actual long-range interaction by the infinite-range interaction (Curie-Weiss-type interaction). On the other hand, in the parameter region where the two ensembles are equivalent, this replacement is always justified. We examine the Heisenberg XXZ model as an illustrative example and discuss the relation to experiments.

  9. Long-range Acoustic Interactions in Insect Swarms - An Adaptive Gravity Model (United States)

    Gorbonos, Dan; Ianconescu, Reuven; Puckett, James G.; Ni, Rui; Ouellette, Nicholas T.; Gov, Nir S.

    The collective motion of groups of animals emerges from the net effect of the interactions between individual members of the group. In many cases, such as birds, fish, or ungulates, these interactions are mediated by sensory stimuli that predominantly arise from nearby neighbors. But not all stimuli in animal groups are short range. We consider mating swarms of midges, which are thought to interact primarily via long-range acoustic stimuli. We exploit the similarity in form between the decay of acoustic and gravitational sources to build a model for swarm behavior. By accounting for the adaptive nature of the midges' acoustic sensing, we show that our ``adaptive gravity'' model makes mean-field predictions that agree well with experimental observations of laboratory swarms. Our results highlight the role of sensory mechanisms and interaction range in collective animal behavior. Additionally, the adaptive interactions open a new class of equations of motion, which may appear in other biological contexts.

  10. Geographical patterns of adaptation within a species' range : Interactions between drift and gene flow

    NARCIS (Netherlands)

    Alleaume-Benharira, M; Pen, IR; Ronce, O

    We use individual-based stochastic simulations and analytical deterministic predictions to investigate the interaction between drift, natural selection and gene flow on the patterns of local adaptation across a fragmented species' range under clinally varying selection. Migration between populations

  11. Novel acoustic technology for studying free-ranging shark social behaviour by recording individuals' interactions

    National Research Council Canada - National Science Library

    Guttridge, Tristan L; Gruber, Samuel H; Krause, Jens; Sims, David W


    Group behaviours are widespread among fish but comparatively little is known about the interactions between free-ranging individuals and how these might change across different spatio-temporal scales...

  12. How interactions between animal movement and landscape processes modify range dynamics and extinction risk (United States)

    Range dynamics models now incorporate many of the mechanisms and interactions that drive species distributions. However, connectivity continues to be studied using overly simple distance-based dispersal models with little consideration of how the individual behavior of dispersin...

  13. Analysis of the exactness of mean-field theory in long-range interacting systems. (United States)

    Mori, Takashi


    Relationships between general long-range interacting classical systems on a lattice and the corresponding mean-field models (infinitely long-range interacting models) are investigated. We study systems in arbitrary dimension d for periodic boundary conditions and focus on the free energy for fixed value of the total magnetization. As a result, it is shown that the equilibrium free energy of the long-range interacting systems are exactly the same as that of the corresponding mean-field models (exactness of the mean-field theory). Moreover, the mean-field metastable states can be also preserved in general long-range interacting systems. It is found that in the case that the magnetization is conserved, the mean-field theory does not give correct property in some parameter region.

  14. High Dynamic Range Pixel Array Detector for Scanning Transmission Electron Microscopy. (United States)

    Tate, Mark W; Purohit, Prafull; Chamberlain, Darol; Nguyen, Kayla X; Hovden, Robert; Chang, Celesta S; Deb, Pratiti; Turgut, Emrah; Heron, John T; Schlom, Darrell G; Ralph, Daniel C; Fuchs, Gregory D; Shanks, Katherine S; Philipp, Hugh T; Muller, David A; Gruner, Sol M


    We describe a hybrid pixel array detector (electron microscope pixel array detector, or EMPAD) adapted for use in electron microscope applications, especially as a universal detector for scanning transmission electron microscopy. The 128×128 pixel detector consists of a 500 µm thick silicon diode array bump-bonded pixel-by-pixel to an application-specific integrated circuit. The in-pixel circuitry provides a 1,000,000:1 dynamic range within a single frame, allowing the direct electron beam to be imaged while still maintaining single electron sensitivity. A 1.1 kHz framing rate enables rapid data collection and minimizes sample drift distortions while scanning. By capturing the entire unsaturated diffraction pattern in scanning mode, one can simultaneously capture bright field, dark field, and phase contrast information, as well as being able to analyze the full scattering distribution, allowing true center of mass imaging. The scattering is recorded on an absolute scale, so that information such as local sample thickness can be directly determined. This paper describes the detector architecture, data acquisition system, and preliminary results from experiments with 80-200 keV electron beams.

  15. Measuring exchange interactions between atomic spins using electron spin resonance STM (United States)

    Yang, Kai; Paul, William; Natterer, Fabian; Choi, Taeyoung; Heinrich, Andreas; Lutz, Christopher

    Exchange interactions between neighboring atoms give rise to magnetic order in magnetic materials. As the size of the electronic device is miniaturized toward the limit of single atoms, magnetic nanostructures such as coupled atomic dimers and clusters are explored more as prototypes for possible data storage, spintronics as well as quantum computing applications. Characterizing inter-atom exchange interactions calls for increasing spatial resolution and higher energy sensitivity to better understand this fundamental interaction. Here, using spin-polarized scanning tunneling microscopy (STM), we studied a magnetically coupled atomic dimer consisting of two 3d transition metal atoms, with one adsorbed on an insulating layer (MgO) and the other attached to the STM tip. We demonstrate the ability to measure the short-range exchange interaction between the two atomic spins with orders-of-magnitude variation ranging from milli-eV all the way to micro-eV. This is realized by the successful combination of inelastic electron tunneling spectroscopy (IETS) and electron spin resonance (ESR) techniques in STM implemented at different energy scales. We unambiguously confirm the exponential decay behavior of the direct exchange interaction.

  16. Constraints on spin-dependent short-range interactions using gravitational quantum levels of ultracold neutrons

    CERN Document Server

    Baeßler, S; Pignol, G; Protasov, K V; Voronin, A Yu


    In this paper, we discuss a possibility to improve constraints on spin-dependent short-range interactions in the range of 1 - 200 micrometer significantly. For such interactions, our constraints are without competition at the moment. They were obtained through the observation of gravitationally bound states of ultracold neutrons. We are going to improve these constraints by about three orders of magnitude in a dedicated experiment with polarized neutrons using the next-generation spectrometer GRANIT.

  17. Electrical, optical, and electronic properties of Al:ZnO films in a wide doping range

    Energy Technology Data Exchange (ETDEWEB)

    Valenti, Ilaria; Valeri, Sergio [CNR, Istituto Nanoscienze, S3, Via G. Campi 213/a, 41125 Modena (Italy); Dipartimento di Scienze Fisiche, Informatiche e Matematiche, Università di Modena e Reggio Emilia, Via G. Campi 213/a, 41125 Modena (Italy); Benedetti, Stefania, E-mail:; Bona, Alessandro di [CNR, Istituto Nanoscienze, S3, Via G. Campi 213/a, 41125 Modena (Italy); Lollobrigida, Valerio [Dipartimento di Scienze, Università Roma Tre, I-00146 Rome, Italy and Dipartimento di Matematica e Fisica, Università Roma Tre, I-00146 Rome (Italy); Perucchi, Andrea; Di Pietro, Paola [INSTM Udr Trieste-ST and Elettra-Sincrotrone Trieste S.C.p.A., Area Science Park, I-34012 Trieste (Italy); Lupi, Stefano [CNR-IOM and Dipartimento di Fisica, Università di Roma Sapienza, P.le Aldo Moro 2, I-00185 Roma (Italy); Torelli, Piero [Laboratorio TASC, IOM-CNR, S.S. 14 km 163.5, Basovizza, I-34149 Trieste (Italy)


    The combination of photoemission spectroscopies, infrared and UV-VIS absorption, and electric measurements has allowed to clarify the mechanisms governing the conductivity and the electronic properties of Al-doped ZnO (AZO) films in a wide doping range. The contribution of defect-related in-gap states to conduction has been excluded in optimally doped films (around 4 at. %). The appearance of gap states at high doping, the disappearance of occupied DOS at Fermi level, and the bands evolution complete the picture of electronic structure in AZO when doped above 4 at. %. In this situation, compensating defects deplete the conduction band and increase the electronic bandgap of the material. Electrical measurements and figure of merit determination confirm the high quality of the films obtained by magnetron sputtering, and thus allow to extend their properties to AZO films in general.

  18. 100 keV electron backscattered range and coefficient for silicon.

    Energy Technology Data Exchange (ETDEWEB)

    Czaplewski, D.A.; Ocola, L.E. (Center for Nanoscale Materials)


    The authors have measured the range and intensity of backscattered electrons in silicon from a 100 keV source using a process independent method. Backscattered electrons contributed to the total dose of features written in a negative tone electron beam resist. Instead of measuring the height of the resist and using a contrast curve to convert the resist height to dose, the heights of the features were made equal by adjusting the backscattered contribution through dose assignments. Creating features of equal height eliminated the need to use a contrast curve to convert from resist height to total dose. Also, it allowed for measurements of the backscattered contribution from larger distances. Using a circularly symmetric torus pattern, the three-dimensional backscatter problem was reduced to a 1-dimensional Gaussian form. The authors measured the range of the backscattered electrons, {beta}, to be 31.08 {+-} 0.06 {micro}m. By varying the writing dose of the pattern, we determined the backscatter coefficient, {eta}, to be 0.63 {+-} 0.03.

  19. Short Range Correlations in Nuclei at Large xbj through Inclusive Quasi-Elastic Electron Scattering

    Energy Technology Data Exchange (ETDEWEB)

    Ye, Zhihong [Univ. of Virginia, Charlottesville, VA (United States)


    The experiment, E08-014, in Hall-A at Jefferson Lab aims to study the short-range correlations (SRC) which are necessary to explain the nuclear strength absent in the mean field theory. The cross sections for 2H, 3He, 4He, 12C, 40Ca and 48Ca, were measured via inclusive quasi-elastic electron scattering from these nuclei in a Q2 range between 0.8 and 2.8 (GeV/c)2 for x>1. The cross section ratios of heavy nuclei to 2H were extracted to study two-nucleon SRC for 1

  20. Spin segregation via dynamically induced long-range interactions in a system of ultracold fermions

    Energy Technology Data Exchange (ETDEWEB)

    Ebling, Ulrich [ICFO-Institut de Ciencies Fotoniques, Avenida Carl Friedrich Gauss, 3, 08860 Castelldefels, Barcelona (Spain); Eckardt, Andre [ICFO-Institut de Ciencies Fotoniques, Avenida Carl Friedrich Gauss, 3, 08860 Castelldefels, Barcelona (Spain); Max-Planck-Institut fuer Physik komplexer Systeme, Noethnitzer Strasse 38, D-01187 Dresden (Germany); Lewenstein, Maciej [ICFO-Institut de Ciencies Fotoniques, Avenida Carl Friedrich Gauss, 3, 08860 Castelldefels, Barcelona (Spain); Institucio Catalana de Recerca i Estudis Avancats, Lluis Companys 23, E-08010 Barcelona (Spain)


    We investigate theoretically the time evolution of a one-dimensional system of spin-1/2 fermions in a harmonic trap after, initially, a spiral spin configuration far from equilibrium is created. We predict a spin segregation building up in time already for weak interaction under realistic experimental conditions. The effect relies on the interplay between exchange interaction and the harmonic trap, and it is found for a wide range of parameters. It can be understood as a consequence of an effective, dynamically induced long-range interaction that is derived by integrating out the rapid oscillatory dynamics in the trap.

  1. Interaction factors for two elliptical embedded cracks with a wide range of aspect ratios

    Directory of Open Access Journals (Sweden)

    Kisaburo Azuma


    Full Text Available The value of stress intensity factor may be increased through the interaction of multiple cracks that are in close proximity to one another. We investigated the interaction factors of two equal elliptical cracks with a wide range of aspect ratios. Finite element analysis for a linear elastic solid was used to obtain the interaction factor for embedded cracks in an infinite model subjected to remote tension loading. Relationships between interaction factors and dimensionless distances between the cracks were discussed. The results demonstrated that the interaction factors depend on the crack aspect ratio, whose effect is related to the dimensionless distance. Thus, it is suggested that interaction factors can be reasonably characterized using different dimensionless distances depending on the aspect ratio. Finally, we provide a simple empirical formula for obtaining the interaction factors for embedded cracks.

  2. Effect of Finite-Range Interactions on Rapidly Rotating Ultracold Bosonic Atoms (United States)

    Hamamoto, Nobukuni


    We investigate the effects of the finite-range interactions of six rotating ultracold bosonic atoms using a Gaussian-type interatomic interaction model. The model is analyzed numerically by exact diagonalization within the Lowest Landau Level (LLL) approximation and semiclassical approximation. The result of exact diagonalization shows that the ground-state angular momentum changes discretely with increasing angular velocity. For the short-range limit, the ground-state angular momentum and wavefunctions agree with those of the delta interaction evaluated by Bertsch and Papenbrock [" xlink:type="simple">Phys. Rev. A 63, 023616 (2001)]. Different from the delta interaction, the ground-state angular momenta higher than 30, i.e., N(N - 1), are observed at a high angular frequency as a result of the finite-range two-body interactions. For the intermediate-range interaction, the sequence of ground-state angular momenta increases in steps of five, which was not found in previous works on the Gaussian interaction. For the long-range limit of Gaussian interaction, we find that the ground-state angular momenta increase in steps of six. These steps of the ground-state angular momentum according to the width of the Gaussian interactions are explained by semiclassical and classical analysis based on the rovibrating molecule picture. The increments of the ground-state angular momentum of five and six are explained by the semiclassical quantization condition of the rotational and vibrational modes of fivefold and sixfold molecules, respectively. Our analysis based on the classical model also confirms that the fivefold molecule picture is more stable than the sixfold molecule picture in the intermediate range of the Gaussian interaction. These results suggest that the Gaussian interaction model can be used to emulate and characterize interactions by their width as the model can reproduce various rotational states including the ground

  3. Interaction of a Relativistic Electron Beam with Magnetized Plasma (United States)

    Dorfman, Seth; Roytershteyn, Vadim; Cattell, Cynthia; van Compernolle, Bart; Delzanno, Gian Luca


    The interaction between relativistic electron beams and a magnetized plasma is a fundamental and practical problem that is relevant to many challenging issues in space physics and astrophysics. For example, it is well known that energetic particles in the Earth's radiation belts pose a danger to communication satellites. Compact electron beam sources may be used on future spacecraft to generate waves that would remove the energetic particles from the radiation belt region. A full understanding of the physics of these waves may also shed light on the mechanism for type II/III solar radio emissions. This talk will discuss experiments proposed to further advance understanding of the physical mechanisms governing beam-plasma interactions. The experiments and supporting simulations will investigate in detail the types of waves (whistler, Langmuir, etc.) produced by high-energy beams, beam stability, and feasibility for future space-based experiments. Experiments will be conducted on the Large Plasma Device (LAPD) at UCLA using a unique variable-energy electron beam recently developed at Los Alamos. We will discuss the proposed experimental setup as well as ongoing feasibility studies conducted using theoretical estimates and kinetic simulations. Supported by NSF.

  4. Configurable Electronics with Low Noise and 14-bit Dynamic Range for Photodiode-based Photon Detectors

    CERN Document Server

    Müller, H; Yin, Z; Zhou, D; Cao, X; Li, Q; Liu, Y; Zou, F; Skaali, B; Awes, T C


    We describe the principles and measured performance characteristics of custom configurable 32-channel shaper/digitizer Front End Electronics (FEE) cards with 14-bit dynamic range for use with gain-adjustable photon detectors. The electronics has been designed for the PHOS calorimeter of ALICE with avalanche photodiode (APD) readout operated at -25 C ambient temperature and a signal shaping time of $1 {\\mu}s$. The electronics has also been adopted by the EMCal detector of ALICE with the same APD readout, but operated at an ambient temperature of +20 C and with a shaping time of 100ns. The CR-RC2 signal shapers on the FEE cards are implemented in discrete logic on a 10-layer board with two shaper sections for each input channel. The two shaper sections with gain ratio of 16:1 are digitized by 10-bit ADCs and provide an effective dynamic range of 14 bits. Gain adjustment for each individual APD is available through 32 bias voltage control registers of 10-bit range. The fixed gains and shaping times of the pole-z...

  5. Electron Bubbles in Superfluid (3) 3 He-A: Exploring the Quasiparticle-Ion Interaction (United States)

    Shevtsov, Oleksii; Sauls, J. A.


    When an electron is forced into liquid ^3He, it forms an "electron bubble", a heavy ion with radius, R˜eq 1.5 nm, and mass, M˜eq 100 m_3, where m_3 is the mass of a ^3He atom. These negative ions have proven to be powerful local probes of the physical properties of the host quantum fluid, especially the excitation spectra of the superfluid phases. We recently developed a theory for Bogoliubov quasiparticles scattering off electron bubbles embedded in a chiral superfluid that provides a detailed understanding of the spectrum of Weyl Fermions bound to the negative ion, as well as a theory for the forces on moving electron bubbles in superfluid ^3He-A (Shevtsov and Sauls in Phys Rev B 94:064511, 2016). This theory is shown to provide quantitative agreement with measurements reported by the RIKEN group (Ikegami et al. in Science 341(6141):59, 2013) for the drag force and anomalous Hall effect of moving electron bubbles in superfluid ^3He-A. In this report, we discuss the sensitivity of the forces on the moving ion to the effective interaction between normal-state quasiparticles and the ion. We consider models for the quasiparticle-ion (QP-ion) interaction, including the hard-sphere potential, constrained random-phase-shifts, and interactions with short-range repulsion and intermediate-range attraction. Our results show that the transverse force responsible for the anomalous Hall effect is particularly sensitive to the structure of the QP-ion potential and that strong short-range repulsion, captured by the hard-sphere potential, provides an accurate model for computing the forces acting on the moving electron bubble in superfluid 3He-A.

  6. Transmission electron microscopy and electron diffraction study of the short-range ordering structure of alpha-LiFeO2. (United States)

    Mitome, Masanori; Kohiki, Shigemi; Murakawa, Yusuke; Hori, Kyoko; Kurashima, Keiji; Bando, Yoshio


    The basic structure of alpha-LiFeO2, lithium iron oxide, is a cubic NaCl-type structure with a lattice constant of 0.42 nm; some short-range ordering characterized by octahedral clusters exists. The local structure of the short-range ordering was investigated by transmission electron microscopy and electron diffraction. A new short-range ordering structure was found in local areas. The local structure has a cubic lattice with a doubled lattice constant. The occupation factors of cations on Wyckoff sites 4(a) and 4(b) are different from those on 24(d) sites, but the stoichiometric composition in cubic clusters is the same as the macroscopic composition. The number of pairs in which iron cations exist in nearest-neighbor sites and next nearest-neighbor sites is reduced in the structure. This means that a magnetic interaction between the iron cations is reduced by cation ordering even without spin ordering at room temperature.

  7. Topological Phase Transition between s+- and s++ Superconducting Phases from Competing Electron--Electron and Electron--Phonon Interactions (United States)

    Kim, Ki-Seok; Gammag, Rayda


    We discover a topological phase transition between conventional s+- and s++ superconducting phases by tuning the ratio of electron--electron and electron--phonon coupling constants in an FeAs-type two-band structure. Proving the existence of this unexpected quantum criticality within the mean-field theory, we propose that the quantum critical point be identified with a critical spin liquid state of an ``extended'' Dirac spectrum, where critical superconducting fluctuations cause screening of charge degrees of freedom for electronic excitations, which allows spinon excitations to carry only the spin quantum number 1/2. The emergence of the critical spin liquid state at the s+--s++ superconducting quantum critical point leads us to predict a metal--insulator--metal crossover behavior in electrical resistivity above the superconducting transition temperatures as the ratio of the electron--electron and electron--phonon coupling constants is increased. In addition, we uncover that the competition between electron--electron repulsion and electron--phonon attraction gives rise to a huge enhancement of the superconducting transition temperature near the quantum critical point which is several hundreds percent larger than that of the case when only one of the two is taken into account. Our renormalization group analysis claims that this mechanism for the enhancement of the critical temperature is not limited to superconductivity but can be applied to various Fermi surface instabilities, proposing an underlying universal structure, which turns out to be essentially identical to that of a recent study [Phys. Rev. Lett. 108 (2012) 046601] on the enhancement of the Kondo temperature in the presence of Rashba spin--orbit interaction. We speculate that the existence of this possible ``deconfined'' quantum criticality can be verified not only theoretically but also experimentally, particularly, in Li2(Pd1-xPtx)3B superconductors, varying x from 0 to 1.

  8. Interaction of the electron density fluctuations with electron cyclotron waves from the equatorial launcher in ITER (United States)

    Snicker, A.; Poli, E.; Maj, O.; Guidi, L.; Köhn, A.; Weber, H.; Conway, G. D.; Henderson, M.; Saibene, G.


    We present a numerical investigation of electron cyclotron beams interacting with electron density fluctuations in the ITER 15 MA H-mode scenario. In particular, here we study how the beam from the equatorial launcher, which shall be utilized to influence the sawtooth instability, is affected by the fluctuations. Moreover, we present the theory and first estimates of the power that is scattered from the injected O-mode to a secondary X-mode in the presence of the fluctuations. It is shown that for ITER parameters the scattered power stays within acceptable limits and broadening of the equatorial beams is less than those from the upper launcher.

  9. [Electronic learning: interactive learning in medicine or Socrates in electronic guise]. (United States)

    Wautier, J-L; Vileyn, F; Lefrère, J-J


    E-learning has been widely used for training in different fields. More recently, it was introduced during medical studies or for continuous medical education. The Canadian Universities are pioneers in e-learning creating special departments dedicated to pedagogy. Developing countries like Brazil or Central Europe have made some pilot experiments, which were successful. Several electronic companies have given a free access to the programmes and sites. The use of electronic media leads to an adaptation of teaching methods making them more interactive.

  10. Laser-electron Compton interaction in plasma channels

    Energy Technology Data Exchange (ETDEWEB)

    Pogorelsky, I.V.; Ben-Zvi, I. [Brookhaven National Lab., Upton, NY (United States); Hirose, T. [Tokyo Metropolitan Univ. (Japan). Physics Dept.


    A concept of high intensity femtosecond laser synchrotron source (LSS) is based on Compton backscattering of focused electron and laser beams. The short Rayleigh length of the focused laser beam limits the length of interaction to a few picoseconds. However, the technology of the high repetition rate high-average power picosecond lasers required for high put through LSS applications is not developed yet. Another problem associated with the picosecond laser pulses is undesirable nonlinear effects occurring when the laser photons are concentrated in a short time interval. To avoid the nonlinear Compton scattering, the laser beam has to be split, and the required hard radiation flux is accumulated over a number of consecutive interactions that complicates the LSS design. In order to relieve the technological constraints and achieve a practically feasible high-power laser synchrotron source, the authors propose to confine the laser-electron interaction region in the extended plasma channel. This approach permits to use nanosecond laser pulses instead of the picosecond pulses. That helps to avoid the nonlinear Compton scattering regime and allows to utilize already existing technology of the high-repetition rate TEA CO{sub 2} lasers operating at the atmospheric pressure. They demonstrate the advantages of the channeled LSS approach by the example of the prospective polarized positron source for Japan Linear Collider.

  11. Interaction-induced merging of Landau levels in an electron system of double quantum wells


    Shashkin, A.A.; Dolgopolov, V.T.; Clark, J. W.; Shaginyan, V. R.; Zverev, M. V.; Khodel, V. A.


    We show that the disappearance of the chemical potential jumps over the range of perpendicular magnetic fields at fixed integer filling factor in a double quantum well with a tunnel barrier is caused by the interaction-induced level merging. The distribution function in the merging regime is special in that the probability to find an electron with energy equal to the chemical potential is different for the two merged levels.


    Energy Technology Data Exchange (ETDEWEB)

    Piot, P. [NICADD, DeKalb; Andorf, M. B. [NICADD, DeKalb; Fagerberg, G. [Northern Illinois U.; Figora, M. [Northern Illinois U.; Sturtz, A. [Northern Illinois U.


    Interaction of an electron beam with external field or its own radiation has widespread applications ranging from coherent-radiation generation, phase space cooling or formation of temporally-structured beams. An efficient coupling mechanism between an electron beam and radiation field relies on the use of a magnetic undulator. In this contribution we detail our plans to build short (11-period) undulators with 7-cm period refurbishing parts of the aladdin U3 undulator [1]. Possible use of these undulators at available test facilities to support experiments relevant to cooling techniques and radiation sources are outlined.

  13. Relativistic collision rate calculations for electron-air interactions

    Energy Technology Data Exchange (ETDEWEB)

    Graham, G. [EG and G Energy Measurements, Inc., Los Alamos, NM (United States); Roussel-Dupre, R. [Los Alamos National Lab., NM (United States)


    The most recent data available on differential cross sections for electron-air interactions are used to calculate the avalanche, momentum transfer, and energy loss rates that enter into the fluid equations. Data for the important elastic, inelastic, and ionizing processes are generally available out to electron energies of 1--10 keV. Prescriptions for extending these cross sections to the relativistic regime are presented. The angular dependence of the cross sections is included where data are available as is the doubly differential cross section for ionizing collisions. The collision rates are computed by taking moments of the Boltzmann collision integrals with the assumption that the electron momentum distribution function is given by the Juettner distribution function which satisfies the relativistic H- theorem and which reduces to the familiar Maxwellian velocity distribution in the nonrelativistic regime. The distribution function is parameterized in terms of the electron density, mean momentum, and thermal energy and the rates are therefore computed on a two dimensional grid as a function of mean kinetic energy and thermal energy.

  14. Electron-Anode Interactions in Particle-in-Cell Simulations of Applied-B Ion Diodes

    Energy Technology Data Exchange (ETDEWEB)

    Bailey, J.E.; Cuneo, M.D.; Johnson, D.J.; Mehlhorn, T.A.; Pointon, T.D.; Renk, T.J.; Stygar, W.A.; Vesey, R.A.


    Particle-in-cell simulations of applied-B ion diodes using the QUICKSILVER code have been augmented with Monte Carlo calculations of electron-anode interactions (reflection and energy deposition). Extraction diode simulations demonstrate a link between the instability evolution and increased electron loss and anode heating. Simulations of radial and extraction ion diodes show spatial non-uniformity in the predicted electron loss profile leading to hot spots on the anode that rapidly exceed the 350-450 {degree}C range, known to be sufficient for plasma formation on electron-bombarded surfaces. Thermal resorption calculations indicate complete resorption of contaminants with 15-20 kcal/mole binding energies in high-dose regions of the anode during the power pulse. Comparisons of parasitic ion emission simulations and experiment show agreement in some aspects; but also highlight the need for better ion source, plasma, and neutral gas models.

  15. Close-packed structure dynamics with finite-range interaction: computational mechanics with individual layer interaction. (United States)

    Rodriguez-Horta, Edwin; Estevez-Rams, Ernesto; Lora-Serrano, Raimundo; Neder, Reinhard


    This is the second contribution in a series of papers dealing with dynamical models in equilibrium theories of polytypism. A Hamiltonian introduced by Ahmad & Khan [Phys. Status Solidi B (2000), 218, 425-430] avoids the unphysical assignment of interaction terms to fictitious entities given by spins in the Hägg coding of the stacking arrangement. In this paper an analysis of polytype generation and disorder in close-packed structures is made for such a Hamiltonian. Results are compared with a previous analysis using the Ising model. Computational mechanics is the framework under which the analysis is performed. The competing effects of disorder and structure, as given by entropy density and excess entropy, respectively, are discussed. It is argued that the Ahmad & Khan model is simpler and predicts a larger set of polytypes than previous treatments.

  16. Seeded free-electron and inverse free-electron laser techniques for radiation amplification and electron microbunching in the terahertz range

    Directory of Open Access Journals (Sweden)

    C. Sung


    Full Text Available A comprehensive analysis is presented that describes amplification of a seed THz pulse in a single-pass free-electron laser (FEL driven by a photoinjector. The dynamics of the radiation pulse and the modulated electron beam are modeled using the time-dependent FEL code, GENESIS 1.3. A 10-ps (FWHM electron beam with a peak current of 50–100 A allows amplification of a ∼1  kW seed pulse in the frequency range 0.5–3 THz up to 10–100 MW power in a relatively compact 2-m long planar undulator. The electron beam driving the FEL is strongly modulated, with some inhomogeneity due to the slippage effect. It is shown that THz microbunching of the electron beam is homogeneous over the entire electron pulse when saturated FEL amplification is utilized at the very entrance of an undulator. This requires seeding of a 30-cm long undulator buncher with a 1–3 MW of pump power with radiation at the resonant frequency. A narrow-band seed pulse in the THz range needed for these experiments can be generated by frequency mixing of CO_{2} laser lines in a GaAs nonlinear crystal. Two schemes for producing MW power pulses in seeded FELs are considered in some detail for the beam parameters achievable at the Neptune Laboratory at UCLA: the first uses a waveguide to transport radiation in the 0.5–3 THz range through a 2-m long FEL amplifier and the second employs high-gain third harmonic generation using the FEL process at 3–9 THz.

  17. Coherent manipulation of thermal transport by tunable electron-photon and electron-phonon interaction (United States)

    Paolucci, Federico; Timossi, Giuliano; Solinas, Paolo; Giazotto, Francesco


    We propose a system where coherent thermal transport between two reservoirs in non-galvanic contact is modulated by independently tuning the electron-photon and the electron-phonon coupling. The scheme is based on two gate-controlled electrodes capacitively coupled through a dc-SQUID (superconducting quantum interference device) as an intermediate phase-tunable resonator. Thereby the electron-photon interaction is modulated by controlling the flux threading the dc-SQUID (superconducting quantum interference device) and the impedance of the two reservoirs, while the electron-phonon coupling is tuned by controlling the charge carrier concentration in the electrodes. To quantitatively evaluate the behavior of the system, we propose to exploit the graphene reservoirs. In this case, the scheme can work at temperatures reaching 1 K, with unprecedented temperature modulations as large as 245 mK, transmittance up to 99%, and energy conversion efficiency up to 50%. Finally, the accuracy of heat transport control allows us to use this system as an experimental tool to determine the electron-phonon coupling in two-dimensional electronic systems.

  18. Electron-phonon interaction and pairing mechanism in superconducting Ca-intercalated bilayer graphene

    National Research Council Canada - National Science Library

    Margine, E R; Lambert, Henry; Giustino, Feliciano


    Using the ab initio anisotropic Eliashberg theory including Coulomb interactions, we investigate the electron-phonon interaction and the pairing mechanism in the recently-reported superconducting Ca...

  19. Effect of electron-electron interactions in thermoelectric power in graphene (United States)

    Ghahari, Fereshte; Zuev, Yuri; Watanabe, Kenji; Taniguchi, Takashi; Kim, Philip


    Thermoelectric power (TEP) of graphene is previously measured in the disorder limited transport regime where the semiclassical Mott relation agrees with experimental data. In this presentation, we report the TEP measurement on graphene samples deposited on hexa boron nitride substrates where drastic suppression of disorder is achieved. Our results show that at high temperatures where the inelastic scattering rate due to electron-electron (e-e) interactions is higher than the elastic scattering rate by disorders, the measured TEP exhibit a large enhancement compared to the expected TEP from the Mott relation. We also investigated TEP in the quantum Hall regime at a high magnetic fields, where we observed symmetry broken integer quantum Hall and fractional quantum Hall states due to the strong e-e interactions.

  20. Continuous Symmetry Breaking in 1D Long-Range Interacting Quantum Systems (United States)

    Maghrebi, Mohammad F.; Gong, Zhe-Xuan; Gorshkov, Alexey V.


    Continuous symmetry breaking (CSB) in low-dimensional systems, forbidden by the Mermin-Wagner theorem for short-range interactions, may take place in the presence of slowly decaying long-range interactions. Nevertheless, there is no stringent bound on how slowly interactions should decay to give rise to CSB in 1D quantum systems at zero temperature. Here, we study a long-range interacting spin chain with U (1 ) symmetry and power-law interactions V (r )˜1 /rα. Using a number of analytical and numerical techniques, we find CSB for α smaller than a critical exponent αc(≤3 ) that depends on the microscopic parameters of the model. Furthermore, the transition from the gapless X Y phase to the gapless CSB phase is mediated by the breaking of conformal and Lorentz symmetries due to long-range interactions, and is described by a universality class akin to, but distinct from, the Berezinskii-Kosterlitz-Thouless transition. Signatures of the CSB phase should be accessible in existing trapped-ion experiments.

  1. Modified Monte Carlo method for study of electron transport in degenerate electron gas in the presence of electron-electron interactions, application to graphene (United States)

    Borowik, Piotr; Thobel, Jean-Luc; Adamowicz, Leszek


    Standard computational methods used to take account of the Pauli Exclusion Principle into Monte Carlo (MC) simulations of electron transport in semiconductors may give unphysical results in low field regime, where obtained electron distribution function takes values exceeding unity. Modified algorithms were already proposed and allow to correctly account for electron scattering on phonons or impurities. Present paper extends this approach and proposes improved simulation scheme allowing including Pauli exclusion principle for electron-electron (e-e) scattering into MC simulations. Simulations with significantly reduced computational cost recreate correct values of the electron distribution function. Proposed algorithm is applied to study transport properties of degenerate electrons in graphene with e-e interactions. This required adapting the treatment of e-e scattering in the case of linear band dispersion relation. Hence, this part of the simulation algorithm is described in details.

  2. Electron-electron interaction, weak localization and spin valve effect in vertical-transport graphene devices

    Energy Technology Data Exchange (ETDEWEB)

    Long, Mingsheng; Gong, Youpin; Wei, Xiangfei; Zhu, Chao; Xu, Jianbao; Liu, Ping; Guo, Yufen; Li, Weiwei; Liu, Liwei, E-mail: [Key Laboratory of Nanodevices and Applications-CAS and Collaborative Innovation Center of Suzhou Nano Science and Technology, Suzhou Institute of Nano-Tech and Nano-Bionics, Chinese Academy of Sciences (CAS), Suzhou 215123 (China); Liu, Guangtong [Institute of Physics, Chinese Academy of Sciences, Beijing 100190 (China)


    We fabricated a vertical structure device, in which graphene is sandwiched between two asymmetric ferromagnetic electrodes. The measurements of electron and spin transport were performed across the combined channels containing the vertical and horizontal components. The presence of electron-electron interaction (EEI) was found not only at low temperatures but also at moderate temperatures up to ∼120 K, and EEI dominates over weak localization (WL) with and without applying magnetic fields perpendicular to the sample plane. Moreover, spin valve effect was observed when magnetic filed is swept at the direction parallel to the sample surface. We attribute the EEI and WL surviving at a relatively high temperature to the effective suppress of phonon scattering in the vertical device structure. The findings open a way for studying quantum correlation at relatively high temperature.

  3. Investigation of Multiconfigurational Short-Range Density Functional Theory for Electronic Excitations in Organic Molecules

    DEFF Research Database (Denmark)

    Hubert, Mickaël; Hedegård, Erik D.; Jensen, Hans Jørgen Aa


    -srDFT for a selected benchmark set of electronic excitations of organic molecules, covering the most common types of organic chromophores. This investigation confirms the expectation that the MC-srDFT method is accurate for a broad range of excitations and comparable to accurate wave function methods such as CASPT2......Computational methods that can accurately and effectively predict all types of electronic excitations for any molecular system are missing in the toolbox of the computational chemist. Although various Kohn-Sham density-functional methods (KS-DFT) fulfill this aim in some cases, they become...... and double excitations have been promising, it is nevertheless important that the accuracy of MC-srDFT is at least comparable to the best KS-DFT methods also for organic molecules that are typically of single-reference character. In this paper we therefore systematically investigate the performance of MC...

  4. Long-range Interactions, Stochasticity and Fractional Dynamics Dedicated to George M Zaslavsky (1935–2008)

    CERN Document Server

    Luo, Albert C J


    In memory of Dr. George Zaslavsky, "Long-range Interactions, Stochasticity and Fractional Dynamics" covers the recent developments of long-range interaction, fractional dynamics, brain dynamics and stochastic theory of turbulence, each chapter was written by established scientists in the field. The book is dedicated to Dr. George Zaslavsky, who was one of three founders of the theory of Hamiltonian chaos. The book discusses self-similarity and stochasticity and fractionality for discrete and continuous dynamical systems, as well as long-range interactions and diluted networks. A comprehensive theory for brain dynamics is also presented. In addition, the complexity and stochasticity for soliton chains and turbulence are addressed. The book is intended for researchers in the field of nonlinear dynamics in mathematics, physics and engineering. Dr. Albert C.J. Luo is a Professor at Southern Illinois University Edwardsville, USA. Dr. Valentin Afraimovich is a Professor at San Luis Potosi University, Mexico.

  5. The role of belowground plant-microbe interactions in climate change induced range shifts (United States)

    Ramirez, Kelly; Snoek, Basten; van der Putten, Wim


    With climate change, plants have been able to shift their ranges into novel environments were conditions have been made suitable due to warming temperature and changes in precipitation. Much belowground range expansion research has focused on either positive plant-soil interactions, such as AMF symbiosis, or on negative plant-soil interactions, such as pathogens. Less focus has been given to the core microbiome of plant hosts. Many unknowns remain in how the soil microbiome may contribute to plant adaptation to climate change, and how this may feedback to plant-soil interactions and ecosystem functions. Using high-throughput Illumina sequencing we assessed soil and root microbial communities under native and range expanding plant species spanning a north-south latitudinal transect in central Europe. As expected, the soil and root microbiomes are both strongly influenced by the plant species under which they grow. Specifically, about 10% of the microbiome could be related to the host plant species. Interestingly, we found that microbiomes associated with range shifting species are less variable than those associated with native species. Further, the enrichment of microbes in roots (from the soil) is stronger with range expanding species than with native plant species. Our research indicates that the soil and root microbiomes can provide insight into plant range shifts and may be important for plant establishment. Our results are also important at a continental and global level, as ecosystems and plant communities worldwide are effected by climate change induced range-expansions.

  6. Top-down and bottom-up forces interact at thermal range extremes on American lobster. (United States)

    Boudreau, Stephanie A; Anderson, Sean C; Worm, Boris


    Exploited marine populations are thought to be regulated by the effects of fishing, species interactions and climate. Yet, it is unclear how these forces interact and vary across a species' range. We conducted a meta-analysis of American lobster (Homarus americanus) abundance data throughout the entirety of the species' range, testing competing hypotheses about bottom-up (climate, temperature) vs. top-down (predation, fishing) regulation along a strong thermal gradient. Our results suggest an interaction between predation and thermal range - predation effects dominated at the cold and warm extremes, but not at the centre of the species' range. Similarly, there was consistent support for a positive climate effect on lobster recruitment at warm range extremes. In contrast, fishing effort followed, rather than led changes in lobster abundance over time. Our analysis suggests that the relative effects of top-down and bottom-up forcing in regulating marine populations may intensify at thermal range boundaries and weaken at the core of a species' range. © 2014 The Authors. Journal of Animal Ecology © 2014 British Ecological Society.

  7. 2012 Gordon Research Conference, Electron donor-acceptor interactions, August 5-10 2012

    Energy Technology Data Exchange (ETDEWEB)

    McCusker, James [Michigan State Univ., East Lansing, MI (United States)


    The upcoming incarnation of the Gordon Research Conference on Electron Donor Acceptor Interactions will feature sessions on classic topics including proton-coupled electron transfer, dye-sensitized solar cells, and biological electron transfer, as well as emerging areas such as quantum coherence effects in donor-acceptor interactions, spintronics, and the application of donor-acceptor interactions in chemical synthesis.

  8. Simulation of electron-matter interaction during wet-STEM electron tomography

    Energy Technology Data Exchange (ETDEWEB)

    Septiyanto, Rahmat Firman, E-mail: [MATEIS, INSA-Lyon, CNRS UMR5510, F-69621, France and Physics of Electronic Material, Departement of Physics, Faculty of Mathematic and Natural Sciences, ITB Jalan Ganesha No. 10, Bandung 40132 (Indonesia); Masenelli-Varlot, Karine [MATEIS, INSA-Lyon, CNRS UMR5510, F-69621 (France); Iskandar, Ferry [Physics of Electronic Material, Departement of Physics, Faculty of Mathematic and Natural Sciences, ITB Jalan Ganesha No. 10, Bandung 40132 (Indonesia)


    Tomography is an efficient tool to probe the 3 dimensional (3D) structure of materials. In the laboratory, a device has been developed to perform electron tomography in an environmental scanning electron microscopy (ESEM). The configuration of Scanning Transmission Electron Microscopy (STEM) in Environmental Scanning Electron Microscopy (ESEM) provides a novel approach for the characterization of the 3D structure of materials and optimizes a compromise between the resolution level of a few nm and the large tomogram due to the high thickness of transparency. Moreover, STEM allows the observation in 2D of wet samples in an ESEM by finely controlling the sample temperature and the water pressure of the sample environment. It has been recently demonstrated that it was possible to acquire image series of hydrated objects and thus to attain 3D characterization of wet samples. In order to get reliable and quantitative data, the present study deals with the simulation of electron-matter interactions. From such simulation on the MCM-41 material, we determine the minimum quantity of water layer which can be detected on wet materials.

  9. The pluripotent regulatory circuitry connecting promoters to their long-range interacting elements. (United States)

    Schoenfelder, Stefan; Furlan-Magaril, Mayra; Mifsud, Borbala; Tavares-Cadete, Filipe; Sugar, Robert; Javierre, Biola-Maria; Nagano, Takashi; Katsman, Yulia; Sakthidevi, Moorthy; Wingett, Steven W; Dimitrova, Emilia; Dimond, Andrew; Edelman, Lucas B; Elderkin, Sarah; Tabbada, Kristina; Darbo, Elodie; Andrews, Simon; Herman, Bram; Higgs, Andy; LeProust, Emily; Osborne, Cameron S; Mitchell, Jennifer A; Luscombe, Nicholas M; Fraser, Peter


    The mammalian genome harbors up to one million regulatory elements often located at great distances from their target genes. Long-range elements control genes through physical contact with promoters and can be recognized by the presence of specific histone modifications and transcription factor binding. Linking regulatory elements to specific promoters genome-wide is currently impeded by the limited resolution of high-throughput chromatin interaction assays. Here we apply a sequence capture approach to enrich Hi-C libraries for >22,000 annotated mouse promoters to identify statistically significant, long-range interactions at restriction fragment resolution, assigning long-range interacting elements to their target genes genome-wide in embryonic stem cells and fetal liver cells. The distal sites contacting active genes are enriched in active histone modifications and transcription factor occupancy, whereas inactive genes contact distal sites with repressive histone marks, demonstrating the regulatory potential of the distal elements identified. Furthermore, we find that coregulated genes cluster nonrandomly in spatial interaction networks correlated with their biological function and expression level. Interestingly, we find the strongest gene clustering in ES cells between transcription factor genes that control key developmental processes in embryogenesis. The results provide the first genome-wide catalog linking gene promoters to their long-range interacting elements and highlight the complex spatial regulatory circuitry controlling mammalian gene expression. © 2015 Schoenfelder et al.; Published by Cold Spring Harbor Laboratory Press.

  10. Local Electron Interaction with Point Defects in Sphalerite Zinc Selenide: Calculation from First Principles (United States)

    Malyk, O. P.; Syrotyuk, S. V.


    The present article deals with the description of electron scattering on the different types of point defects in zinc blende ZnSe on the basis of short-range principles. The electron interaction with polar and nonpolar optical phonons, piezoelectric and acoustic phonons, neutral and ionized impurities and static strain centers is considered. The electron transition probabilities and, respectively, the kinetic coefficients in zinc selenide, were calculated using the numerical eigenfunction and self-consistent potential obtained within the ab initio density functional theory. The latter were evaluated using the projector augmented waves formalism as implemented in the ABINIT software suite. We investigated ZnSe samples with defect concentration 4.7 × 1015-1.08 × 1017 cm-3 , then calculated temperature dependencies of electron mobility and Hall factors in the range of 20-400 K. It is shown that the theoretical curves obtained in the framework of short-range scattering models much better coincide with experimental data than the curves calculated on the basis of long-range scattering models.

  11. The Spectrum of Particles with Short-Ranged Interactions in a Harmonic Trap

    Directory of Open Access Journals (Sweden)

    Metsch B. Ch.


    Full Text Available The possibility to control short-ranged interactions of cold gases in optical traps by Feshbachresonances makes these systems ideal candidates to study universal scaling properties and Efimov physics. The spectrum of particles in a trap, idealised by a harmonic oscillator potential, in the zero range limit with 2- and 3-particle contact interactions is studied numerically. The Hamiltonian is regularised by restricting the oscillator basis and the coupling constants are tuned such that the ground state energies of the 2- and 3-particle sector are reproduced [1],[2]. Results for 2-, 3-, and 4 particle systems are presented and compared to exact results [3],[4].

  12. Long-range protein electron transfer observed at the single-molecule level

    DEFF Research Database (Denmark)

    Chi, Qijin; Farver, Ole; Ulstrup, Jens


    potential. Maximum resonance appears around the equilibrium redox potential of azurin with an on/off current ratio of approximately 9. Simulation analyses, based on a two-step interfacial ET model for the scanning tunneling microscopy redox process, were performed and provide quantitative information......A biomimetic long-range electron transfer (ET) system consisting of the blue copper protein azurin, a tunneling barrier bridge, and a gold single-crystal electrode was designed on the basis of molecular wiring self-assembly principles. This system is sufficiently stable and sensitive in a quasi...

  13. Long-range interactions of hydrogen atoms in excited states. III. n S -1 S interactions for n ≥3 (United States)

    Adhikari, C. M.; Debierre, V.; Jentschura, U. D.


    The long-range interaction of excited neutral atoms has a number of interesting and surprising properties such as the prevalence of long-range oscillatory tails and the emergence of numerically large van der Waals C6 coefficients. Furthermore, the energetically quasidegenerate n P states require special attention and lead to mathematical subtleties. Here we analyze the interaction of excited hydrogen atoms in n S states (3 ≤n ≤12 ) with ground-state hydrogen atoms and find that the C6 coefficients roughly grow with the fourth power of the principal quantum number and can reach values in excess of 240 000 (in atomic units) for states with n =12 . The nonretarded van der Waals result is relevant to the distance range R ≪a0/α , where a0 is the Bohr radius and α is the fine-structure constant. The Casimir-Polder range encompasses the interatomic distance range a0/α ≪R ≪ℏ c /L , where L is the Lamb shift energy. In this range, the contribution of quasidegenerate excited n P states remains nonretarded and competes with the 1 /R2 and 1 /R4 tails of the pole terms, which are generated by lower-lying m P states with 2 ≤m ≤n -1 , due to virtual resonant emission. The dominant pole terms are also analyzed in the Lamb shift range R ≫ℏ c /L . The familiar 1 /R7 asymptotics from the usual Casimir-Polder theory is found to be completely irrelevant for the analysis of excited-state interactions. The calculations are carried out to high precision using computer algebra in order to handle a large number of terms in intermediate steps of the calculation for highly excited states.

  14. Condensation transition in a conserved generalized interacting zero-range process. (United States)

    Khaleque, Abdul; Sen, Parongama


    A conserved generalized zero-range process is considered in which two sites interact such that particles hop from the more populated site to the other with a probability p. The steady-state particle distribution function P(n) is obtained using both analytical and numerical methods. The system goes through several phases as p is varied. In particular, a condensate phase appears for p_{l}condensate phase using a known scaling form shows there is universal behavior in the short-range process while the infinite range process displays nonuniversality. In the noncondensate phase above p_{c}, two distinct regions are identified: p_{c}0.5; a scale emerges in the system in the latter and this feature is present for all ranges of interaction.

  15. Rapid evolution and range expansion of an invasive plant are driven by provenance-environment interactions. (United States)

    Zenni, Rafael D; Bailey, Joseph K; Simberloff, Daniel


    To improve our ability to prevent and manage biological invasions, we must understand their ecological and evolutionary drivers. We are often able to explain invasions after they happen, but our predictive ability is limited. Here, we show that range expansions of introduced Pinus taeda result from an interaction between genetic provenance and climate and that temperature and precipitation clines predict the invasive performance of particular provenances. Furthermore, we show that genotypes can occupy climate niche spaces different from those observed in their native ranges and, at least in our case, that admixture is not a main driver of invasion. Genotypes respond to climate in distinct ways, and these interactions affect the ability of populations to expand their ranges. While rapid evolution in introduced ranges is a mechanism at later stages of the invasion process, the introduction of adapted genotypes is a key driver of naturalisation of populations of introduced species. © 2014 John Wiley & Sons Ltd/CNRS.

  16. Spin g -factor due to electronic interactions in graphene (United States)

    Menezes, Natália; Alves, Van Sérgio; Marino, E. C.; Nascimento, Leonardo; Nascimento, Leandro O.; Morais Smith, C.


    The gyromagnetic factor is an important physical quantity relating the magnetic-dipole moment of a particle to its spin. The electron spin g -factor in vacuo is one of the best model-based theoretical predictions ever made, showing agreement with the measured value up to ten parts per trillion [J. Schwinger, Phys. Rev. 73, 416 (1948), 10.1103/PhysRev.73.416; R. S. Van Dyck, Jr. et al., Phys. Rev. Lett. 59, 26 (1987), 10.1103/PhysRevLett.59.26; D. Hanneke et al., Phys. Rev. Lett. 100, 120801 (2008), 10.1103/PhysRevLett.100.120801; T. Aoyama et al., Phys. Rev. Lett. 109, 111807 (2012), 10.1103/PhysRevLett.109.111807]. However, for electrons in a material the g -factor is modified with respect to its value in vacuo because of environment interactions. Here, we show how interaction effects lead to the spin g -factor correction in graphene by considering the full electromagnetic interaction in the framework of pseudo-QED [A. Kovner et al., Phys. Rev. B 42, 4748 (1990), 10.1103/PhysRevB.42.4748; N. Dorey et al., Nucl. Phys. B 386, 614 (1992), 10.1016/0550-3213(92)90632-L; S. Teber, Phys. Rev. D 86, 025005 (2012), 10.1103/PhysRevD.86.025005; S. Teber, Phys. Rev. D 89, 067702 (2014), 10.1103/PhysRevD.89.067702; E. C. Marino, Nucl. Phys. B 408, 551 (1993), 10.1016/0550-3213(93)90379-4]. We compare our theoretical prediction with experiments performed on graphene deposited on SiO2 and SiC, and we find a very good agreement between them.

  17. Electron acceleration at Jupiter: input from cyclotron-resonant interaction with whistler-mode chorus waves

    Directory of Open Access Journals (Sweden)

    E. E. Woodfield


    Full Text Available Jupiter has the most intense radiation belts of all the outer planets. It is not yet known how electrons can be accelerated to energies of 10 MeV or more. It has been suggested that cyclotron-resonant wave-particle interactions by chorus waves could accelerate electrons to a few MeV near the orbit of Io. Here we use the chorus wave intensities observed by the Galileo spacecraft to calculate the changes in electron flux as a result of pitch angle and energy diffusion. We show that, when the bandwidth of the waves and its variation with L are taken into account, pitch angle and energy diffusion due to chorus waves is a factor of 8 larger at L-shells greater than 10 than previously shown. We have used the latitudinal wave intensity profile from Galileo data to model the time evolution of the electron flux using the British Antarctic Survey Radiation Belt (BAS model. This profile confines intense chorus waves near the magnetic equator with a peak intensity at ∼5° latitude. Electron fluxes in the BAS model increase by an order of magnitude for energies around 3 MeV. Extending our results to L = 14 shows that cyclotron-resonant interactions with chorus waves are equally important for electron acceleration beyond L = 10. These results suggest that there is significant electron acceleration by cyclotron-resonant interactions at Jupiter contributing to the creation of Jupiter's radiation belts and also increasing the range of L-shells over which this mechanism should be considered.

  18. Low energy lepton scattering -- recent results for electron and positron interactions (United States)

    Sullivan, J. P.; Vizcaino, V.; Mondal, S.; Lower, J. C.; Jones, A.; Caradonna, P.; Makochekanwa, C.; Buckman, S. J.


    The interaction of low energy electrons with atoms, molecules and materials underpin a large number of technological, environmental and biomedical processes that impact on our everyday lives. Many of these areas have been well studied over the years and in some cases a large body of important and relevant cross section data has been gathered to assist in the understanding and development of the technology or phenomena. A perfect example of this is the area of low energy gaseous electronics where microscopic cross section information for a whole host of scattering processes (vibrational and electronic excitation, dissociation, ionization) have been critical to an understanding of the macroscopic behaviour of a range of gas discharge environments -- large area plasma processing discharges being a case in point. More recently there has been a realisation that fundamental information about both low energy electron and positron interactions also have significant bearing on issues of radiation damage in biological materials. Low energy electrons have been shown to cause significant damage to DNA strands, for instance, as a result of processes such as dissociative attachment -- a process which can occur at energies down to 0 eV. These processes result from the production of copious low energy electrons (body. This realisation has provided an enormous boost to the field of low energy electron physics and spawned an enormous number of new studies of interactions with biologically relevant molecules. In a similar fashion, low energy positron interactions are thought to be fundamentally important for an understanding of the atomic and molecular processes that underpin technologies such as Positron Emission Tomography (PET). PET scans image the coincident 511 keV gamma-rays that arise form the annihilation of an electron-positron pair. During a PET scan, high energy positrons thermalise in the body through scattering (ionization and excitation of molecules) until their energy

  19. Emission of low-energy electrons from multicharged ions interacting with metal surfaces

    Energy Technology Data Exchange (ETDEWEB)

    Zeijlmans van Emmichoven, P.A. (Oak Ridge National Laboratory, Oak Ridge, Tennessee 37831-6372 (United States) Joint Institute for Heavy Ion Research, Holifield Heavy Ion Research Facility, Oak Ridge, Tennessee 37831-6374 (United States)); Havener, C.C. (Oak Ridge National Laboratory, Oak Ridge, Tennessee 37831-6372 (United States)); Hughes, I.G. (Oak Ridge National Laboratory, Oak Ridge, Tennessee 37831-6372 (United States) Joint Institute for Heavy Ion Research, Holifield Heavy Ion Research Facility, Oak Ridge, Tennessee 37831-6374 (United States)); Zehner, D.M.; Meyer, F.W. (Oak Ridge National Laboratory, Oak Ridge, Tennessee 37831-6372 (United States))


    Low-energy electron spectra are reported for 60- and 100-keV multicharged ions interacting at an incident angle of 20[degree] with Au and Cu surfaces. Analysis of the spectra indicate that at least two features contribute. The first feature represents the major contribution to the total electron yield and consists of 5--10-eV electrons emitted over a wide range of angles. The angular distribution of this component is not symmetric with respect to the surface normal, but shows an increase in the forward direction of the incident ions. It will be shown that this component arises predominantly from below the surface. Possible potential-emission mechanisms which may contribute will be discussed. The second feature, which constitutes a minor part of the overall electron emission, occurs at higher electron energies ([similar to]20 eV), and is peaked at the extreme forward angles. Binary encounters between incident ions and metal electrons at the surface-vacuum interface will be shown to describe the main features of this component. At even higher electron energies ([gt]40 eV) the spectra show a tail whose slope does not depend on either the initial charge state or kinetic energy of the incident ions. The invariance with kinetic energy is in sharp contrast with the corresponding experimental results from ion-atom collisions.

  20. Interaction between Solid Nitrogen and 1-3-keV Electrons

    DEFF Research Database (Denmark)

    Schou, Jørgen; Sørensen, H.


    Experimental studies were made of the interaction between solid nitrogen and beams of 1-2-keV electrons. The projected range for the electrons was measured by means of the mirror-substrate method (gold substrate), giving the result 9.02×1016 E1.75 molecules/cm2 with the energy given in ke......V. At 3 keV, the SEE coefficient is 12 times that for solid deuterium. This is attributed partly to the larger production rate for low-energy electrons in nitrogen and partly to the larger escape probability for these electrons. Moreover, measurements were made of the electron-reflection coefficient, both......V. The escape depth for secondary electrons was studied by means of the equivalent-substrate method (carbon substrate). The results varied from 280 Å at 1 keV to 400 Å at 3 keV. Measurements were also made of the secondary-electron-emission coefficient, which varied from 2.3 el/el at 1 keV to 1.2 el/el at 3 ke...

  1. Electronic dynamics due to exchange interaction with holes in GaAs (United States)

    Schneider, Hans Christian; Krauß, Michael


    We present an investigation of electron-spin dynamics in p-doped bulk GaAs due to the electron-hole exchange interaction, aka the Bir-Aronov-Pikus mechanism. We discuss under which conditions a spin relaxation times for this mechanism is, in principle, accessible to experimental techniques, in particular to 2-photon photoemission, but also Faraday/Kerr effect measurements. We give numerical results for the spin relaxation time for a range of p-doping densities and temperatures. We then go beyond the relaxation time approximation and calculate numerically the spin-dependent electron dynamics by including the spin-flip electron-hole exchange scattering and spin-conserving carrier Coulomb scattering at the level of Boltzmann scattering integrals. We show that the electronic dynamics deviates from the simple spin-relaxation dynamics for electrons excited at high energies where the thermalization does not take place faster than the spin relaxation time. We also present a derivation of the influence of screening on the electron-hole exchange scattering and conclude that it can be neglected for the case of GaAs, but may become important for narrow-gap semiconductors.

  2. Variable range hopping in TiO2 insulating layers for oxide electronic devices

    Directory of Open Access Journals (Sweden)

    Y. L. Zhao


    Full Text Available TiO2 thin films are of importance in oxide electronics, e.g., Pt/TiO2/Pt for memristors and Co-TiO2/TiO2/Co-TiO2 for spin tunneling devices. When such structures are deposited at a variety of oxygen pressures, how does TiO2 behave as an insulator? We report the discovery of an anomalous resistivity minimum in a TiO2 film at low pressure (not strongly dependent on deposition temperature. Hall measurements rule out band transport and in most of the pressure range the transport is variable range hopping (VRH though below 20 K it was difficult to differentiate between Mott and Efros-Shklovskii's (ES mechanism. Magnetoresistance (MR of the sample with lowest resistivity was positive at low temperature (for VRH but negative above 10 K indicating quantum interference effects.

  3. Capacitive electronic metal-support interactions: Outer surface charging of supported catalyst particles (United States)

    Binninger, Tobias; Schmidt, Thomas J.; Kramer, Denis


    Electronic metal-support interactions (EMSI) in catalysis are commonly rationalized in terms of an electron transfer between support material and supported metal catalyst particles. This general perspective, however, cannot fully explain experimentally observed EMSI for metallic nanoparticulate catalysts, because the strong charge screening of metals should locally confine effects of direct electronic interaction with the support to the catalyst-support interface (CSI), which, apart from the perimeter, is largely inaccessible for catalysis reactants. The concept of capacitive EMSI is proposed here for catalyst particles at the nanometer scale, where electronic equilibration results in a long-range charging of the catalytically active outer surface (CAOS) bypassing the expected strong metallic charge screening, which is confirmed and quantified by electrostatic and density functional theory simulations revealing a strong dependence on the coverage of the support surface with catalyst particles. This long-range charge transfer leads to a shift of the local work function at the CAOS. In order to describe the catalytic consequences, an amendment of d -band theory in terms of `d -band + work function' is proposed. Furthermore, the charging of remote catalytic sites at the CAOS scales with the relative dielectric constant of the surrounding medium, and it is concluded that EMSI can have surprisingly strong influence especially in the presence of a strongly polarizable dielectric.

  4. Photon-Electron Interactions in Dirac Quantum Materials

    Energy Technology Data Exchange (ETDEWEB)

    Xu, Xiaodong [Univ. of Washington, Seattle, WA (United States). Dept. of Material Science and Engineering


    The objective of this proposal was to explore the fundamental light-matter interactions in a new class of Dirac quantum materials, atomically thin transition metal dichalcogenides (TMDs). Monolayer TMDs are newly discovered two-dimensional semiconductors with direct bandgap. Due to their hexagonal lattice structure, the band edge localizes at corner of Brillouin zone, i.e. “Dirac valleys”. This gives the corresponding electron states a “valley index” (or pseudospin) in addition to the real spin. Remarkably, the valley pseudospins have circularly polarized optical selection rules, providing the first solid state system for dynamic control of the valley degree of freedom. During this award, we have developed a suite of advanced nano-optical spectroscopy tools in the investigation and manipulation of charge, spin, and valley degrees of freedom in monolayer semiconductors. Emerging physical phenomena, such as quantum coherence between valley pseudospins, have been demonstrated for the first time in solids. In addition to monolayers, we have developed a framework in engineering, formulating, and understanding valley pseudospin physics in 2D heterostructures formed by different monolayer semiconductors. We demonstrated long-lived valley-polarized interlayer excitons with valley-dependent many-body interaction effects. These works push the research frontier in understanding the light-matter interactions in atomically-thin quantum materials for protentional transformative energy technologies.

  5. Effects of non-standard neutrino-electron interactions on relic neutrino decoupling

    Energy Technology Data Exchange (ETDEWEB)

    Mangano, Gianpiero [Dipartimento di Scienze Fisiche, Universita di Napoli Federico II and INFN, Sezione di Napoli, Complesso Universitario di Monte S. Angelo, Via Cintia, I-80126 Naples (Italy); Miele, Gennaro [Dipartimento di Scienze Fisiche, Universita di Napoli Federico II and INFN, Sezione di Napoli, Complesso Universitario di Monte S. Angelo, Via Cintia, I-80126 Naples (Italy); Pastor, Sergio [Instituto de Fisica Corpuscular (CSIC-Universitat de Valencia), Ed. Institutos de Investigacion, Apdo. 22085, E-46071 Valencia (Spain)]. E-mail:; Pinto, Teguayco [Instituto de Fisica Corpuscular (CSIC-Universitat de Valencia), Ed. Institutos de Investigacion, Apdo. 22085, E-46071 Valencia (Spain); Pisanti, Ofelia [Dipartimento di Scienze Fisiche, Universita di Napoli Federico II and INFN, Sezione di Napoli, Complesso Universitario di Monte S. Angelo, Via Cintia, I-80126 Naples (Italy); Serpico, Pasquale D. [Max-Planck-Institut fuer Physik (Werner-Heisenberg-Institut), Foehringer Ring 6, D-80805 Munich (Germany)


    We consider the decoupling of neutrinos in the early Universe in presence of non-standard neutral current neutrino-electron interactions (NSI). We first discuss a semi-analytical approach to solve the relevant kinetic equations and then present the results of fully numerical and momentum-dependent calculations, including flavor neutrino oscillations. We present our results in terms of both the effective number of neutrino species (N{sub eff}) and the impact on the abundance of {sup 4}He produced during big bang nucleosynthesis. We find that the presence of neutrino-electron NSI may enhance the entropy transfer from electron-positron pairs into neutrinos instead of photons, up to a value of N{sub eff}{approx}3.12 for NSI parameters within the ranges allowed by present laboratory data, which is almost three times the effect that appears for standard weak interactions. Thus non-standard neutrino-electron interactions do not essentially modify the density of relic neutrinos nor the bounds on neutrino properties from cosmological observables, such as their mass.

  6. Study of neutrino interactions with the electronic detectors of the OPERA experiment

    CERN Document Server

    Agafonova, N.; Altinok, O.; Anokhina, A.; Aoki, S.; Ariga, A.; Ariga, T.; Autiero, D.; Badertscher, A.; Bagulya, A.; Bendhabi, A.; Bertolin, A.; Bozza, C.; Brugiere, T.; Brugnera, R.; Brunet, F.; Brunetti, G.; Buontempo, S.; Cazes, A.; Chaussard, L.; Chernyavsky, M.; Chiarella, V.; Chukanov, A.; D'Ambrosio, N.; Dal Corso, F.; De Lellis, G.; del Amo Sanchez, P.; Declais, Y.; De Serio, M.; Di Capua, F.; Di Crescenzo, A.; Di Ferdinando, D.; Di Marco, N.; Dmitrievski, S.; Dracos, M.; Duchesneau, D.; Dusini, S.; Dzhatdoev, T.; Ebert, J.; Egorov, O.; Enikeev, R.; Ereditato, A.; Esposito, L.S.; Favier, J.; Ferber, T.; Fini, R.A.; Frekers, D.; Fukuda, T.; Garfagnini, A.; Giacomelli, G.; Giorgini, M.; Gollnitz, C.; Goldberg, J.; Golubkov, D.; Goncharova, L.; Gornushkin, Y.; Grella, G.; Grianti, F.; Guler, A.M.; Gustavino, C.; Hagner, C.; Hamada, K.; Hara, T.; Hierholzer, M.; Hollnagel, A.; Hoshino, K.; Ieva, M.; Ishida, H.; Jakovcic, K.; Jollet, C.; Juget, F.; Kamiscioglu, M.; Kazuyama, K.; Kim, S.H.; Kimura, M.; Kitagawa, N.; Klicek, B.; Knuesel, J.; Kodama, K.; Komatsu, M.; Kose, U.; Kreslo, I.; Kubota, H.; Lazzaro, C.; Lenkeit, J.; Lippi, I.; Ljubicic, A.; Longhin, A.; Loverre, P.; Lutter, G.; Malgin, A.; Mandrioli, G.; Mannai, K.; Marteau, J.; Matsuo, T.; Matveev, V.; Mauri, N.; Medinaceli, E.; Meisel, F.; Meregaglia, A.; Migliozzi, P.; Mikado, S.; Miyamoto, S.; Monacelli, P.; Morishima, K.; Moser, U.; Muciaccia, M.T.; Naganawa, N.; Naka, T.; Nakamura, M.; Nakano, T.; Naumov, D.; Nikitina, V.; Niwa, K.; Nonoyama, Y.; Ogawa, S.; Okateva, N.; Olchevski, A.; Paniccia, M.; Paoloni, A.; Park, B.D.; Park, I.G.; Pastore, A.; Patrizii, L.; Pennacchio, E.; Pessard, H.; Pretzl, K.; Pilipenko, V.; Pistillo, C.; Polukhina, N.; Pozzato, M.; Pupilli, F.; Rescigno, R.; Roganova, T.; Rokujo, H.; Romano, G.; Rosa, G.; Rostovtseva, I.; Rubbia, A.; Russo, A.; Ryasny, V.; Ryazhskaya, O.; Sato, O.; Sato, Y.; Schembri, A.; Schmidt-Parzefall, W.; Schroeder, H.; Scotto Lavina, L.; Sheshukov, A.; Shibuya, H.; Shoziyoev, G.; Simone, S.; Sioli, M.; Sirignano, C.; Sirri, G.; Song, J.S.; Spinetti, M.; Stanco, L.; Starkov, N.; Stipcevic, M.; Strauss, T.; Strolin, P.; Takahashi, S.; Tenti, M.; Terranova, F.; Tezuka, I.; Tioukov, V.; Tolun, P.; Trabelsi, A.; Tran, T.; Tufanli, S.; Vilain, P.; Vladimirov, M.; Votano, L.; Vuilleumier, J.L.; Wilquet, G.; Wonsak, B.; Yakushev, V.; Yoon, C.S.; Yoshioka, T.; Yoshida, J.; Zaitsev, Y.; Zemskova, S.; Zghiche, A.; Zimmermann, R.


    The OPERA experiment is based on a hybrid technology combining electronic detectors and nuclear emulsions. OPERA collected muon-neutrino interactions during the 2008 and 2009 physics runs of the CNGS neutrino beam, produced at CERN with an energy range of about 5-35 GeV. A total of $5.3 \\times 10^{19}$ protons on target equivalent luminosity has been analysed with the OPERA electronic detectors: scintillator strips target trackers and magnetic muon spectrometers equipped with resistive plate gas chambers and drift tubes, allowing a detailed reconstruction of muon-neutrino interactions. Charged Current (CC) and Neutral Current (NC) interactions are identified, using the measurements in the electronic detectors, and the NC/CC ratio is computed. The momentum distribution and the charge of the muon tracks produced in CC interactions are analysed. Calorimetric measurements of the visible energy are performed for both the CC and NC samples. For CC events the Bjorken-$y$ distribution and the hadronic shower profile ...

  7. A screen for potential ferredoxin electron transfer partners uncovers new, redox dependent interactions. (United States)

    Hanke, G T; Satomi, Y; Shinmura, K; Takao, T; Hase, T


    Ferredoxin (Fd) is the primary soluble acceptor at the end of the photosynthetic electron transport chain, and is known to directly transfer electrons to a wide range of proteins for use in metabolism and regulatory processes. We have conducted a screen to identify new putative Fd interaction partners in the cyanobacteria Synechocystis sp. PCC 6803 using Fd-chromatography in combination with MALDI-TOF mass spectrometry. Many novel interactions were detected, including several redox enzymes, which are now candidates for further experiments to investigate electron transfer with Fd. In addition, some proteins with regulatory activity related to photosynthesis were identified. We cloned and expressed one such protein, known as RpaA, which is a specific regulator of energy transfer between phycobilisomes and PSI. Using the recombinant protein we confirmed direct interaction with Fd, and discovered that this was dependent on redox state. The screen for putative Fd-binding proteins was repeated, comparing oxidizing and reducing conditions, identifying many proteins whose interaction with Fd is redox dependent. These include several additional signaling molecules, among them the LexA repressor, Ycf53 and NII, which are all involved in interpreting the redox state of the cell. Copyright © 2010 Elsevier B.V. All rights reserved.

  8. Zero Droplet Stiffness Exponent $\\theta$ is Revealed in Short Range Spin Glasses when Probed with Large Avalanches Induced by Long Range Interactions


    Pazmandi, Ferenc; Zimanyi, Gergely T.


    We probe the droplet excitations in short range spin glasses by adding a perturbative long range interaction that decays with distance as a power law: $J/r^{\\sigma}$. It is shown that if the power law exponent $\\sigma$ is smaller than the spatial dimension $d$, the perturbation induces large scale avalanches which roll until they force the system to develop a pseudo gap in the excitation spectrum of the stabilities. This makes the perturbative long range interactions relevant for $\\sigma < \\s...

  9. Towards understanding the influence of electron-gas interactions on imaging in an environmental TEM

    DEFF Research Database (Denmark)

    Wagner, Jakob Birkedal; Boothroyd, Chris; Beleggia, Marco


    improved the point resolution to the sub-Ångström level [1] and reduced image delocalization, allowing images of surface and interface structures to be interpreted more directly [2]. However, when gas is present in the microscope the path of electrons along the column is modified due to gas......-electron scattering [3]. In general there are two approaches for performing TEM experiments in the presence of gases. These approaches are based on a differential pumping scheme and the closed cell TEM holder approach and each has its advantages and disadvantages. In the closed cell approach, gas molecules...... are confined to a thin (typically 50-200 μm thick) slab around the sample, but the electrons interact with the window material (e.g. C, SiN) as well as with the gas and the sample. In addition, the field of view is typically smaller than in a conventional TEM and a limited range of sample geometries can...

  10. Modeling Electronic-Nuclear Interactions for Excitation Energy Transfer Processes in Light-Harvesting Complexes. (United States)

    Lee, Mi Kyung; Coker, David F


    An accurate approach for computing intermolecular and intrachromophore contributions to spectral densities to describe the electronic-nuclear interactions relevant for modeling excitation energy transfer processes in light harvesting systems is presented. The approach is based on molecular dynamics (MD) calculations of classical correlation functions of long-range contributions to excitation energy fluctuations and a separate harmonic analysis and single-point gradient quantum calculations for electron-intrachromophore vibrational couplings. A simple model is also presented that enables detailed analysis of the shortcomings of standard MD-based excitation energy fluctuation correlation function approaches. The method introduced here avoids these problems, and its reliability is demonstrated in accurate predictions for bacteriochlorophyll molecules in the Fenna-Matthews-Olson pigment-protein complex, where excellent agreement with experimental spectral densities is found. This efficient approach can provide instantaneous spectral densities for treating the influence of fluctuations in environmental dissipation on fast electronic relaxation.

  11. Effective atomic numbers, electron densities and kinetic energy released in matter of vitamins for photon interaction (United States)

    Shantappa, A.; Hanagodimath, S. M.


    Effective atomic numbers, electron densities of some vitamins (Retinol, Riboflavin, Niacin, Biotin, Folic acid, Cobalamin, Phylloquinone and Flavonoids) composed of C, H, O, N, Co, P and S have been calculated for total and partial photon interactions by the direct method for energy range 1 keV-100 GeV by using WinXCOM and kinetic energy released in matter (Kerma) relative to air is calculated in energy range of 1 keV-20 MeV. Change in effective atomic number and electron density with energy is calculated for all photon interactions. Variation of photon mass attenuation coefficients with energy are shown graphically only for total photon interaction. It is observed that change in mass attenuation coefficient with composition of different chemicals is very large below 100 keV and moderate between 100 keV and 10 MeV and negligible above 10 MeV. Behaviour of vitamins is almost indistinguishable except biotin and cobalamin because of large range of atomic numbers from 1(H) to 16 (S) and 1(H) to 27(Co) respectively. K a value shows a peak due to the photoelectric effect around K-absorption edge of high- Z constituent of compound for biotin and cobalamin.


    Directory of Open Access Journals (Sweden)



    Full Text Available Generalization of the Anderson model to describe the states of electronegative impurities in liquid-metal alloys is the main aim of the present paper. The effects of the random inner field on the charge impurity states is accounted for selfconsistently. Qualitative and quantitative estimation of hamiltonian parameters has been carried out. The limits of the proposed model applicability to a description of real systems are considered. Especially, the case of the oxygen impurity in liquid sodium is studied. The modelling of the proper electron-ionic interaction potential is the main goal of the paper. The parameters of the proposed pseudopotential are analyzed in detail. The comparison with other model potentials have been carried out. Resistivity of liquid sodium containing the oxygen impurities is calculated with utilizing the form-factor of the proposed model potential. Dependence of the resistivity on impurity concentration and on the charge states is received.

  13. Long-range interactions in magnetic bilayer above the critical temperature (United States)

    de Souza, R. M. V.; Pereira, T. A. S.; Godoy, M.; de Arruda, A. S.


    In this paper we have studied the stabilization of the long-range order in (z ; x) -plane of two isotropic Heisenberg ferromagnetic monolayers coupled by a short-range exchange interaction (J⊥), by a long range dipole-dipole interactions and a magnetic field. We have applied a magnetic field along of the z-direction to study the thermodynamic properties above the critical temperature. The dispersion relation ω and the magnetization are given as function of dipolar anisotropy parameter defined as Ed =(gμ) 2 S /a3J∥ and for other Hamiltonian parameters, and they are calculated by the double-time Zubarev-Tyablikov Green's functions in the random-phase approximation (RPA). The results show that the system is unstable for values of Ed ≥ 0.012 with external magnetic field ranging between H /J∥ = 0 and 10-3. The instability appears for Ed larger then Edc = 0.0158 with H /J∥ = 10-5, Edc = 0.02885 with H /J∥ = 10-4, and Edc = 0.115 with H /J∥ = 10-3, i.e., a small magnetic field is sufficient to maintain the magnetic order in a greater range of the dipolar interaction.

  14. Long-range interactions, wobbles, and phase defects in chains of model cilia (United States)

    Brumley, Douglas R.; Bruot, Nicolas; Kotar, Jurij; Goldstein, Raymond E.; Cicuta, Pietro; Polin, Marco


    Eukaryotic cilia and flagella are chemo-mechanical oscillators capable of generating long-range coordinated motions known as metachronal waves. Pair synchronization is a fundamental requirement for these collective dynamics, but it is generally not sufficient for collective phase-locking, chiefly due to the effect of long-range interactions. Here we explore experimentally and numerically a minimal model for a ciliated surface: hydrodynamically coupled oscillators rotating above a no-slip plane. Increasing their distance from the wall profoundly affects the global dynamics, due to variations in hydrodynamic interaction range. The array undergoes a transition from a traveling wave to either a steady chevron pattern or one punctuated by periodic phase defects. Within the transition between these regimes the system displays behavior reminiscent of chimera states.

  15. UROX 2.0: an interactive tool for fitting atomic models into electron-microscopy reconstructions. (United States)

    Siebert, Xavier; Navaza, Jorge


    Electron microscopy of a macromolecular structure can lead to three-dimensional reconstructions with resolutions that are typically in the 30-10 A range and sometimes even beyond 10 A. Fitting atomic models of the individual components of the macromolecular structure (e.g. those obtained by X-ray crystallography or nuclear magnetic resonance) into an electron-microscopy map allows the interpretation of the latter at near-atomic resolution, providing insight into the interactions between the components. Graphical software is presented that was designed for the interactive fitting and refinement of atomic models into electron-microscopy reconstructions. Several characteristics enable it to be applied over a wide range of cases and resolutions. Firstly, calculations are performed in reciprocal space, which results in fast algorithms. This allows the entire reconstruction (or at least a sizeable portion of it) to be used by taking into account the symmetry of the reconstruction both in the calculations and in the graphical display. Secondly, atomic models can be placed graphically in the map while the correlation between the model-based electron density and the electron-microscopy reconstruction is computed and displayed in real time. The positions and orientations of the models are refined by a least-squares minimization. Thirdly, normal-mode calculations can be used to simulate conformational changes between the atomic model of an individual component and its corresponding density within a macromolecular complex determined by electron microscopy. These features are illustrated using three practical cases with different symmetries and resolutions. The software, together with examples and user instructions, is available free of charge at

  16. Three-body bound states with zero-range interaction in the Bethe-Salpeter approach (United States)

    Ydrefors, E.; Alvarenga Nogueira, J. H.; Gigante, V.; Frederico, T.; Karmanov, V. A.


    The Bethe-Salpeter equation for three bosons with zero-range interaction is solved for the first time. For comparison the light-front equation is also solved. The input is the two-body scattering length and the outputs are the three-body binding energies, Bethe-Salpeter amplitudes and light-front wave functions. Three different regimes are analyzed: (i) For weak enough two-body interaction the three-body system is unbound. (ii) For stronger two-body interaction a three-body bound state appears. It provides an interesting example of a deeply bound Borromean system. (iii) For even stronger two-body interaction this state becomes unphysical with a negative mass squared. However, another physical (excited) state appears, found previously in light-front calculations. The Bethe-Salpeter approach implicitly incorporates three-body forces of relativistic origin, which are attractive and increase the binding energy.

  17. Resonance zones for interactions of magnetosonic waves with radiation belt electrons and protons (United States)

    Zhang, Wenxun; Zhou, Ruoxian; Yi, Juan; Gu, Xudong; Ni, Binbin; Zheng, Chengyao; Hua, Man


    As an important plasma wave mode in the geospace, magnetosonic waves can interact with both radiation belt electrons and protons, thereby impacting the dynamics of magnetospheric particles. Based on the Doppler-shifted resonance condition and the cold plasma dispersion relation, we investigate the profiles of resonance zone and resonant frequency of the Landau resonance between radiation belt electrons and magnetosonic waves and the cyclotron resonances with protons. The results demonstrate that resonant interactions between magnetosonic waves and magnetospheric charged particles largely rely on L-shell, wave normal angle, and kinetic energy and equatorial pitch angle of particles. Resonance zones for the Landau resonance between magnetosonic waves and radiation belt electrons are confined to a very narrow (mostly less than 1°) extent of magnetic latitude, which tends to shift to lower latitudes with increasing equatorial pitch angle and decreasing electron energy. Landau resonance frequencies also increase with magnetosonic wave normal angle. In contrast, higher order cyclotron resonances of magnetosonic waves with protons are much easier to occur in a broad range of magnetic latitude. As the resonance order increases, the coverage of the resonance zone shrinks overall and occupies the geomagnetic equatorial region. In addition, resonant frequencies increase with resonance order. Corresponding to higher order cyclotron resonances, protons are more likely to interact with magnetosonic waves at intermediate to high frequencies. Our study can be useful to elaborate the resonant interaction processes between magnetosonic waves and radiation belt electrons and protons and improve the current understanding of the multi-aspect impact of magnetosonic waves on the magnetospheric particle dynamics.

  18. Neutrino-Nucleus Interactions and the Short-Range Structure of Nuclei

    Energy Technology Data Exchange (ETDEWEB)

    Cavanna, F. [Fermi National Accelerator Lab. (FNAL), Batavia, IL (United States); Palamara, O. [Fermi National Accelerator Lab. (FNAL), Batavia, IL (United States); Schiavilla, R. [Old Dominion Univ., Norfolk, VA (United States); Thomas Jefferson National Accelerator Facility (TJNAF), Newport News, VA (United States); Soderberg, M. [Syracuse Univ., NY (United States); Fermi National Accelerator Lab. (FNAL), Batavia, IL (United States); Wiringa, R. B. [Argonne National Lab. (ANL), Argonne, IL (United States)


    Improvements in theoretical modeling of Short Range structures and phenomena, and comparisons with data, will require sustained collaboration between nuclear theorists and neutrino experimentalists. The extensive history of studying this area of nuclear physics in electron- and hadron-scattering experiments, coupled with the transformative capabilities of LArTPCs to identify neutrinos, will provide a ripe opportunity for new discoveries that will further our understanding of the nucleus.

  19. Long ranged interactions in computer simulations and for quasi-2D systems

    Energy Technology Data Exchange (ETDEWEB)

    Mazars, Martial, E-mail: Martial.Mazars@th.u-psud.f


    Taking correctly into account long ranged interactions in molecular simulations of molecular models based on classical atomistic representations are essential to obtain reliable results on model systems and in simulations of biological systems. A lot of numerical methods have been developed to this end; the most important of them are reviewed in this paper. Particular attention is paid to the analytical relations between the methods, this allows comparisons on efficiency and accuracy between them and also to proceed to precise implementations of these techniques. While most of the methods have been developed for Coulomb interactions, we give also some analytical details to apply these methods to screened Coulomb (Yukawa interactions), inverse power law and dipolar interactions. Particular types of systems, the quasi-2D systems, are also considered in this paper. Quasi-2D systems represent a large class of physical systems where the spatial extension in one direction of the space is very small by comparison to the other two. These representations are very useful to describe the properties of interfaces, surfaces, fluids confined in slab geometry, etc. In computer simulations, these systems are studied with partial periodic boundary conditions: periodic boundary conditions are taken in directions where spatial extensions are large and some other boundary conditions are taken in directions with smaller extensions. In this review, we describe also the numerical methods developed to handle long ranged interactions in numerical simulations of quasi-2D systems. The properties of quasi-2D systems depend strongly on interactions between components; more specifically electrostatic and magnetic interactions and interactions with external fields are of particular interest in these systems.

  20. Quantifying Long-Range Interactions and Coherent Structure in Multi-Agent Dynamics. (United States)

    Cliff, Oliver M; Lizier, Joseph T; Wang, X Rosalind; Wang, Peter; Obst, Oliver; Prokopenko, Mikhail


    We develop and apply several novel methods quantifying dynamic multi-agent team interactions. These interactions are detected information-theoretically and captured in two ways: via (i) directed networks (interaction diagrams) representing significant coupled dynamics between pairs of agents, and (ii) state-space plots (coherence diagrams) showing coherent structures in Shannon information dynamics. This model-free analysis relates, on the one hand, the information transfer to responsiveness of the agents and the team, and, on the other hand, the information storage within the team to the team's rigidity and lack of tactical flexibility. The resultant interaction and coherence diagrams reveal implicit interactions, across teams, that may be spatially long-range. The analysis was verified with a statistically significant number of experiments (using simulated football games, produced during RoboCup 2D Simulation League matches), identifying the zones of the most intense competition, the extent and types of interactions, and the correlation between the strength of specific interactions and the results of the matches.

  1. Molecular dynamics simulation of gas models of Lennard-Jones type interactions: Extensivity associated with interaction range and external noise (United States)

    Kadijani, M. Nouri; Abbasi, H.; Nezamipour, S.


    Statistics of a two-dimensional gas model interacting through a Lennard-Jones type potential, is considered. The goal is to examine the extensivity of internal energy in respect to the potential range and external white noise through molecular dynamics simulation. Accordingly a molecular dynamics simulation model is designed that provides reasonable evidence, in this respect. It is shown that for the long range potential the internal energy scales according to non-extensive thermodynamics expectation and the criteria is specified. Besides, for the short range case we demonstrate that the external noise drastically modifies the statistics of gas and makes the internal energy non-extensive. The relation between the non-extensive parameter, q, and the relaxation time and the noise intensity is obtained.

  2. Probing new spin-independent interactions through precision spectroscopy in atoms with few electrons (United States)

    Delaunay, Cédric; Frugiuele, Claudia; Fuchs, Elina; Soreq, Yotam


    The very high precision of current measurements and theory predictions of spectral lines in few-electron atoms allows us to efficiently probe the existence of exotic forces between electrons, neutrons and protons. We investigate the sensitivity to new spin-independent interactions in transition frequencies (and their isotopic shifts) of hydrogen, helium and some heliumlike ions. We find that present data probe new regions of the force-carrier couplings to electrons and neutrons around the MeV mass range. We also find that, below few keV, the sensitivity to the electron coupling in precision spectroscopy of helium and positronium is comparable to that of the anomalous magnetic moment of the electron. Finally, we interpret our results in the dark-photon model where a new gauge boson is kinetically mixed with the photon. There, we show that helium transitions, combined with the anomalous magnetic moment of the electron, provide the strongest indirect bound from laboratory experiments above 100 keV.

  3. Fast Quantum State Transfer and Entanglement Renormalization Using Long-Range Interactions (United States)

    Eldredge, Zachary; Gong, Zhe-Xuan; Young, Jeremy T.; Moosavian, Ali Hamed; Foss-Feig, Michael; Gorshkov, Alexey V.


    In short-range interacting systems, the speed at which entanglement can be established between two separated points is limited by a constant Lieb-Robinson velocity. Long-range interacting systems are capable of faster entanglement generation, but the degree of the speedup possible is an open question. In this Letter, we present a protocol capable of transferring a quantum state across a distance L in d dimensions using long-range interactions with a strength bounded by 1 /rα. If α interactions in three dimensions.

  4. Boundary Associated Long Noncoding RNA Mediates Long-Range Chromosomal Interactions.

    Directory of Open Access Journals (Sweden)

    Ifeoma Jane Nwigwe

    Full Text Available CCCTC binding factor (CTCF is involved in organizing chromosomes into mega base-sized, topologically associated domains (TADs along with other factors that define sub-TAD organization. CTCF-Cohesin interactions have been shown to be critical for transcription insulation activity as it stabilizes long-range interactions to promote proper gene expression. Previous studies suggest that heterochromatin boundary activity of CTCF may be independent of Cohesin, and there may be additional mechanisms for defining topological domains. Here, we show that a boundary site we previously identified known as CTCF binding site 5 (CBS5 from the homeotic gene cluster A (HOXA locus exhibits robust promoter activity. This promoter activity from the CBS5 boundary element generates a long noncoding RNA that we designate as boundary associated long noncoding RNA-1 (blncRNA1. Functional characterization of this RNA suggests that the transcript stabilizes long-range interactions at the HOXA locus and promotes proper expression of HOXA genes. Additionally, our functional analysis also shows that this RNA is not needed in the stabilization of CTCF-Cohesin interactions however CTCF-Cohesin interactions are critical in the transcription of blncRNA1. Thus, the CTCF-associated boundary element, CBS5, employs both Cohesin and noncoding RNA to establish and maintain topologically associated domains at the HOXA locus.

  5. Long-range interactions in the ozone molecule: spectroscopic and dynamical points of view

    CERN Document Server

    Lepers, Maxence; Dulieu, Olivier


    Using the multipolar expansion of the electrostatic energy, we have characterized the asymptotic interactions between an oxygen atom O$(^3P)$ and an oxygen molecule O$_2(^3\\Sigma_g^-)$, both in their electronic ground state. We have calculated the interaction energy induced by the permanent electric quadrupoles of O and O$_2$ and the van der Waals energy. On one hand we determined the 27 electronic potential energy surfaces including spin-orbit connected to the O$(^3P)$ + O$_2(^3\\Sigma_g^-)$ dissociation limit of the O--O$_2$ complex. On the other hand we computed the potential energy curves characterizing the interaction between O$(^3P)$ and a O$_2(^3\\Sigma_g^-)$ molecule in its lowest vibrational level and in a low rotational level. Such curves are found adiabatic to a good approximation, namely they are only weakly coupled to each other. These results represent a first step for modeling the spectroscopy of ozone bound levels close to the dissociation limit, as well as the low energy collisions between O an...

  6. Overpotential-induced lability of the electronic overlap factor in long-range electrochemical electron transfer: charge and distance dependence

    DEFF Research Database (Denmark)

    Kornyshev, A. A.; Kuznetsov, A. M.; Nielsen, Jens Ulrik


    Long-distance electrochemical electron transfer exhibits approximately exponential dependence on the electron transfer distance. On the basis of a jellium model of the metal surface we show that the slope of the logarithm of the current vs. the transfer distance also depends strongly...... on the electrode charge. The slope is smaller the more negative the charge density due to enhanced extension of the surface electronic density profile on the solution side, and thereby better electronic overlap with the reacting molecule. The effect is sensitive to the bulk electron density of the metal...... and the localization of the electronic state at the molecular reactant site. Effects similar to these have been observed experimentally and could be common for electronically light metals....

  7. Tunable-Range, Photon-Mediated Atomic Interactions in Multimode Cavity QED

    Directory of Open Access Journals (Sweden)

    Varun D. Vaidya


    Full Text Available Optical cavity QED provides a platform with which to explore quantum many-body physics in driven-dissipative systems. Single-mode cavities provide strong, infinite-range photon-mediated interactions among intracavity atoms. However, these global all-to-all couplings are limiting from the perspective of exploring quantum many-body physics beyond the mean-field approximation. The present work demonstrates that local couplings can be created using multimode cavity QED. This is established through measurements of the threshold of a superradiant, self-organization phase transition versus atomic position. Specifically, we experimentally show that the interference of near-degenerate cavity modes leads to both a strong and tunable-range interaction between Bose-Einstein condensates (BECs trapped within the cavity. We exploit the symmetry of a confocal cavity to measure the interaction between real BECs and their virtual images without unwanted contributions arising from the merger of real BECs. Atom-atom coupling may be tuned from short range to long range. This capability paves the way toward future explorations of exotic, strongly correlated systems such as quantum liquid crystals and driven-dissipative spin glasses.

  8. Tunable-Range, Photon-Mediated Atomic Interactions in Multimode Cavity QED (United States)

    Vaidya, Varun D.; Guo, Yudan; Kroeze, Ronen M.; Ballantine, Kyle E.; Kollár, Alicia J.; Keeling, Jonathan; Lev, Benjamin L.


    Optical cavity QED provides a platform with which to explore quantum many-body physics in driven-dissipative systems. Single-mode cavities provide strong, infinite-range photon-mediated interactions among intracavity atoms. However, these global all-to-all couplings are limiting from the perspective of exploring quantum many-body physics beyond the mean-field approximation. The present work demonstrates that local couplings can be created using multimode cavity QED. This is established through measurements of the threshold of a superradiant, self-organization phase transition versus atomic position. Specifically, we experimentally show that the interference of near-degenerate cavity modes leads to both a strong and tunable-range interaction between Bose-Einstein condensates (BECs) trapped within the cavity. We exploit the symmetry of a confocal cavity to measure the interaction between real BECs and their virtual images without unwanted contributions arising from the merger of real BECs. Atom-atom coupling may be tuned from short range to long range. This capability paves the way toward future explorations of exotic, strongly correlated systems such as quantum liquid crystals and driven-dissipative spin glasses.

  9. Analysing the origin of long-range interactions in proteins using lattice models

    Directory of Open Access Journals (Sweden)

    Unger Ron


    Full Text Available Abstract Background Long-range communication is very common in proteins but the physical basis of this phenomenon remains unclear. In order to gain insight into this problem, we decided to explore whether long-range interactions exist in lattice models of proteins. Lattice models of proteins have proven to capture some of the basic properties of real proteins and, thus, can be used for elucidating general principles of protein stability and folding. Results Using a computational version of double-mutant cycle analysis, we show that long-range interactions emerge in lattice models even though they are not an input feature of them. The coupling energy of both short- and long-range pairwise interactions is found to become more positive (destabilizing in a linear fashion with increasing 'contact-frequency', an entropic term that corresponds to the fraction of states in the conformational ensemble of the sequence in which the pair of residues is in contact. A mathematical derivation of the linear dependence of the coupling energy on 'contact-frequency' is provided. Conclusion Our work shows how 'contact-frequency' should be taken into account in attempts to stabilize proteins by introducing (or stabilizing contacts in the native state and/or through 'negative design' of non-native contacts.

  10. Functional renormalization group approach for inhomogeneous one-dimensional Fermi systems with finite-ranged interactions (United States)

    Weidinger, Lukas; Bauer, Florian; von Delft, Jan


    We introduce an equilibrium formulation of the functional renormalization group (fRG) for inhomogeneous systems capable of dealing with spatially finite-ranged interactions. In the general third-order truncated form of fRG, the dependence of the two-particle vertex is described by O (N4) independent variables, where N is the dimension of the single-particle system. In a previous paper [Bauer et al., Phys. Rev. B 89, 045128 (2014), 10.1103/PhysRevB.89.045128], the so-called coupled-ladder approximation (CLA) was introduced and shown to admit a consistent treatment for models with a purely onsite interaction, reducing the vertex to O (N2) independent variables. In this work, we introduce an extended version of this scheme, called the extended coupled ladder approximation (eCLA), which includes a spatially extended feedback between the individual channels, measured by a feedback length L , using O (N2L2) independent variables for the vertex. We apply the eCLA in a static approximation and at zero temperature to three types of one-dimensional model systems, focusing on obtaining the linear response conductance. First, we study a model of a quantum point contact (QPC) with a parabolic barrier top and on-site interactions. In our setup, where the characteristic length lx of the QPC ranges between approximately 4-10 sites, eCLA achieves convergence once L becomes comparable to lx. It also turns out that the additional feedback stabilizes the fRG flow. This enables us, second, to study the geometric crossover between a QPC and a quantum dot, again for a one-dimensional model with on-site interactions. Third, the enlarged feedback also enables the treatment of a finite-ranged interaction extending over up to L sites. Using a simple estimate for the form of such a finite-ranged interaction in a QPC with a parabolic barrier top, we study its effects on the conductance and the density. We find that for low densities and sufficiently large interaction ranges the conductance

  11. Tyrosine oxidation in heme oxygenase: examination of long-range proton-coupled electron transfer. (United States)

    Smirnov, Valeriy V; Roth, Justine P


    Heme oxygenase is responsible for the degradation of a histidine-ligated ferric protoporphyrin IX (Por) to biliverdin, CO, and the free ferrous ion. Described here are studies of tyrosyl radical formation reactions that occur after oxidizing Fe(III)(Por) to Fe(IV)=O(Por(·+)) in human heme oxygenase isoform-1 (hHO-1) and the structurally homologous protein from Corynebacterium diphtheriae (cdHO). Site-directed mutagenesis on hHO-1 probes the reduction of Fe(IV)=O(Por(·+)) by tyrosine residues within 11 Å of the prosthetic group. In hHO-1, Y58· is implicated as the most likely site of oxidation, based on the pH and pD dependent kinetics. The absence of solvent deuterium isotope effects in basic solutions of hHO-1 and cdHO contrasts with the behavior of these proteins in the acidic solution, suggesting that long-range proton-coupled electron transfer predominates over electron transfer.

  12. Thermodynamic instabilities of nuclear matter at finite temperature with finite range effective interactions

    Energy Technology Data Exchange (ETDEWEB)

    Ventura, J.; Polls, A.; Vinas, X.; Pi, M. (Barcelona Univ. (Spain). Dept. de Estructura y Constituyentes de la Materia); Hernandez, S. (Buenos Aires Univ. (Argentina). Dept. de Fisica)


    A systematic study of the equation of state for symmetric nuclear matter is performed in the framework of a finite-temperature density dependent Hartree-Fock method using the Gogny finite-range effective interaction. Special attention is devoted to the density and temperature dependence of the single-particle spectrum, the effective mass and the momentum distributions. The liquid-gas phase transition and the spinodal lines are discussed, in connection with the breakup of heated nucleus into small clusters that takes place in medium energy heavy ion reactions. The level density parameter, which has been derived by a low temperature expansion of the internal energy, is also discussed. Comparisons with previous calculations using zero range effective interactions are also made. (orig.).

  13. Charge ordering and long-range interactions in layered transitionmetal oxides: a quasiclassical continuum study

    Energy Technology Data Exchange (ETDEWEB)

    Stojkovic, Branko P.; Yu, Z.G.; Chernyshev, A.L.; Bishop, A.R.; Neto, A.H. Castro; Gronbech-Jensen, Niels


    The competition between long-range and short-range interactions among holes moving in an antiferromagnet (AF), is studied within a model derived from the spin density wave picture of layered transition metal oxides. A novel numerical approach is developed which allows one to solve the problem at finite hole densities in very large systems (of order hundreds of lattice spacings), albeit in a quasiclassical limit, and to correctly incorporate the long-range part of the Coulomb interaction. The focus is on the problem of charge ordering and the charge-phase diagram: at low temperatures four different phases are found, depending on the strength of the magnetic (dipolar) interaction generated by the spin-wave exchange, and the density of holes. The four phases are the Wigner crystal, diagonal shapes, a grid phase (horizontal-vertical stripe loops) and a glassy-clumped phase. In the presence of both in-plane and out-of-plane charged impurities the stripe ordering is suppressed, although finite stripe segments persist.At finite temperatures multiscale (intermittency) dynamics is found, reminiscent of that in glasses. The dynamics of stripe melting and its implications for experiments is discussed.

  14. Charge ordering and long-range interactions in layered transition metal oxides: A quasiclassical continuum study

    Energy Technology Data Exchange (ETDEWEB)

    Stojkovic, Branko P. [Theoretical Division and Center for Nonlinear Studies, Los Alamos National Laboratory, Los Alamos, New Mexico 87545 (United States); Yu, Z. G. [Department of Chemistry, Iowa State University, Ames, Iowa 50011 (United States); Chernyshev, A. L. [Department of Physics, University of California, Riverside, California 92521 (United States); Bishop, A. R. [Theoretical Division and Center for Nonlinear Studies, Los Alamos National Laboratory, Los Alamos, New Mexico 87545 (United States); Castro Neto, A. H. [Department of Physics, University of California, Riverside, California 92521 (United States); Groenbech-Jensen, Niels [Department of Applied Science, University of California, Davis, California 95616 and NERSC, Lawrence Berkeley Laboratory, Berkeley, California 94720 (United States)


    The competition between long-range and short-range interactions among holes moving in an antiferromagnet (AF) is studied within a model derived from the spin-density-wave picture of layered transition metal oxides.A novel numerical approach is developed that allows one to solve the problem at finite hole densities in very large systems (of the order of hundreds of lattice spacings), albeit in a quasiclassical limit, and to correctly incorporate the long-range part of the Coulomb interaction. The focus is on the problem of charge ordering and the charge phase diagram: at low temperatures four different phases are found, depending on the strength of the magnetic (dipolar) interaction generated by the spin-wave exchange and the density of holes. The four phases are the Wigner crystal, diagonal stripes, a grid phase (horizontal-vertical stripe loops), and a glassy-clumped phase. In the presence of both in-plane and out-of-plane charged impurities the stripe ordering is suppressed, although finite stripe segments persist. At finite temperatures multiscale (intermittency) dynamics is found, reminiscent of that in glasses. The dynamics of stripe melting and its implications for experiments is discussed. (c) 2000 The American Physical Society.

  15. Studies of high-current relativistic electron beam interaction with gas and plasma in Novosibirsk

    Energy Technology Data Exchange (ETDEWEB)

    Sinitsky, S. L., E-mail:; Arzhannikov, A. V. [Budker Institute of Nuclear Physics, 11 Acad. Lavrentyev Ave, Novosibirsk, 630090 (Russian Federation); Novosibirsk State University, 2 Pirogova St., Novosibirsk, 630090 (Russian Federation); Burdakov, A. V. [Budker Institute of Nuclear Physics, 11 Acad. Lavrentyev Ave, Novosibirsk, 630090 (Russian Federation); Novosibirsk State Technical University, 20 Prospekt K. Marksa, Novosibirsk, 630073 (Russian Federation)


    This paper presents an overview of the studies on the interaction of a high-power relativistic electron beam (REB) with dense plasma confined in a long open magnetic trap. The main goal of this research is to achieve plasma parameters close to those required for thermonuclear fusion burning. The experimental studies were carried over the course of four decades on various devices: INAR, GOL, INAR-2, GOL-M, and GOL-3 (Budker Institute of Nuclear Physics) for a wide range of beam and plasma parameters.

  16. The Noble Gas Dimers as a Probe of the Energetic Contributions of Dispersion and Short-Range Electron Correlation in Weakly-Bound Systems


    Housden, Michael Philip; Pyper, Nicholas Charles


    Abstract The binding of the noble gas dimers is examined using a theory in which the Hartree-Fock interaction energy is augmented with both a short-range correlation term derived from the theory of a uniform electron-gas plus a dispersion energy damped according to the theory of Jabobi and Csanak. The good agreement between the predicted and experimental binding energies and equilibrium inter-nuclear separations confirms that this approach captures the essential physics of the int...

  17. Long-range interactions between excited helium and alkali-metal atoms

    KAUST Repository

    Zhang, J.-Y.


    The dispersion coefficients for the long-range interaction of the first four excited states of He, i.e., He(2 1,3S) and He(2 1,3P), with the low-lying states of the alkali-metal atoms Li, Na, K, and Rb are calculated by summing over the reduced matrix elements of the multipole transition operators. For the interaction between He and Li the uncertainty of the calculations is 0.1–0.5%. For interactions with other alkali-metal atoms the uncertainty is 1–3% in the coefficient C5, 1–5% in the coefficient C6, and 1–10% in the coefficients C8 and C10. The dispersion coefficients Cn for the interaction of He(2 1,3S) and He(2 1,3P) with the ground-state alkali-metal atoms and for the interaction of He(2 1,3S) with the alkali-metal atoms in their first 2P states are presented in this Brief Report. The coefficients for other pairs of atomic states are listed in the Supplemental Material.

  18. Coherent Many-Body Spin Dynamics in a Long-Range Interacting Ising Chain

    Directory of Open Access Journals (Sweden)

    Johannes Zeiher


    Full Text Available Coherent many-body quantum dynamics lies at the heart of quantum simulation and quantum computation. Both require coherent evolution in the exponentially large Hilbert space of an interacting many-body system. To date, trapped ions have defined the state of the art in terms of achievable coherence times in interacting spin chains. Here, we establish an alternative platform by reporting on the observation of coherent, fully interaction-driven quantum revivals of the magnetization in Rydberg-dressed Ising spin chains of atoms trapped in an optical lattice. We identify partial many-body revivals at up to about ten times the characteristic time scale set by the interactions. At the same time, single-site-resolved correlation measurements link the magnetization dynamics with interspin correlations appearing at different distances during the evolution. These results mark an enabling step towards the implementation of Rydberg-atom-based quantum annealers, quantum simulations of higher-dimensional complex magnetic Hamiltonians, and itinerant long-range interacting quantum matter.

  19. Coherent Many-Body Spin Dynamics in a Long-Range Interacting Ising Chain (United States)

    Zeiher, Johannes; Choi, Jae-yoon; Rubio-Abadal, Antonio; Pohl, Thomas; van Bijnen, Rick; Bloch, Immanuel; Gross, Christian


    Coherent many-body quantum dynamics lies at the heart of quantum simulation and quantum computation. Both require coherent evolution in the exponentially large Hilbert space of an interacting many-body system. To date, trapped ions have defined the state of the art in terms of achievable coherence times in interacting spin chains. Here, we establish an alternative platform by reporting on the observation of coherent, fully interaction-driven quantum revivals of the magnetization in Rydberg-dressed Ising spin chains of atoms trapped in an optical lattice. We identify partial many-body revivals at up to about ten times the characteristic time scale set by the interactions. At the same time, single-site-resolved correlation measurements link the magnetization dynamics with interspin correlations appearing at different distances during the evolution. These results mark an enabling step towards the implementation of Rydberg-atom-based quantum annealers, quantum simulations of higher-dimensional complex magnetic Hamiltonians, and itinerant long-range interacting quantum matter.

  20. Interplay between short-range correlated disorder and Coulomb interaction in nodal-line semimetals (United States)

    Wang, Yuxuan; Nandkishore, Rahul M.


    In nodal-line semimetals, Coulomb interactions and short-range correlated disorder are both marginal perturbations to the clean noninteracting Hamiltonian. We analyze their interplay using a weak-coupling renormalization group approach. In the clean case, the Coulomb interaction has been found to be marginally irrelevant, leading to Fermi liquid behavior. We extend the analysis to incorporate the effects of disorder. The nodal line structure gives rise to kinematical constraints similar to that for a two-dimensional Fermi surface, which plays a crucial role in the one-loop renormalization of the disorder couplings. For a twofold degenerate nodal loop (Weyl loop), we show that disorder flows to strong coupling along a unique fixed trajectory in the space of symmetry inequivalent disorder couplings. Along this fixed trajectory, all symmetry inequivalent disorder strengths become equal. For a fourfold degenerate nodal loop (Dirac loop), disorder also flows to strong coupling, however, the strengths of symmetry inequivalent disorder couplings remain different. We show that feedback from disorder reverses the sign of the beta function for the Coulomb interaction, causing the Coulomb interaction to flow to strong coupling as well. However, the Coulomb interaction flows to strong coupling asymptotically more slowly than disorder. Extrapolating our results to strong coupling, we conjecture that at low energies nodal line semimetals should be described by a noninteracting nonlinear sigma model. We discuss the relation of our results with possible many-body localization at zero temperatures in such materials.

  1. Relativistic electron beam interaction and $K_{\\alpha}$-generation in solid targets

    CERN Document Server

    Fill, E; Eder, D; Eidmann, K; Saemann, A


    When fs laser pulses interact with solid surfaces at intensities I lambda /sup 2/ >10/sup 18/ W/cm/sup 2/ mu m/sup 2/, collimated relativistic electron beams are generated. These electrons can be used for producing intense X-radiation (bremsstrahlung or K/sub alpha /) for pumping an innershell X-ray laser. The basic concept of such a laser involves the propagation of the electron beam in a material which converts electron energy into appropriate pump photons. Using the ATLAS titanium-sapphire laser at Max-Planck-Institut fur Quantenoptik, we investigate the generation of hot electrons and of characteristic radiation in copper. The laser (200 mJ/130 fs) is focused by means of an off-axis parabola to a diameter of about 10 mu m. By varying the position of the focus, we measure the copper K/sub alpha /-yield as a function of intensity in a range from 10/sup 15/ to 2 x 10/sup 18/ W/cm/sup 2/ while keeping the laser pulse energy constant. Surprisingly, the highest emission is obtained at an intensity of about 10/s...

  2. Cross sections for electron scattering by methylfluoride (CH{sub 3}F) in the low- and intermediate-energy ranges

    Energy Technology Data Exchange (ETDEWEB)

    Ferraz, J.R.; Santos, A.S. dos [Departamento de Física, UFSCar, 13565-905 São Carlos, SP (Brazil); Souza, G.L.C. de; Lee, M.-T. [Departamento de Química, UFSCar, 13565-905 São Carlos, SP (Brazil); Brescansin, L.M. [Instituto de Física “Gleb Wataghin”, UNICAMP, 13083-970 Campinas, SP (Brazil); Lucchese, R.R. [Department of Chemistry, Texas A and M University, College Station, TX 7784-3255 (United States); Machado, L.E., E-mail: [Departamento de Física, UFSCar, 13565-905 São Carlos, SP (Brazil)


    Highlights: • Theoretical investigation on e{sup −}–CH{sub 3}F collisions. • Complex optical potential is used to evaluate elastic, total, and total absorption cross sections. • Single-center expansion, combined with the Padé approximant technique, is used to solve the scattering equations. • Calculated results are in good agreement with existing theoretical and experimental data. - Abstract: We report a theoretical study on electron scattering by methylfluoride (CH{sub 3}F) in the intermediate-energy range. Calculated elastic differential, integral, and momentum-transfer, as well as grand-total (elastic + inelastic) and total absorption cross sections are reported for impact energies ranging from 15 to 500 eV. A complex optical potential is used to represent the electron–molecule interaction dynamics. A theoretical method based on the single-center-expansion close-coupling framework and corrected by the Padé approximant technique is used to solve the scattering equations. The comparison of our calculated results with experimental and other available theoretical data is encouraging.

  3. Improved Models and Tools for Prediction of Radiation Effects on Space Electronics in Wide Temperature Range Project (United States)

    National Aeronautics and Space Administration — All NASA exploration systems operate in the extreme environments of space and require reliable electronics capable of handling a wide temperature range (-180:C to...

  4. Universality in the Neutron-^{19}C Scattering Using Finite-Range Separable Interactions (United States)

    Shalchi, M. A.; Yamashita, M. T.; Hadizadeh, M. R.; Frederico, T.; Tomio, Lauro


    We report a study on the low-energy properties of the elastic s-wave scattering of a neutron ( n) in the carbon isotope ^{19}C near the critical condition for the occurrence of an excited Efimov state in the three-body n- n-^{18}C system. For the separation energy of the two halo neutrons in ^{20}C we use the available experimental data. We also investigate to which extent the universal scaling laws, strictly valid in the zero-range limit, will survive when using finite-range interactions. By allowing to vary the n-^{18}C binding energy, a scaling behavior for the real and imaginary parts of the s-wave phase-shift δ _0 is verified, emerging some universal characteristics given by the pole-position of k\\cot (δ _0^R) and effective-range parameters.

  5. Interplay of electron-electron and electron-phonon interaction in the metal to insulator transition in vanadium oxides.

    Energy Technology Data Exchange (ETDEWEB)

    Baldassarre, Leonetta [CNR-INFM COHERENTIA, Roma (Italy); Experimentalphysik II, Universitaet Augsburg (Germany); Department of Physics, University of Rome ' La Sapienza' (Italy); Arcangeletti, Emanuele; Perucchi, Andrea; Nicoletti, Daniele; Di Castro, Daniele; Marini, Carlo; Postorino, Paolo; Lupi, Stefano [CNR-INFM COHERENTIA, Roma (Italy); Department of Physics, University of Rome ' La Sapienza' (Italy)


    Several families of vanadium oxides display metal to insulator transitions (MIT) often driven by both temperature (T) and pressure (P) with jumps of conductivity up to 7 orders of magnitude. While the transition in V{sub 2}O{sub 3} is considered as induced mainly by electronic correlation (Mott-Hubbard transition), the MIT mechanism that drives the electronic transition in VO{sub 2} is still unclear, probably determined by an interplay between electronic and lattice degrees of freedom. Here we present a complete investigation of MIT as a function of T and P of V{sub 2}O{sub 3} and VO{sub 2}. Infrared measurements have been performed in a wide range of T (10-600 K) and P (0-15 GPa) in order to cover the rich phase diagrams of those materials. P-dependent Raman measurements have also been performed on VO{sub 2} so to follow also the lattice dynamics. Moreover, the high temperature incoherent phase is discussed in V{sub 2}O{sub 3}, the ideal playground to study the correlation effects on the low-energy electrodynamics.

  6. Effect of electron-phonon interaction on the impurity binding energy in a quantum wire


    Chen, Yueh-Nan; Chuu, Der-San; Lin, Yuh-Kae


    The effect of electron-optical phonon interaction on the hydrogenic impurity binding energy in a cylindrical quantum wire is studied. By using Landau and Pekar variational method, the hamiltonian is separated into two parts which contain phonon variable and electron variable respectively. A perturbative-variational technique is then employed to construct the trial wavefunction for the electron part. The effect of confined electron-optical phonon interaction on the binding energies of the grou...

  7. A study of self-consistent Hartree-Fock plus Bardeen-Cooper-Schrieffer calculations with finite-range interactions (United States)

    Anguiano, M.; Lallena, A. M.; Co', G.; De Donno, V.


    In this work we test the validity of a Hartree-Fock plus Bardeen-Cooper-Schrieffer model in which a finite-range interaction is used in the two steps of the calculation by comparing the results obtained to those found in fully self-consistent Hartree-Fock-Bogoliubov calculations using the same interaction. Specifically, we consider the Gogny-type D1S and D1M forces. We study a wide range of spherical nuclei, far from the stability line, in various regions of the nuclear chart, from oxygen to tin isotopes. We calculate various quantities related to the ground state properties of these nuclei, such as binding energies, radii, charge and density distributions, and elastic electron scattering cross sections. The pairing effects are studied by direct comparison with the Hartree-Fock results. Despite its relative simplicity, in most cases, our model provides results very close to those of the Hartree-Fock-Bogoliubov calculations, and it reproduces the empirical evidence of pairing effects rather well in the nuclei investigated.

  8. Interaction processes between vacancies and dislocations in molybdenum in the temperature range around 0.3 of the melting temperature

    Energy Technology Data Exchange (ETDEWEB)

    Zelada-Lambri, G.I. [Facultad de Ciencias Exactas, Ingenieria y Agrimensura, Universidad Nacional de Rosario, Laboratorio de Materiales, Escuela de Ingenieria Electrica, Avenida Pellegrini 250, 2000 Rosario (Argentina); Lambri, O.A. [Facultad de Ciencias Exactas, Ingenieria y Agrimensura, Universidad Nacional de Rosario, Laboratorio de Materiales, Escuela de Ingenieria Electrica, Avenida Pellegrini 250, 2000 Rosario (Argentina); Instituto de Fisica Rosario, Member of the CONICET' s Research Staff (Argentina)], E-mail:; Bozzano, P.B. [Laboratorio de Microscopia Electronica, Unidad de Actividad Materiales, Centro Atomico Constituyentes, Comision Nacional de Energia Atomica, Avenida General Paz 1499, 1650 San Martin (Argentina); Garcia, J.A. [Departamento de Fisica Aplicada II, Facultad de Ciencias y Tecnologia, Universidad del Pais Vasco, Apartado 644, 48080 Bilbao, Pais Vasco (Spain); Celauro, C.A. [Reactor Nuclear RA-4, Facultad de Ciencias Exactas, Ingenieria y Agrimensura, Universidad Nacional de Rosario, Riobamba y Berruti, 2000 Rosario (Argentina)


    Mechanical spectroscopy, electrical resistivity and transmission electron microscopy studies have been performed on pre-strained neutron irradiated single crystalline molybdenum in order to check the interaction processes between vacancies and dislocations in the temperature range between room temperature and 1273 K. The anelastic relaxation in molybdenum which appears between 800 K and 1273 K has been separated in two different physical mechanisms depending on the temperature of appearance of the relaxation peak. The physical mechanism which controls the damping peak appearing at around 800 K was related with the dragging of jogs by the dislocation under movement assisted by vacancy diffusion. The damping peak which appears at higher temperatures of about 1000 K was more consistent with the formation and diffusion of vacancies assisted by the dislocation movement.

  9. Electronic interactions between "pea" and "pod": the case of oligothiophenes encapsulated in carbon nanotubes. (United States)

    Gao, Jia; Blondeau, Pascal; Salice, Patrizio; Menna, Enzo; Bártová, Barbora; Hébert, Cécile; Leschner, Jens; Kaiser, Ute; Milko, Matus; Ambrosch-Draxl, Claudia; Loi, Maria Antonietta


    One of the most challenging strategies to achieve tunable nanophotonic devices is to build robust nanohybrids with variable emission in the visible spectral range, while keeping the merits of pristine single-walled carbon nanotubes (SWNTs). This goal is realized by filling SWNTs ("pods") with a series of oligothiophene molecules ("peas"). The physical properties of these peapods are depicted by using aberration-corrected high-resolution transmission electron microscopy, Raman spectroscopy, and other optical methods including steady-state and time-resolved measurements. Visible photoluminescence with quantum yields up to 30% is observed for all the hybrids. The underlying electronic structure is investigated by density functional theory calculations for a series of peapods with different molecular lengths and tube diameters, which demonstrate that van der Waals interactions are the bonding mechanism between the encapsulated molecule and the tube. Copyright © 2011 WILEY-VCH Verlag GmbH & Co. KGaA, Weinheim.

  10. An interactive system for creating object models from range data based on simulated annealing

    Energy Technology Data Exchange (ETDEWEB)

    Hoff, W.A.; Hood, F.W.; King, R.H. [Colorado School of Mines, Golden, CO (United States). Center for Robotics and Intelligent Systems


    In hazardous applications such as remediation of buried waste and dismantlement of radioactive facilities, robots are an attractive solution. Sensing to recognize and locate objects is a critical need for robotic operations in unstructured environments. An accurate 3-D model of objects in the scene is necessary for efficient high level control of robots. Drawing upon concepts from supervisory control, the authors have developed an interactive system for creating object models from range data, based on simulated annealing. Site modeling is a task that is typically performed using purely manual or autonomous techniques, each of which has inherent strengths and weaknesses. However, an interactive modeling system combines the advantages of both manual and autonomous methods, to create a system that has high operator productivity as well as high flexibility and robustness. The system is unique in that it can work with very sparse range data, tolerate occlusions, and tolerate cluttered scenes. The authors have performed an informal evaluation with four operators on 16 different scenes, and have shown that the interactive system is superior to either manual or automatic methods in terms of task time and accuracy.

  11. Noncovalent Intermolecular Interactions in Organic Electronic Materials: Implications for the Molecular Packing vs Electronic Properties of Acenes

    KAUST Repository

    Sutton, Christopher


    Noncovalent intermolecular interactions, which can be tuned through the toolbox of synthetic chemistry, determine not only the molecular packing but also the resulting electronic, optical, and mechanical properties of materials derived from π-conjugated molecules, oligomers, and polymers. Here, we provide an overview of the theoretical underpinnings of noncovalent intermolecular interactions and briefly discuss the computational chemistry approaches used to understand the magnitude of these interactions. These methodologies are then exploited to illustrate how noncovalent intermolecular interactions impact important electronic properties-such as the electronic coupling between adjacent molecules, a key parameter for charge-carrier transport-through a comparison between the prototype organic semiconductor pentacene with a series of N-substituted heteropentacenes. Incorporating an understanding of these interactions into the design of organic semiconductors can assist in developing novel materials systems from this fascinating molecular class. © 2015 American Chemical Society.

  12. Pairing and unpairing electron densities in organic systems: Two-electron three center through space and through bonds interactions (United States)

    Lobayan, Rosana M.; Bochicchio, Roberto C.


    Two-electron three-center bonding interactions in organic ions like methonium (CH5+), ethonium (C2H7+), and protonated alkanes n-C4H_{11}+ isomers (butonium cations) are described and characterized within the theoretical framework of the topological analysis of the electron density decomposition into its effectively paired and unpaired contributions. These interactions manifest in some of this type of systems as a concentration of unpaired electron cloud around the bond paths, in contrast to the well known paradigmatic boron hydrids in which it is not only concentrated close to the atomic nucleus and the bond paths but out of them and over the region defined by the involved atoms as a whole. This result permits to propose an attempt of classification for these interactions based in such manifestations. In the first type, it is called as interactions through bonds and in the second type as interactions through space type.

  13. Assessment of oscillator strengths with multiconfigurational short-range density functional theory for electronic excitations in organic molecules

    DEFF Research Database (Denmark)

    Hedegård, Erik Donovan


    considered the large collection of organic molecules whose excited states were investigated with a range of electronic structure methods by Thiel et al. As a by-product of our calculations of oscillator strengths, we also obtain electronic excitation energies, which enable us to compare the performance......We have in a series of recent papers investigated electronic excited states with a hybrid between a complete active space self-consistent field (CASSCF) wave function and density functional theory (DFT). This method has been dubbed the CAS short-range DFT method (CAS–srDFT). The previous papers...

  14. Pitch-angle diffusion coefficients from resonant interactions with electrostatic electron cyclotron harmonic waves in planetary magnetospheres

    Directory of Open Access Journals (Sweden)

    A. K. Tripathi


    Full Text Available Pitch-angle diffusion coefficients have been calculated for resonant interaction with electrostatic electron cyclotron harmonic (ECH waves in the magnetospheres of Earth, Jupiter, Saturn, Uranus and Neptune. Calculations have been performed at two radial distances of each planet. It is found that observed wave electric field amplitudes in the magnetospheres of Earth and Jupiter are sufficient to put electrons on strong diffusion in the energy range of less than 100 eV. However, for Saturn, Uranus and Neptune, the observed ECH wave amplitude are insufficient to put electrons on strong diffusion at any radial distance.

  15. Electron quantum dynamics in atom-ion interaction. (United States)

    Sabzyan, H; Jenabi, M J


    Electron transfer (ET) process and its dependence on the system parameters are investigated by solving two-dimensional time-dependent Schrödinger equation numerically using split operator technique. Evolution of the electron wavepacket occurs from the one-electron species hydrogen atom to another bare nucleus of charge Z > 1. This evolution is quantified by partitioning the simulation box and defining regional densities belonging to the two nuclei of the system. It is found that the functional form of the time-variations of these regional densities and the extent of ET process depend strongly on the inter-nuclear distance and relative values of the nuclear charges, which define the potential energy surface governing the electron wavepacket evolution. Also, the initial electronic state of the single-electron atom has critical effect on this evolution and its consequent (partial) electron transfer depending on its spreading extent and orientation with respect to the inter-nuclear axis.

  16. The impact range for smooth wall–liquid interactions in nanoconfined liquids

    DEFF Research Database (Denmark)

    Ingebrigtsen, Trond; Dyre, J. C.


    Bulk and nanoconfined liquids have very different physics; for instance, nanoconfined liquids show stratification and position-dependent relaxation processes. A number of similarities between bulk and nanoconfined liquids have nevertheless been reported in computer simulations during the last...... decade. Inspired by these observations, we present results from molecular dynamics computer simulations of four nanoconfined liquids (the single-component Lennard-Jones liquid, the Kob–Andersen binary Lennard-Jones mixture, an asymmetric dumbbell model, and the Dzugutov liquid) demonstrating also...... a microscopic similarity between bulk and nanoconfined liquids. The results show that the interaction range for the wall–liquid and liquid–liquid interactions of the nanoconfined liquid is identical to that of the bulk liquid if the liquid is “Roskilde simple” in bulk as well as nanoconfinement, i.e., exhibits...


    CERN Document Server

    Belli, E; Rumolo, G


    The FCC-ee is an e⁺e⁻ circular collider designed to accommodate four different experiments in a beam energy range from 91 to 350 GeV and is a part of the Future Circular Collider (FCC) project at CERN. One of the most critical aspects of this new very challenging machine regards the collective effects which can produce instabilities, thus limiting the accelerator operation and reducing its performance. The following studies are focused on the Interaction Region of the machine. This talk will present preliminary simulation results of the power loss due to the wake fields generated by the electromagnetic interaction of the beam with the vacuum chamber. A preliminary estimation of the electron cloud build-up is also reported, whose effects have been recognized as one of the main limitations for the Large Hadron Collider at CERN.

  18. FFT-based Kronecker product approximation to micromagnetic long-range interactions

    CERN Document Server

    Exl, Lukas; Mauser, Norbert J; Schrefl, Thomas; Stimming, Hans Peter; Suess, Dieter


    We derive a Kronecker product approximation for the micromagnetic long range interactions in a collocation framework by means of separable sinc quadrature. Evaluation of this operator for structured tensors (Canonical format, Tucker format, Tensor Trains) scales below linear in the volume size. Based on efficient usage of FFT for structured tensors, we are able to accelerate computations to quasi linear complexity in the number of collocation points used in one dimension. Quadratic convergence of the underlying collocation scheme as well as exponential convergence in the separation rank of the approximations is proved. Numerical experiments on accuracy and complexity confirm the theoretical results.

  19. Interaction of electromagnetic radiation with magnetically functionalized CNT nanocomposite in the subterahertz frequency range

    Energy Technology Data Exchange (ETDEWEB)

    Atdaev, A.; Danilyuk, A. L.; Labunov, V. A.; Prischepa, S. L., E-mail: [Belarusian State University of Informatics and Radioelectronics (Belarus); Pavlov, A. A. [Russian Academy of Sciences, Institute of Microelectronics Nanotechnologies (Russian Federation); Basaev, A. S.; Shaman, Yu. P. [SMC Technological Center (Russian Federation)


    The interaction of electromagnetic radiation with a magnetically functionalized nanocomposite based on carbon nanotubes (CNTs) is considered using the model of random distribution of ferromagnetic nanoparticles in the carbon matrix characterized by the presence of resistive–inductive–capacitive coupling (contours). The model is based on the representation of the nanocomposite as a system consisting of the CNT matrix, ferromagnetic nanoparticles, and the interfaces between CNTs and nanoparticles. The wide range of possible resonant phenomena caused both by the presence of contours and the properties of the CNT nanocomposite is shown.

  20. Local interactions and global properties of wild, free-ranging stickleback shoals


    Ward, Ashley; Schaerf, Timothy; Herbert-Read, James; Morrell, Lesley; Sumpter, David; Webster, Michael Munro


    Funding: Australian Research Council. A.J.W.W. and T.M.S. were supported by a Discovery Project Grant from the Australian Research Council. D.J.T.S. and J.E.H.-R. were supported by a Knut & Alice Wallenberg Foundation Grant. Collective motion describes the global properties of moving groups of animals and the self-organized, coordinated patterns of individual behaviour that produce them. We examined the group-level patterns and local interactions between individuals in wild, free-ranging s...

  1. Spectral broadening due to long-range Coulomb interactions in the molecular metal TTF-TCNQ

    Energy Technology Data Exchange (ETDEWEB)

    Koch, E.; Dolfen, A. [Inst. fuer Festkoerperforschung, Forschungszentrum Juelich (Germany); Cano-Cortes, L.; Merino, J. [Univ. Autonona de Madrid (Spain); Behler, J.; Reuter, K. [Fritz-Haber-Inst., Berlin (Germany); Delley, B. [Paul-Scherrer-Inst., Villigen (Switzerland)


    We employ density-functional theory to calculate realistic parameters for an extended Hubbard model of the molecular metal TTF-TCNQ. Considering both intra- and intermolecular screening in the crystal, we find that longer-range Coulomb interactions along the molecular stacks, as well as inter-stack coupling are of importance. Contrary to past belief, these terms do not lead to the formation of a Wigner lattice, but simply broaden the spectral function. We show how this can be understood already in perturbation theory. Moreover we calculate the effect of the nearest neighbor repulsion on the Luttinger parameter. (orig.)

  2. Parity-violating electric-dipole transitions in helium induced by the electron-electron neutral weak interaction

    Energy Technology Data Exchange (ETDEWEB)

    Esteve, J.G.; Morales, A.; Morales, J.; Nuez-Lagos, R.; Pacheco, A.F.


    The parity-violating E1 transitions between the n = 2 levels of atomic helium, induced by the electron-electron neutral weak interaction have been computed by using Coulomb-type wave functions and (up to 84 parameter) Hylleraas wave functions. The parity-violating matrix elements turn out to be of the same order of magnitude as those due to the electron-nucleus weak interaction, thus allowing one to conclude that the relative importance of both effects is to be traced to their corresponding effective coupling constants.

  3. Interaction of 3d transition metal atoms with charged ion projectiles from Electron Nuclear Dynamics computation (United States)

    Hagelberg, Frank


    Computational results on atomic scattering between charged projectiles and transition metal target atoms are presented. This work aims at obtaining detailed information about charge, spin and energy transfer processes that occur between the interacting particles. An in-depth understanding of these phenomena is expected to provide a theoretical basis for the interpretation of various types of ion beam experiments, ranging from gas phase chromatography to spectroscopic observations of fast ions in ferromagnetic media. This contribution focuses on the scattering of light projectiles ranging from He to O, that are prepared in various initial charge states, by 3d transition metal atoms. The presented computations are performed in the framework of Electron Nuclear Dynamics (END)^1 theory which incorporates the coupling between electronic and nuclear degrees of freedom without reliance on the computationally cumbersome and frequently intractable determination of potential energy surfaces. In the present application of END theory to ion - transition metal atom scattering, a supermolecule approach is utilized in conjunction with a spin-unrestricted single determinantal wave function describing the electronic system. Integral scattering, charge and spin exchange cross sections are discussed as functions of the elementary parameters of the problem, such as projectile and target atomic numbers as well as projectile charge and initial kinetic energy. ^1 E.Deumens, A.Diz, R.Longo, Y.Oehrn, Rev.Mod.Phys. 66, 917 (1994)

  4. "Feathered" fractal surfaces to minimize secondary electron emission for a wide range of incident angles (United States)

    Swanson, Charles; Kaganovich, Igor D.


    Complex structures on a material surface can significantly reduce the total secondary electron emission from that surface. The reduction occurs due to the capture of low-energy, true secondary electrons emitted at one point of the structure and intersecting another. We performed Monte Carlo calculations to demonstrate that fractal surfaces can reduce net secondary electron emission produced by the surface as compared to the flat surface. Specifically, we describe one surface, a "feathered" surface, which reduces the secondary electron emission yield more effectively than other previously considered configurations. Specifically, feathers grown onto a surface suppress secondary electron emission from shallow angles of incidence more effectively than velvet. We find that, for the surface simulated, secondary electron emission yield remains below 20% of its un-suppressed value, even for shallow incident angles, where the velvet-only surface gives reduction factor of only 50%.

  5. Dynamical phase diagram of quantum spin chains with long-range interactions (United States)

    Halimeh, Jad C.; Zauner-Stauber, Valentin


    Using an infinite matrix product state (iMPS) technique based on the time-dependent variational principle (TDVP), we study two major types of dynamical phase transitions (DPT) in the one-dimensional transverse-field Ising model (TFIM) with long-range power-law (∝1 /rα with r interspin distance) interactions out of equilibrium in the thermodynamic limit—DPT-I: based on an order parameter in a (quasi-)steady state, and DPT-II: based on nonanalyticities (cusps) in the Loschmidt-echo return rate. We construct the corresponding rich dynamical phase diagram, while considering different quench initial conditions. We find a nontrivial connection between both types of DPT based on their critical lines. Moreover, and very interestingly, we detect a new DPT-II dynamical phase in a certain range of interaction exponent α , characterized by what we call anomalous cusps that are distinct from the regular cusps usually associated with DPT-II. Our results provide the characterization of experimentally accessible signatures of the dynamical phases studied in this work.

  6. Investigations of Memory, Entanglement, and Long-Range Interactions Using Ultra-Cold Atoms (United States)

    Dudin, Yaroslav


    Long-term storage of quantum information has diverse applications in quantum information science. I have employed ultra-cold rubidium atoms confined in one-dimensional optical lattices to demonstrate entanglement between a light field and a long-lived spin wave, to develop light-shift compensated quantum memories, to create entanglement between a telecom-band light field and a light-shift compensated memory qubit of a 0.1 s lifetime, and to store coherent light pulses with 1/e lifetime of 16 s in a magnetically-compensated lattice augmented by dynamic decoupling. Highly excited Rydberg atoms offer a unique platform for study of strongly correlated systems and quantum information, because of their enormous dipole moments and consequent strong, long-range interactions. I will present experimental studies of single collective Rydberg excitations created in a cold atomic gas including first realization of a Rydberg-atom-based single photon source, measurement of entanglement between a Rydberg spin wave and light, investigations of long-range correlations of strongly interacting Rydberg spin waves, and initial observations of coherent many-body Rabi oscillations between the ground level and a Rydberg level using several hundred cold rubidium atoms.

  7. Observation of long-range tertiary interactions during ligand binding by the TPP riboswitch aptamer. (United States)

    Duesterberg, Van K; Fischer-Hwang, Irena T; Perez, Christian F; Hogan, Daniel W; Block, Steven M


    The thiamine pyrophosphate (TPP) riboswitch is a cis-regulatory element in mRNA that modifies gene expression in response to TPP concentration. Its specificity is dependent upon conformational changes that take place within its aptamer domain. Here, the role of tertiary interactions in ligand binding was studied at the single-molecule level by combined force spectroscopy and Förster resonance energy transfer (smFRET), using an optical trap equipped for simultaneous smFRET. The 'Force-FRET' approach directly probes secondary and tertiary structural changes during folding, including events associated with binding. Concurrent transitions observed in smFRET signals and RNA extension revealed differences in helix-arm orientation between two previously-identified ligand-binding states that had been undetectable by spectroscopy alone. Our results show that the weaker binding state is able to bind to TPP, but is unable to form a tertiary docking interaction that completes the binding process. Long-range tertiary interactions stabilize global riboswitch structure and confer increased ligand specificity.

  8. Range-Separated meta-GGA Functional Designed for Noncovalent Interactions. (United States)

    Modrzejewski, Marcin; Chałasiński, Grzegorz; Szczęśniak, Małgorzata M


    The accuracy of applying density functional theory to noncovalent interactions is hindered by errors arising from low-density regions of interaction-induced change in the density gradient, error compensation between correlation and exchange functionals, and dispersion double counting. A new exchange-correlation functional designed for noncovalent interactions is proposed to address these problems. The functional consists of the range-separated PBEsol exchange considered in two variants, pure and hybrid, and the semilocal correlation functional of Modrzejewski et al. (J. Chem. Phys. 2012, 137, 204121) designed with the constraint satisfaction technique to smoothly connect with a dispersion term. Two variants of dispersion correction are appended to the correlation functional: the atom-atom pairwise additive DFT-D3 model and the density-dependent many-body dispersion with self-consistent screening (MBD-rsSCS). From these building blocks, a set of four functionals is created to systematically examine the role of pure versus hybrid exchange and the underlying models for dispersion. The new functional is extensively tested on benchmark sets with diverse nature and size. Truly outstanding performance is demonstrated for water clusters of varying size, ionic hydrogen bonds, and thermochemistry of isodesmic n-alkane fragmentation reactions. The merits of each component of the new functional are discussed.

  9. Spectroscopic Studies of the Electron Donor-Acceptor Interaction of ...

    African Journals Online (AJOL)


    base-acid reaction between two or more different chemical constituents, preferably aromatic nucleus–based compounds with electron–rich centers and electron-deficient compounds. The formation of electron-donor- acceptor (EDA) complexes can be rapidly assessed for its validity as a simple quantitative analytical method ...

  10. Simulating the Agostic Interaction in Electron-deficient (16-e) Group ...

    African Journals Online (AJOL)

    A large number of theoretical studies have focused on understanding the molecular features of the agostic interaction in various kinds of molecular environments. However, there is a lack of electronic structure information about the agostic interaction in electron-deficient group (VI)ML6 organometallic complexes. In this ...

  11. Investigation of electron heating in laser-plasma interaction

    Directory of Open Access Journals (Sweden)

    A Parvazian


    Full Text Available  In this paper, stimulated Raman scattering (SRS and electron heating in laser plasma propagating along the plasma fusion is investigated by particle-in cell simulation. Applying an external magnetic field to plasma, production of whistler waves and electron heating associated with whistler waves in the direction perpendicular to external magnetic field was observed in this simulation. The plasma waves with low phase velocities, generated in backward-SRS and dominateing initially in time and space, accelerated the backward electrons by trapping them. Then these electrons promoted to higher energies by the forward-SRS plasma waves with high phase velocities. This tow-stage electron acceleration is more efficient due to the coexistence of these two instabilities.

  12. Improved superconducting hot-electron bolometer devices for the THz range

    NARCIS (Netherlands)

    Klapwijk, T.M.; Barends, R.; Gao, J.R.; Hajenius, M.; Baselmans, J.J.A.


    Improved and reproducible heterodyne mixing (noise temperatures of 950 K at 2.5 THz) has been realized with NbN based hot-electron superconducting devices with low contact resistances. A distributed temperature numerical model of the NbN bridge, based on a local electron and a phonon temperature,

  13. Enzymatic cellulose oxidation is linked to lignin by long-range electron transfer

    DEFF Research Database (Denmark)

    Westereng, Bjorge; Cannella, David; Wittrup Agger, Jane


    Enzymatic oxidation of cell wall polysaccharides by lytic polysaccharide monooxygenases (LPMOs) plays a pivotal role in the degradation of plant biomass. While experiments have shown that LPMOs are copper dependent enzymes requiring an electron donor, the mechanism and origin of the electron supp...

  14. Magnetic interactions and electronic structure of Ni–Mn–In

    Energy Technology Data Exchange (ETDEWEB)

    D' Souza, Sunil Wilfred [UGC-DAE Consortium for Scientific Research, Khandwa Road, Indore 452001, Madhya Pradesh (India); Chakrabarti, Aparna [Raja Ramanna Centre for Advanced Technology, Indore 452013, Madhya Pradesh (India); Barman, Sudipta Roy, E-mail: [UGC-DAE Consortium for Scientific Research, Khandwa Road, Indore 452001, Madhya Pradesh (India)


    Highlights: • The ground state of Ni{sub 2}Mn{sub 1.4}In{sub 0.6} is ferromagnetic. • The magnetic moments of Ni–Mn–In are in good agreement with the magnetization measurements. • Exchange coupling parameters exhibit a strong competition between ferromagnetic and antiferromagnetic configurations. • Jahn–Teller splitting of the Ni 3d e{sub g} states drives the martensite transformation. - Abstract: The electronic structure and magnetic properties of a magnetic shape memory alloy Ni–Mn–In have been studied using spin polarized fully relativistic Korringa–Kohn–Rostoker (SPRKKR) method. The total energy calculations with different starting magnetic spin configurations show that the ground state of Ni{sub 2}Mn{sub 1.4}In{sub 0.6} is ferromagnetic. The spin and orbital magnetic moments of Ni{sub 2}Mn{sub 1.4}In{sub 0.6} and Ni{sub 2}MnIn are in good agreement with the magnetization measurements. The exchange coupling parameters of the different sublattice interactions exhibit a strong competition between ferromagnetic and antiferromagnetic configurations, due to the substitution of excess Mn atoms at the In site in Ni{sub 2}Mn{sub 1.4}In{sub 0.6}. The Curie temperature of Ni{sub 2}MnIn, calculated under a mean field approximation, is found to be in relatively good agreement with the experimental values. While Ni{sub 2}MnIn does not undergo martensite transition, it is shown that a Jahn–Teller splitting of the Ni 3d e{sub g} states plays an important role in driving the martensite transformation in Ni{sub 2}Mn{sub 1.4}In{sub 0.6}. We find that both the calculated ultra-violet photoemission spectra and the inverse photoemission spectra are in good agreement with the existing experimental data.

  15. Dynamic simulation of concentrated macromolecular solutions with screened long-range hydrodynamic interactions: algorithm and limitations. (United States)

    Ando, Tadashi; Chow, Edmond; Skolnick, Jeffrey


    Hydrodynamic interactions exert a critical effect on the dynamics of macromolecules. As the concentration of macromolecules increases, by analogy to the behavior of semidilute polymer solutions or the flow in porous media, one might expect hydrodynamic screening to occur. Hydrodynamic screening would have implications both for the understanding of macromolecular dynamics as well as practical implications for the simulation of concentrated macromolecular solutions, e.g., in cells. Stokesian dynamics (SD) is one of the most accurate methods for simulating the motions of N particles suspended in a viscous fluid at low Reynolds number, in that it considers both far-field and near-field hydrodynamic interactions. This algorithm traditionally involves an O(N(3)) operation to compute Brownian forces at each time step, although asymptotically faster but more complex SD methods are now available. Motivated by the idea of hydrodynamic screening, the far-field part of the hydrodynamic matrix in SD may be approximated by a diagonal matrix, which is equivalent to assuming that long range hydrodynamic interactions are completely screened. This approximation allows sparse matrix methods to be used, which can reduce the apparent computational scaling to O(N). Previously there were several simulation studies using this approximation for monodisperse suspensions. Here, we employ newly designed preconditioned iterative methods for both the computation of Brownian forces and the solution of linear systems, and consider the validity of this approximation in polydisperse suspensions. We evaluate the accuracy of the diagonal approximation method using an intracellular-like suspension. The diffusivities of particles obtained with this approximation are close to those with the original method. However, this approximation underestimates intermolecular correlated motions, which is a trade-off between accuracy and computing efficiency. The new method makes it possible to perform large

  16. Playing with Technology: Mother-Toddler Interaction Scores Lower during Play with Electronic Toys (United States)

    Wooldridge, Michaela B.; Shapka, Jennifer


    To investigate play with electronic toys (battery-operated or digital), 25 mother-toddler (16-24 months old) dyads were videotaped in their homes playing with sets of age-appropriate electronic and non-electronic toys for approximately 10 min each. Parent-child interactions were coded from recorded segments of both of the play conditions using the…

  17. An improved lattice Boltzmann scheme for multiphase fluid with multi-range interactions

    Energy Technology Data Exchange (ETDEWEB)

    Maquignon, Nicolas; Duchateau, Julien; Roussel, Gilles; Rousselle, François; Renaud, Christophe [Laboratoire Informatique Signal et Image de la Côte d' Opale, 50 rue Ferdinand Buisson, 62100 Calais (France); Université du Littoral Côte d' Opale, 1 place de l' Yser, 59140, Dunkerque (France); Association INNOCOLD, MREI 1, 145 (France)


    Modeling of fluids with liquid to gas phase transition has become important for understanding many environmental or industrial processes. Such simulations need new techniques, because traditional solvers are often limited. The Lattice Boltzmann Model (LBM) allows simulate complex fluids, because its mesoscopic nature gives possibility to incorporate additional physics in comparison to usual methods. In this work, an improved lattice Boltzmann model for phase transition flow will be introduced. First, the state of art for Shan and Chen (SC) type of LBM will be reminded. Then, link to real thermodynamics will be established with Maxwell equal areas construction. Convergence to isothermal liquid vapor equilibrium will be shown and discussed. Inclusion of an equation of state for real fluid and better incorporation of force term is presented. Multi-range interactions have been used for SC model, but it hasn't been yet applied to real fluid with non-ideal equation of state. In this work, we evaluate this model when it is applied to real liquid-vapor equilibrium. We show that important differences are found for evaluation of gas density. In order to recover thermodynamic consistency, we use a new scheme for calculation of force term, which is a combination of multi range model and numerical weighting used by Gong and Cheng. We show the superiority of our new model by studying convergence to equilibrium values over a large temperature range. We prove that spurious velocities remaining at equilibrium are decreased.

  18. Features of electron-phonon interactions in nanotubes with chiral symmetry in magnetic field

    CERN Document Server

    Kibis, O V


    Interaction of the electrons with acoustic phonons in the nanotube with chiral symmetry by availability of the magnetic field, parallel to the nanotube axis, is considered. It is shown that the electron energy spectrum is asymmetric relative to the electron wave vector inversion and for that reason the electron-phonon interaction appears to be different for similar phonons with mutually contrary directions of the wave vector. This phenomenon leads to origination of the electromotive force by the spatially uniform electron gas heating and to appearance of the quadrupole component in the nanotube volt-ampere characteristics

  19. Sub-Seasonal Predictability And Dynamical Processes: Long-Range Interactions (United States)

    Brunet, G.


    World leading global forecasting systems in 2016 operate with around 20-100 ensemble members and a horizontal resolution in the range 13 to 50km with of order 100 vertical levels. We can currently predict large-scale weather patterns and regime transitions out to a month or more ahead and high-impact events, such as tropical cyclones, out to two weeks ahead. Under certain conditions, even sub-seasonal to seasonal forecasts have some predictive skill. Especially the intra-seasonal variability has a lot more degrees of freedom than seasonal variability and the associated dynamical and physical processes are numerous and complex. As an example research in the last three decades on tropical modes of ocean-atmosphere interaction, like the El Nino/Southern Oscillation (ENSO) oceanic phenomenon and its complex interaction between the large scale tropical atmosphere and organised moist convection, has permitted significant advances in seasonal prediction. Similarly research in the intra-seasonal variability has point out another ocean-atmosphere interaction mode, the Madden-Julian Oscillation (MJO), as an important source of predictability. MJO modulates significantly the mid-latitude intra-seasonal variability through tropical and mid-latitude teleconnections, like the Canadian winter temperature and precipitation. Another example is the two-way link between the MJO and the North Atlantic Oscillation (NAO) modulates significantly weather regimes over Western Europe. Pushing forecast leadtime to sub-seasonal scale will unfold a new landscape of predictability, model uncertainties and ensemble prediction issues. The richness of the sources of predictability associated with these processes could provide increase predictive skill in all seasons and regions. The associated socio-economic benefits are indeed promising to inform reliably the risk of high-impact weather, including tropical cyclones, droughts, floods, heat waves and the waxing and waning of monsoon precipitation

  20. Role of ligand substitution on long-range electron transfer in azurins

    DEFF Research Database (Denmark)

    Farver, O; Jeuken, L J; Canters, G W


    Azurin contains two potential redox sites, a copper centre and, at the opposite end of the molecule, a cystine disulfide (RSSR). Intramolecular electron transfer between a pulse radiolytically produced RSSR- radical anion and the blue Cu(II) ion was studied in a series of azurins in which single......-site mutations were introduced into the copper ligand sphere. In the Met121His mutant, the rate constant for intramolecular electron transfer is half that of the corresponding wild-type azurin. In the His46Gly and His117Gly mutants, a water molecule is co-ordinated to the copper ion when no external ligands...... are added. Both these mutants also exhibit slower intramolecular electron transfer than the corresponding wild-type azurin. However, for the His117Gly mutant in the presence of excess imidazole, an azurin-imidazole complex is formed and the intramolecular electron-transfer rate increases considerably...

  1. Electron confinement in thin metal films. Structure, morphology and interactions

    Energy Technology Data Exchange (ETDEWEB)

    Dil, J.H.


    This thesis investigates the interplay between reduced dimensionality, electronic structure, and interface effects in ultrathin metal layers (Pb, In, Al) on a variety of substrates (Si, Cu, graphite). These layers can be grown with such a perfection that electron confinement in the direction normal to the film leads to the occurrence of quantum well states in their valence bands. These quantum well states are studied in detail, and their behaviour with film thickness, on different substrates, and other parameters of growth are used here to characterise a variety of physical properties of such nanoscale systems. The sections of the thesis deal with a determination of quantum well state energies for a large data set on different systems, the interplay between film morphology and electronic structure, and the influence of substrate electronic structure on their band shape; finally, new ground is broken by demonstrating electron localization and correlation effects, and the possibility to measure the influence of electron-phonon coupling in bulk bands. (orig.)

  2. Interaction Models for Common Long-Range Dependence in Asset Prices Volatility (United States)

    Teyssière, G.

    We consider a class of microeconomic models with interacting agents which replicate the main properties of asset prices time series: non-linearities in levels and common degree of long-memory in the volatilities and co-volatilities of multivariate time series. For these models, long-range dependence in asset price volatility is the consequence of swings in opinions and herding behavior of market participants, which generate switches in the heteroskedastic structure of asset prices. Thus, the observed long-memory in asset prices volatility might be the outcome of a change-point in the conditional variance process, a conclusion supported by a wavelet anaysis of the volatility series. This explains why volatility processes share only the properties of the second moments of long-memory processes, but not the properties of the first moments.

  3. Long-range interactions of excited He atoms with ground-state noble-gas atoms

    KAUST Repository

    Zhang, J.-Y.


    The dispersion coefficients C6, C8, and C10 for long-range interactions of He(n1,3S) and He(n1,3P), 2≤n≤10, with the ground-state noble-gas atoms Ne, Ar, Kr, and Xe are calculated by summing over the reduced matrix elements of multipole transition operators. The large-n expansions for the sums over the He oscillator strength divided by the corresponding transition energy are presented for these series. Using the expansions, the C6 coefficients for the systems involving He(131,3S) and He(131,3P) are calculated and found to be in good agreement with directly calculated values.

  4. Interactive Theory of Breastfeeding: creation and application of a middle-range theory. (United States)

    Primo, Cândida Caniçali; Brandão, Marcos Antônio Gomes


    To describe a breastfeeding theory based on King's Conceptual System. Theoretical study that used analysis of concept, assertion synthesis, and derivation of theory for the creation of a new theory. King's system components were associated with elements of the breastfeeding process and a middle-range theory was created, which describes, explains, predicts, and prescribes breastfeeding by analyzing factors that precede and affect it, as well as their consequences on the breastfeeding process. The Breastfeeding Interactive Model is abstract enough to be applied in different social, cultural, political, and economic contexts, because it conceptualizes breastfeeding in systemic, dynamic, and procedural aspects. Based on a conceptual model of nursing, it contributes to the scientific construction of the subject; however it can also potentially be applied by other professionals involved in breastfeeding assistance.

  5. CGC/saturation approach for soft interactions at high energy: long range rapidity correlations

    Energy Technology Data Exchange (ETDEWEB)

    Gotsman, E.; Maor, U. [Tel Aviv University, Department of Particle Physics, School of Physics and Astronomy, Raymond and Beverly Sackler Faculty of Exact Science, Tel Aviv (Israel); Levin, E. [Tel Aviv University, Department of Particle Physics, School of Physics and Astronomy, Raymond and Beverly Sackler Faculty of Exact Science, Tel Aviv (Israel); Universidad Tecnica Federico Santa Maria and Centro Cientifico- Tecnologico de Valparaiso, Departemento de Fisica, Valparaiso (Chile)


    In this paper we continue our program to construct a model for high energy soft interactions that is based on the CGC/saturation approach. The main result of this paper is that we have discovered a mechanism that leads to large long range rapidity correlations and results in large values of the correlation function R(y{sub 1}, y{sub 2}) ≥ 1, which is independent of y{sub 1} and y{sub 2}. Such a behavior of the correlation function provides strong support for the idea that at high energies the system of partons that is produced is not only dense but also has strong attractive forces acting between the partons. (orig.)

  6. Long-range pseudoknot interactions dictate the regulatory response in the tetrahydrofolate riboswitch

    Energy Technology Data Exchange (ETDEWEB)

    Huang, Lili; Ishibe-Murakami, Satoko; Patel, Dinshaw J.; Serganov, Alexander (MSKCC)


    Tetrahydrofolate (THF), a biologically active form of the vitamin folate (B{sub 9}), is an essential cofactor in one-carbon transfer reactions. In bacteria, expression of folate-related genes is controlled by feedback modulation in response to specific binding of THF and related compounds to a riboswitch. Here, we present the X-ray structures of the THF-sensing domain from the Eubacterium siraeum riboswitch in the ligand-bound and unbound states. The structure reveals an 'inverted' three-way junctional architecture, most unusual for riboswitches, with the junction located far from the regulatory helix P1 and not directly participating in helix P1 formation. Instead, the three-way junction, stabilized by binding to the ligand, aligns the riboswitch stems for long-range tertiary pseudoknot interactions that contribute to the organization of helix P1 and therefore stipulate the regulatory response of the riboswitch. The pterin moiety of the ligand docks in a semiopen pocket adjacent to the junction, where it forms specific hydrogen bonds with two moderately conserved pyrimidines. The aminobenzoate moiety stacks on a guanine base, whereas the glutamate moiety does not appear to make strong interactions with the RNA. In contrast to other riboswitches, these findings demonstrate that the THF riboswitch uses a limited number of available determinants for ligand recognition. Given that modern antibiotics target folate metabolism, the THF riboswitch structure provides insights on mechanistic aspects of riboswitch function and may help in manipulating THF levels in pathogenic bacteria

  7. Dynamics and thermodynamics of systems with long-range dipole-type interactions. (United States)

    Atenas, Boris; Curilef, Sergio


    A Hamiltonian mean field model, where the potential is inspired by dipole-dipole interactions, is proposed to characterize the behavior of systems with long-range interactions. The dynamics of the system remains in quasistationary states before arriving at equilibrium. The equilibrium is analytically derived from the canonical ensemble and coincides with that obtained from molecular dynamics simulations (microcanonical ensemble) at only long time scales. The dynamics of the system is characterized by the behavior of the mean value of the kinetic energy. The significance of the results, compared to others in the recent literature, is that two plateaus sequentially emerge in the evolution of the model under the special considerations of the initial conditions and systems of finite size. The first plateau decays to a different second one before the system reaches equilibrium, but the dynamics of the system is expected to have only one plateau when the thermodynamics limit is reached because the difference between them tends to disappear as N tends to infinity. Hence, the first plateau is a type of quasistationary state the lifetime of which depends on a power law of N and the second seems to be a true quasistationary state as reported in the literature. We characterize the general behavior of the model according to its dynamics and thermodynamics.

  8. Earthquake simulations with time-dependent nucleation and long-range interactions

    Directory of Open Access Journals (Sweden)

    J. H. Dieterich


    Full Text Available A model for rapid simulation of earthquake sequences is introduced which incorporates long-range elastic interactions among fault elements and time-dependent earthquake nucleation inferred from experimentally derived rate- and state-dependent fault constitutive properties. The model consists of a planar two-dimensional fault surface which is periodic in both the x- and y-directions. Elastic interactions among fault elements are represented by an array of elastic dislocations. Approximate solutions for earthquake nucleation and dynamics of earthquake slip are introduced which permit computations to proceed in steps that are determined by the transitions from one sliding state to the next. The transition-driven time stepping and avoidance of systems of simultaneous equations permit rapid simulation of large sequences of earthquake events on computers of modest capacity, while preserving characteristics of the nucleation and rupture propagation processes evident in more detailed models. Earthquakes simulated with this model reproduce many of the observed spatial and temporal characteristics of clustering phenomena including foreshock and aftershock sequences. Clustering arises because the time dependence of the nucleation process is highly sensitive to stress perturbations caused by nearby earthquakes. Rate of earthquake activity following a prior earthquake decays according to Omori's aftershock decay law and falls off with distance.

  9. Research on three-phase traffic flow modeling based on interaction range (United States)

    Zeng, Jun-Wei; Yang, Xu-Gang; Qian, Yong-Sheng; Wei, Xu-Ting


    On the basis of the multiple velocity difference effect (MVDE) model and under short-range interaction, a new three-phase traffic flow model (S-MVDE) is proposed through careful consideration of the influence of the relationship between the speeds of the two adjacent cars on the running state of the rear car. The random slowing rule in the MVDE model is modified in order to emphasize the influence of vehicle interaction between two vehicles on the probability of vehicles’ deceleration. A single-lane model which without bottleneck structure under periodic boundary conditions is simulated, and it is proved that the traffic flow simulated by S-MVDE model will generate the synchronous flow of three-phase traffic theory. Under the open boundary, the model is expanded by adding an on-ramp, the congestion pattern caused by the bottleneck is simulated at different main road flow rates and on-ramp flow rates, which is compared with the traffic congestion pattern observed by Kerner et al. and it is found that the results are consistent with the congestion characteristics in the three-phase traffic flow theory.

  10. Interactive drivers of activity in a free-ranging estuarine predator.

    Directory of Open Access Journals (Sweden)

    Matthew D Taylor

    Full Text Available Animal activity patterns evolve as an optimal balance between energy use, energy acquisition, and predation risk, so understanding how animals partition activity relative to extrinsic environmental fluctuations is central to understanding their ecology, biology and physiology. Here we use accelerometry to examine the degree to which activity patterns of an estuarine teleost predator are driven by a series of rhythmic and arrhythmic environmental fluctuations. We implanted free-ranging bream Acanthopagrus australis with acoustic transmitters that measured bi-axial acceleration and pressure (depth, and simultaneously monitored a series of environmental variables (photosynthetically active radiation, tidal height, temperature, turbidity, and lunar phase for a period of approximately four months. Linear modeling showed an interaction between fish activity, light level and tidal height; with activity rates also negatively correlated with fish depth. These patterns highlight the relatively-complex trade-offs that are required to persist in highly variable environments. This study demonstrates how novel acoustic sensor tags can reveal interactive links between environmental cycles and animal behavior.

  11. Study for online range monitoring with the interaction vertex imaging method (United States)

    Finck, Ch; Karakaya, Y.; Reithinger, V.; Rescigno, R.; Baudot, J.; Constanzo, J.; Juliani, D.; Krimmer, J.; Rinaldi, I.; Rousseau, M.; Testa, E.; Vanstalle, M.; Ray, C.


    Ion beam therapy enables a highly accurate dose conformation delivery to the tumor due to the finite range of charged ions in matter (i.e. Bragg peak (BP)). Consequently, the dose profile is very sensitive to patients anatomical changes as well as minor mispositioning, and so it requires improved dose control techniques. Proton interaction vertex imaging (IVI) could offer an online range control in carbon ion therapy. In this paper, a statistical method was used to study the sensitivity of the IVI technique on experimental data obtained from the Heidelberg Ion-Beam Therapy Center. The vertices of secondary protons were reconstructed with pixelized silicon detectors. The statistical study used the χ2 test of the reconstructed vertex distributions for a given displacement of the BP position as a function of the impinging carbon ions. Different phantom configurations were used with or without bone equivalent tissue and air inserts. The inflection points in the fall-off region of the longitudinal vertex distribution were computed using different methods, while the relation with the BP position was established. In the present setup, the resolution of the BP position was about 4–5 mm in the homogeneous phantom under clinical conditions (106 incident carbon ions). Our results show that the IVI method could therefore monitor the BP position with a promising resolution in clinical conditions.

  12. Fast methods for long-range interactions in complex systems. Lecture notes

    Energy Technology Data Exchange (ETDEWEB)

    Sutmann, Godehard; Gibbon, Paul; Lippert, Thomas (eds.)


    Parallel computing and computer simulations of complex particle systems including charges have an ever increasing impact in a broad range of fields in the physical sciences, e.g. in astrophysics, statistical physics, plasma physics, material sciences, physical chemistry, and biophysics. The present summer school, funded by the German Heraeus-Foundation, took place at the Juelich Supercomputing Centre from 6 - 10 September 2010. The focus was on providing an introduction and overview over different methods, algorithms and new trends for the computational treatment of long-range interactions in particle systems. The Lecture Notes contain an introduction into particle simulation, as well as five different fast methods, i.e. the Fast Multipole Method, Barnes-Hut Tree Method, Multigrid, FFT based methods, and Fast Summation using the non-equidistant FFT. In addition to introducing the methods, efficient parallelization of the methods is presented in detail. This publication was edited at the Juelich Supercomputing Centre (JSC) which is an integral part of the Institute for Advanced Simulation (IAS). The IAS combines the Juelich simulation sciences and the supercomputer facility in one organizational unit. It includes those parts of the scientific institutes at Forschungszentrum Juelich which use simulation on supercomputers as their main research methodology. (orig.)

  13. Upper and lower critical decay exponents of Ising ferromagnets with long-range interaction. (United States)

    Horita, Toshiki; Suwa, Hidemaro; Todo, Synge


    We investigate the universality class of the finite-temperature phase transition of the two-dimensional Ising model with the algebraically decaying ferromagnetic long-range interaction, J_{ij}=|r[over ⃗]_{i}-r[over ⃗]_{j}|^{-(d+σ)}, where d (=2) is the dimension of the system and σ is the decay exponent, by means of the order-N cluster-algorithm Monte Carlo method. In particular, we focus on the upper and lower critical decay exponents, the boundaries between the mean-field-universality, intermediate, and short-range-universality regimes. At the critical decay exponents, it is found that the standard Binder ratio of magnetization at the critical temperature exhibits extremely slow convergence as a function of the system size. We propose more effective physical quantities, namely the combined Binder ratio and the self-combined Binder ratio, both of which cancel the leading finite-size corrections of the conventional Binder ratio. Utilizing these techniques, we clearly demonstrate that in two dimensions, the lower and upper critical decay exponents are σ=1 and 7/4, respectively, contrary to the recent Monte Carlo and renormalization-group studies [M. Picco, arXiv:1207.1018; T. Blanchard et al., Europhys. Lett. 101, 56003 (2013)EULEEJ0295-507510.1209/0295-5075/101/56003].

  14. Cavity-photon contribution to the effective interaction of electrons in parallel quantum dots

    Energy Technology Data Exchange (ETDEWEB)

    Gudmundsson, Vidar [Science Institute, University of Iceland, Reykjavik (Iceland); Sitek, Anna [Science Institute, University of Iceland, Reykjavik (Iceland); Department of Theoretical Physics, Faculty of Fundamental Problems of Technology, Wroclaw University of Technology (Poland); Abdullah, Nzar Rauf [Science Institute, University of Iceland, Reykjavik (Iceland); Physics Department, Faculty of Science and Science Education, School of Science, University of Sulaimani, Kurdistan Region (Iraq); Tang, Chi-Shung [Department of Mechanical Engineering, National United University, Miaoli (China); Manolescu, Andrei [School of Science and Engineering, Reykjavik University (Iceland)


    A single cavity photon mode is expected to modify the Coulomb interaction of an electron system in the cavity. Here we investigate this phenomena in a parallel double quantum dot system. We explore properties of the closed system and the system after it has been opened up for electron transport. We show how results for both cases support the idea that the effective electron-electron interaction becomes more repulsive in the presence of a cavity photon field. This can be understood in terms of the cavity photons dressing the polarization terms in the effective mutual electron interaction leading to nontrivial delocalization or polarization of the charge in the double parallel dot potential. In addition, we find that the effective repulsion of the electrons can be reduced by quadrupolar collective oscillations excited by an external classical dipole electric field. (copyright 2015 by WILEY-VCH Verlag GmbH and Co. KGaA, Weinheim)

  15. Electron Flow in Multiheme Bacterial Cytochromes is a Balancing Act Between Heme Electronic Interaction and Redox Potentials

    Energy Technology Data Exchange (ETDEWEB)

    Breuer, Marian; Rosso, Kevin M.; Blumberger, Jochen


    The naturally widespread process of electron transfer from metal reducing bacteria to extracellular solid metal oxides entails unique biomolecular machinery optimized for long-range electron transport. To perform this function efficiently microorganisms have adapted multi-heme c-type cytochromes to arrange heme cofactors into wires that cooperatively span the cellular envelope, transmitting electrons along distances greater than 100 Angstroms. Implications and opportunities for bionanotechnological device design are self-evident. However, at the molecular level how these proteins shuttle electrons along their heme wires, navigating intraprotein intersections and interprotein interfaces effciently, remains a mystery so far inaccessible to experiment. To shed light on this critical topic, we carried out extensive computer simulations to calculate Marcus theory quantities for electron transfer along the ten heme cofactors in the recently crystallized outer membrane cytochrome MtrF. The combination of electronic coupling matrix elements with free energy calculations of heme redox potentials and reorganization energies for heme-to-heme electron transfer allows the step-wise and overall electron transfer rate to be estimated and understood in terms of structural and dynamical characteristics of the protein. By solving a master equation for electron hopping, we estimate an intrinsic, maximum possible electron flux through solvated MtrF of 104-105 s-1, consistent with recently measured rates for the related MtrCAB protein complex. Intriguingly, this flux must navigate thermodynamically uphill steps past low potential hemes. Our calculations show that the rapid electron transport through MtrF is the result of a clear correlation between heme redox potential and the strength of electronic coupling along the wire: Thermodynamically uphill steps occur only between electronically well connected stacked heme pairs. This suggests that the protein evolved to harbor low potential

  16. Molecular Understanding of Fullerene - Electron Donor Interactions in Organic Solar Cells

    KAUST Repository

    Ryno, Sean


    Organic solar cells hold promise of providing low-cost, renewable power generation, with current devices providing up to 13% power conversion efficiency. The rational design of more performant systems requires an in-depth understanding of the interactions between the electron donating and electron accepting materials within the active layers of these devices. Here, we explore works that give insight into the intermolecular interactions between electron donors and electron acceptors, and the impact of molecular orientations and environment on these interactions. We highlight, from a theoretical standpoint, the effects of intermolecular interactions on the stability of charge carriers at the donor/acceptor interface and in the bulk and how these interactions influence the nature of the charge transfer states as wells as the charge separation and charge transport processes. © 2016 WILEY-VCH Verlag GmbH & Co. KGaA, Weinheim.

  17. Long-range coupling of electron-hole pairs in spatially separated organic donor-acceptor layers (United States)

    Nakanotani, Hajime; Furukawa, Taro; Morimoto, Kei; Adachi, Chihaya


    Understanding exciton behavior in organic semiconductor molecules is crucial for the development of organic semiconductor-based excitonic devices such as organic light-emitting diodes and organic solar cells, and the tightly bound electron-hole pair forming an exciton is normally assumed to be localized on an organic semiconducting molecule. We report the observation of long-range coupling of electron-hole pairs in spatially separated electron-donating and electron-accepting molecules across a 10-nanometers-thick spacer layer. We found that the exciton energy can be tuned over 100 megaelectron volts and the fraction of delayed fluorescence can be increased by adjusting the spacer-layer thickness. Furthermore, increasing the spacer-layer thickness produced an organic light-emitting diode with an electroluminescence efficiency nearly eight times higher than that of a device without a spacer layer. Our results demonstrate the first example of a long-range coupled charge-transfer state between electron-donating and electron-accepting molecules in a working device. PMID:26933691


    Directory of Open Access Journals (Sweden)



    Full Text Available Anharmonic phonon contributions to Raman scattering in locally anharmonic crystal systems in the framework of the pseudospin-electron model with tunneling splitting of levels are investigated. The case of strong pseudospin-electron coupling is considered. Pseudospin and electron contributions to scattering are taken into account. Frequency dependences of Raman scattering intensity for different values of model parameters and for different polarization of scattering and incident light are investigated.

  19. Thermoluminescence response of sodalime glass irradiated with photon and electron beams in the 1-20 Gy range

    Energy Technology Data Exchange (ETDEWEB)

    Bartolotta, A., E-mail: [Dipartimento Farmacochimico, Tossicologico e Biologico, via Archirafi 32, 90123 Palermo (Italy); Brai, M. [Dipartimento di Fisica e Tecnologie Relative, Universita di Palermo, Viale delle Scienze, Ed. 18, 90128 Palermo (Italy); Gruppo V, INFN, Sezione di Catania, Catania (Italy); Caputo, V. [Unita Operativa Complessa Fisica Sanitaria, ARNAS, Palermo (Italy); D' Oca, M.C. [Dipartimento Farmacochimico, Tossicologico e Biologico, via Archirafi 32, 90123 Palermo (Italy); Longo, A.; Marrale, M. [Dipartimento di Fisica e Tecnologie Relative, Universita di Palermo, Viale delle Scienze, Ed. 18, 90128 Palermo (Italy); Gruppo V, INFN, Sezione di Catania, Catania (Italy)


    The thermoluminescence response of a watch commercial glass was studied after irradiation with photons and electrons, in the range 1-20 Gy, of interest in accidental dosimetry; a linear response was obtained with both beams. This result, together with the satisfactory time stability of the thermoluminescence signal, indicates this glass as a potential material for retrospective dosimetry applications.

  20. Electron–electron interactions and the electrical resistivity of lithium ...

    Indian Academy of Sciences (India)

    The contribution of the electron–electron Umklapp scattering processes in the electrical resistivity of lithium at low temperatures has been evaluated using a simplified ... Department of Physics, Regional Institute of Education, National Council of Educational Research & Training, Shyamla Hills, Bhopal 462 013, India ...

  1. Interactive electronic storybooks for kindergartners to promote vocabulary growth

    NARCIS (Netherlands)

    Smeets, Daisy J. H.; Bus, Adriana G


    The goals of this study were to examine (a) whether extratextual vocabulary instructions embedded in electronic storybooks facilitated word learning over reading alone and (b) whether instructional formats that required children to invest more effort were more effective than formats that required

  2. Physician Interaction with Electronic Medical Records: A Qualitative Study (United States)

    Noteboom, Cherie Bakker


    The integration of EHR (Electronic Health Records) in IT infrastructures supporting organizations enable improved access to and recording of patient data, enhanced ability to make better and more-timely decisions, and improved quality and reduced errors. Despite these benefits, there are mixed results as to the use of EHR. The literature suggests…

  3. Interactive Electronic Storybooks for Kindergartners to Promote Vocabulary Growth (United States)

    Smeets, Daisy J. H.; Bus, Adriana G.


    The goals of this study were to examine (a) whether extratextual vocabulary instructions embedded in electronic storybooks facilitated word learning over reading alone and (b) whether instructional formats that required children to invest more effort were more effective than formats that required less effort. A computer-based "assistant" was added…

  4. Mechanisms of Interactions of Energetic Electrons with Epoxy Resins (United States)

    Gupta, A.; Coulter, D. R.; Tsay, F. D.; Moacanin, J.


    The mechanism of deactivation of energy of excitation in a resin system was investigated on optical excitation as well as excitation by high energy electrons. This mechanism involves formation of excited state complexes, known as exciplexes which have a considerable charge transfer character. This mechanism will be used to develop a degradation model for epoxy matrix materials deployed in a space environment.

  5. A measurement of auroral electrons in the 1–10 MeV range

    NARCIS (Netherlands)

    Gils, J.N. van; Beek, H.F. van; Fetter, L.D. de; Hendrickx, R.V.

    Particle fluxes have been measured by means of shielded Geiger-Müller telescopes mounted m a rocket, which was launched from ESRANGE(Kiruna) into a diffuse aurora. The analysis of the dependence of the counting rates on altitude indicates that a weak flux of energetic electrons, 1–10 MeV, has been

  6. Single-molecule Mapping of Long-range Electron Transfer for a Cytochrome b562 Variant

    DEFF Research Database (Denmark)

    Della Pia, Eduardo Antonio; Chi, Qijin; Jones, D. Dafydd


    Cytochrome b562 was engineered to introduce a cysteine residue at a surface-exposed position to facilitate direct self-assembly on a Au(111) surface. The confined protein exhibited reversible and fast electron exchange with a gold substrate over a distance of 20 Å between the heme redox center an...

  7. Unconventional superconductivity in two-dimensional electron systems with long-range correlations

    Energy Technology Data Exchange (ETDEWEB)

    Clark, J.W.; Khodel, V.A.; Zverev, M.V.; Yakovenko, V.M


    We explore salient features of high-T{sub c} superconductivity in two-dimensional electron liquid, that are triggered by critical fluctuations enhanced in the vicinity of an impending second order phase transition. A simple theoretical explanation for the transition from d-wave to another type of superconducting pairing that has recently observed in the electron-doped cuprates is offered. The d{sub x{sup 2}}{sub -y{sup 2}} pairing potential {delta}, which has maximal magnitude at the hot spots on the Fermi surface, becomes suppressed under increase of electron doping, because the hot spots approach the Brillouin zone diagonals where the respective gap value vanishes, and pairing with d{sub x{sup 2}}{sub -y{sup 2}} symmetry is then replaced by either singlet s-wave or triplet p-wave pairing. We argue in favor of p-wave pairing and propose experiments to verify this assertion. The phenomenon of flattening of electron spectra in high-T{sub c} superconductors is discussed. We suggest that this phenomenon can be explained on the basis of the Fermi liquid approach, involving unconventional solutions emerging beyond the point where stability conditions for the traditional Landau state are violated. The problem of pairing in anisotropic electron systems possessing patches of fermion condensate in the vicinity of the van Hove points is analyzed. Attention is directed to opportunities for the occurrence of non-BCS pairing correlations between the states belonging to the fermion condensate. It is shown that the physical emergence of such pairing correlations would drastically alter the behavior of the single-particle Green function, the canonical pole of Fermi-liquid theory being replaced by a branch point.

  8. Increased persistence via asynchrony in oscillating ecological populations with long-range interaction (United States)

    Gupta, Anubhav; Banerjee, Tanmoy; Dutta, Partha Sharathi


    Understanding the influence of the structure of a dispersal network on the species persistence and modeling a realistic species dispersal in nature are two central issues in spatial ecology. A realistic dispersal structure which favors the persistence of interacting ecological systems was studied [M. D. Holland and A. Hastings, Nature (London) 456, 792 (2008), 10.1038/nature07395], where it was shown that a randomization of the structure of a dispersal network in a metapopulation model of prey and predator increases the species persistence via clustering, prolonged transient dynamics, and amplitudes of population fluctuations. In this paper, by contrast, we show that a deterministic network topology in a metapopulation can also favor asynchrony and prolonged transient dynamics if species dispersal obeys a long-range interaction governed by a distance-dependent power law. To explore the effects of power-law coupling, we take a realistic ecological model, namely, the Rosenzweig-MacArthur model in each patch (node) of the network of oscillators, and show that the coupled system is driven from synchrony to asynchrony with an increase in the power-law exponent. Moreover, to understand the relationship between species persistence and variations in power-law exponent, we compute a correlation coefficient to characterize cluster formation, a synchrony order parameter, and median predator amplitude. We further show that smaller metapopulations with fewer patches are more vulnerable to extinction as compared to larger metapopulations with a higher number of patches. We believe that the present work improves our understanding of the interconnection between the random network and the deterministic network in theoretical ecology.

  9. Long-range interactions in mammalian platelet aggregation. I. Evidence from kinetic studies in brownian diffusion. (United States)

    Longmire, K.; Frojmovic, M.


    The Smoluchowski theory describing aggregation in suspensions of spherical colloidal particles due to Brownian diffusion-controlled two-body collisions, was used to obtain collision efficiencies, alpha B, for adenosine diphosphate (ADP)-induced platelet aggregation in citrated platelet-rich plasma (PRP) from humans, dogs, and rabbits. For these diffusion studies, PRP was stirred with 10 microM ADP for 0.5 s, then kept nonstirred at 37 degrees C for varying times before fixation; the percent aggregation was computed from the decrease in particle concentration with time measured with a resistive particle counter. Up to 20% of rabbit platelets formed microaggregates within 60 s of ADP addition to such nonstirred suspensions, corresponding to mean alpha B values of approximately 0.9. However, human and dog platelets aggregated approximately 10 times and 2-3 times faster than rabbit platelets within the first 60 s of ADP addition, corresponding to alpha B approximately 8 and 2, respectively. These high alpha B (much greater than 1) for human platelets were independent of initial platelet count and were equally observed with the calcium ionophore A23187 as activator. In about one-third of human, dog, or rabbit PRP, comparable and lower values of alpha B (less than 0.5) were obtained for a slower second phase of aggregation seen for the nonstirred PRP over 60-300 s post ADP-addition. Platelet aggregability in continually stirred PRP was distinct from that observed in Brownian diffusion (nonstirred) because comparable aggregation was observed for all three species' stirred PRP, whereas greater than 3-8 times more ADP is required to yield 50% of maximal rates of aggregation for nonstirred than for stirred PRP. The above results point to the existence of long-range interactions mediating platelet aggregation in Brownian diffusion-controlled platelet collisions which varies according to human > dog > rabbit platelets. The roles for platelet pseudopods and adhesive sites in

  10. Free-ranging dogs prefer petting over food in repeated interactions with unfamiliar humans. (United States)

    Bhattacharjee, Debottam; Sau, Shubhra; Das, Jayjit; Bhadra, Anindita


    Dogs ( Canis lupus familiaris ) are the first species to have been domesticated and, unlike other domesticated species, they have developed a special bond with their owners. The ability to respond to human gestures and language, and the hypersocial behaviours of dogs are considered key factors that have led them to become man's best friend. Free-ranging dogs provide an excellent model system for understanding the dog-human relationship in various social contexts. In India, free-ranging dogs occur in all possible human habitations. They scavenge among garbage, beg for food from humans, give birth in dens close to human habitations, and establish social bonds with people. However, there is ample dog-human conflict on the streets, leading to morbidity and mortality of dogs. Hence, the ability to assess an unfamiliar human before establishing physical contact could be adaptive for dogs, especially in the urban environment. We tested a total of 103 adult dogs to investigate their response to immediate social and long-term food and social rewards. The dogs were provided a choice of obtaining food either from an experimenter's hand or the ground. The dogs avoided making physical contact with the unfamiliar human. While immediate social reward was not effective in changing this response, the long-term test showed a strong effect of social contact. Our results revealed that these dogs tend to build trust based on affection, not food. This study provides significant insights into the dynamics of dog-human interactions on the streets and subsequent changes in behaviour of dogs through the process of learning. © 2017. Published by The Company of Biologists Ltd.

  11. Interlayer interaction and electronic screening in multilayer graphene


    Ohta, Taisuke; Bostwick, Aaron; McChesney, J. L.; Seyller, Thomas; Horn, Karsten; Rotenberg, Eli


    The unusual transport properties of graphene are the direct consequence of a peculiar bandstructure near the Dirac point. We determine the shape of the pi bands and their characteristic splitting, and the transition from a pure 2D to quasi-2D behavior for 1 to 4 layers of graphene by angle-resolved photoemission. By exploiting the sensitivity of the pi bands to the electronic potential, we derive the layer-dependent carrier concentration, screening length and strength of interlayer interactio...

  12. Modified Monte Carlo method for study of electron transport in degenerate electron gas in the presence of electron–electron interactions, application to graphene

    Energy Technology Data Exchange (ETDEWEB)

    Borowik, Piotr, E-mail: [Warsaw University of Technology, Faculty of Physics, ul. Koszykowa 75, 00-662 Warszawa (Poland); Thobel, Jean-Luc, E-mail: [Institut d' Electronique, de Microélectronique et de Nanotechnologies, UMR CNRS 8520, Université Lille 1, Avenue Poincaré, CS 60069, 59652 Villeneuve d' Ascq Cédex (France); Adamowicz, Leszek, E-mail: [Warsaw University of Technology, Faculty of Physics, ul. Koszykowa 75, 00-662 Warszawa (Poland)


    Standard computational methods used to take account of the Pauli Exclusion Principle into Monte Carlo (MC) simulations of electron transport in semiconductors may give unphysical results in low field regime, where obtained electron distribution function takes values exceeding unity. Modified algorithms were already proposed and allow to correctly account for electron scattering on phonons or impurities. Present paper extends this approach and proposes improved simulation scheme allowing including Pauli exclusion principle for electron–electron (e–e) scattering into MC simulations. Simulations with significantly reduced computational cost recreate correct values of the electron distribution function. Proposed algorithm is applied to study transport properties of degenerate electrons in graphene with e–e interactions. This required adapting the treatment of e–e scattering in the case of linear band dispersion relation. Hence, this part of the simulation algorithm is described in details.

  13. Radiation emission from braided electrons in interacting wakefields (United States)

    Wallin, Erik; Gonoskov, Arkady; Marklund, Mattias


    The radiation emission from electrons wiggling in a laser wakefield acceleration (LWFA) process, being initially considered as a parasitic effect for the electron energy gain, can eventually serve as a novel X-ray source, which could be used for diagnostic purposes. Although several schemes for enhancing the X-ray emission in LWFA has been recently proposed and analyzed, finding an efficient way to use and control this radiation emission remains an important problem. Based on analytical estimates and 3D particle-in-cell simulations, we here propose and examine a new method utilizing two colliding LWFA patterns with an angle in between their propagation directions. Varying the angle of collision, the distance of acceleration before the collision and other parameters provide an unprecedented control over the emission parameters. Moreover, we reveal here that for a collision angle of 5°, the two wakefields merge into a single LWFA cavity, inducing strong and stable collective oscillations between the two trapped electron bunches. This results in an X-ray emission which is strongly peaked, both in the spatial and frequency domains. The basic concept of the proposed scheme may pave a way for using LWFA radiation sources in many important applications, such as phase-contrast radiography.

  14. Heat Transport in Interacting Magnetized Electron Temperature Filaments (United States)

    Sydora, Richard; Karbashewski, Scott; van Compernolle, Bart; Poulos, Matt; Morales, George


    Results are presented from basic heat transport experiments and numerical simulations of multiple magnetized electron temperature filaments in close proximity. This arrangement samples cross-field transport from nonlinear drift-Alfven waves and large scale convective cells. Experiments are performed in the Large Plasma Device (LAPD) at UCLA. The setup consists of three biased CeB6 crystal cathodes that inject low energy electrons (below ionization energy) along a strong magnetic field into a pre-existing large and cold plasma forming 3 electron temperature filaments embedded in a colder plasma, and far from the machine walls. A triangular spatial pattern is chosen for the thermal sources and multiple axial and transverse probe measurements allow for determination of the cross-field mode patterns and axial filament length. We have characterized the spontaneous thermal waves and drift-Alfven waves that develop on an individual filament when a single source is activated. When the 3 sources are activated, and in close proximity, a complex wave pattern emerges due to interference of the various wave modes leading to enhanced cross-field transport and chaotic mixing. Steep thermal gradients develop in a periphery region of the filaments where higher azimuthal wavenumber drift-Alfven modes are excited. Detailed spectral analysis and comparison with nonlinear fluid and gyrokinetic simulations will be reported. Work Supported by NSERC, Canada and NSF-DOE, USA.

  15. Wide Temperature Range DC-DC Boost Converters for Command/Control/Drive Electronics Project (United States)

    National Aeronautics and Space Administration — We shall develop wide temperature range DC-DC boost converters that can be fabricated using commercial CMOS foundries. The boost converters will increase the low...

  16. Parametric decay instability of an obliquely propagating ordinary wave in the electron cyclotron frequency range (United States)

    Gusakov, E. Z.; Popov, A. Yu.


    The possibility of the low-power-threshold parametric decay of an obliquely propagating ordinary wave to an upper hybrid wave and a low-hybrid wave is analysed under conditions of nonmonotonic plasma density profile in a magnetic trap. The instability threshold and growth rate are derived explicitly. The analytical results are illustrated under the conditions typical of the ordinary mode fundamental electron cyclotron resonance heating harmonic experiments at the FTU tokamak.

  17. Orthogonal interactions between nitryl derivatives and electron donors: pnictogen bonds

    Czech Academy of Sciences Publication Activity Database

    Sanchez-Sanz, Goar; Trujillo, Cristina; Solimannejad, M.; Alkorta, I.; Elguero, J.


    Roč. 15, č. 34 (2013), s. 14310-14318 ISSN 1463-9076 Institutional support: RVO:61388963 Keywords : center-dot-N * perturbation-theory approach * pnicogen bonds * noncovalent interactions * hydrogen-bonds Subject RIV: CF - Physical ; Theoretical Chemistry Impact factor: 4.198, year: 2013

  18. Study of wave-particle interaction between fast Magnetosonic and energetic electrons based on numerical simulation (United States)

    Fu, S.


    There are many energetic electrons in the radiation belt of Earth. When the geomagnetic activity becomes stronger, the energy flux of energetic electrons will increase to more than ten times in the outer radiation belt, therefore it is very important to study how the energetic electrons generate and the lifetime of energetic electrons for space weather research. The acceleration of electrons in radiation belt is mainly depending on wave-particle interaction: the whistler mode chorus is the main driver for local acceleration mechanism, which could accelerate and loss energetic electrons; the geomagnetic pulsation ULF wave will cause energetic electron inward radial diffusion which will charge the electrons; recently observation results show us that the fast magnetosonic waves may also accelerate energetic electrons. For the reason that we try to study the wave-particle interaction between fast Magnetosonic and energetic electrons based on numerical simulation, in which the most important past is at the storm time the combination of highly warped Earth magnetic field and fast magnetosonic wave field will be applied for the electromagnetic environment of moving test particles. The energy, pitch angle and cross diffusion coefficients will be calculated respectively in this simulation to study how the electrons receive energy from fast magnetosonic wave. The diffusion coefficients within different dipole Earth magnetic field and non-dipole storm magnetic field are compared, while dynamics of electrons at selected initial energys are shown in our study.

  19. Gelation of anisotropic silica colloids with thermoreversible short-range interactions (United States)

    Murphy, Ryan; Wagner, Norman

    Colloidal suspensions containing anisotropic particles are widely used in particle-based technologies including pharmaceuticals, consumer products, and coatings. The rheological properties of colloidal suspensions are known to be affected by particle shape; however, the combined influence of particle shape and attraction strength is not quantitatively understood for dynamic arrest transitions such as gelation. A model system of anisotropic silica colloids with thermoreversible, short-range attractions was developed to quantify the effect of particle shape and attractions on the gelation behavior. This tunable model system aims to map a fundamental state diagram for anisotropic particle suspensions as a function of particle shape, volume fraction, and interaction strength. Macroscopic rheological properties of thermoreversible gels were explored to determine the influence of particle shape on the gel transition. Neutron and x-ray scattering methods further probed the underlying fluid and gel microstructure at various temperatures, volume fractions, and aspect ratios. Linking these fundamental macroscopic and microscopic measurements will provide practical insight into particle technologies and manufacturing processes containing anisotropic colloidal suspensions.

  20. Window for Efimov physics for few-body systems with finite-range interactions (United States)

    E Rasmussen, S.; Jensen, A. S.; Fedorov, D. V.


    We investigate the two lowest-lying weakly bound states of N≤slant 8 bosons as functions of the strength of two-body Gaussian interactions. We observe the limit for validity of Efimov physics. We calculate energies and second radial moments as functions of scattering length. For identical bosons we find that two (N-1)-body states appear before the N-body ground states become bound. This pattern ceases to exist for N≥slant 7 where the size of the ground state becomes smaller than the range of the two-body potential. All mean-square-radii for N≥slant 4 remain finite at the threshold of zero binding, where they vary as {(N-1)}p with p=-3/2,-3 for ground and excited states, respectively. Decreasing the mass of one particle we find stronger binding and smaller radii. The identical particles form a symmetric system, while the lighter particle is further away in the ground states. In the excited states we find the identical bosons either surrounded or surrounding the light particle for few or many bosons, respectively. We demonstrate that the first excited states for all strengths resemble two-body halos of one particle weakly bound to a dense N-body system for N = 3, 4. This structure ceases to exist for N≥slant 5.

  1. Local interactions and global properties of wild, free-ranging stickleback shoals. (United States)

    Ward, Ashley J W; Schaerf, Timothy M; Herbert-Read, James E; Morrell, Lesley; Sumpter, David J T; Webster, Mike M


    Collective motion describes the global properties of moving groups of animals and the self-organized, coordinated patterns of individual behaviour that produce them. We examined the group-level patterns and local interactions between individuals in wild, free-ranging shoals of three-spine sticklebacks, Gasterosteus aculeatus. Our data reveal that the highest frequencies of near-neighbour encounters occur at between one and two body lengths from a focal fish, with the peak frequency alongside a focal individual. Fish also show the highest alignment with these laterally placed individuals, and generally with animals in front of themselves. Furthermore, fish are more closely matched in size, speed and orientation to their near neighbours than to more distant neighbours, indicating local organization within groups. Among the group-level properties reported here, we find that polarization is strongly influenced by group speed, but also the variation in speed among individuals and the nearest neighbour distances of group members. While we find no relationship between group order and group size, we do find that larger groups tend to have lower nearest neighbour distances, which in turn may be important in maintaining group order.

  2. The spectrum of the torus profile to a geometric variational problem with long range interaction (United States)

    Ren, Xiaofeng; Wei, Juncheng


    The profile problem for the Ohta-Kawasaki diblock copolymer theory is a geometric variational problem. The energy functional is defined on sets in R3 of prescribed volume and the energy of an admissible set is its perimeter plus a long range interaction term related to the Newtonian potential of the set. This problem admits a solution, called a torus profile, that is a set enclosed by an approximate torus of the major radius 1 and the minor radius q. The torus profile is both axially symmetric about the z axis and reflexively symmetric about the xy-plane. There is a way to set up the profile problem in a function space as a partial differential-integro equation. The linearized operator L of the problem at the torus profile is decomposed into a family of linear ordinary differential-integro operators Lm where the index m = 0 , 1 , 2 , … is called a mode. The spectrum of L is the union of the spectra of the Lm's. It is proved that for each m, when q is sufficiently small, Lm is positive definite. (0 is an eigenvalue for both L0 and L1, due to the translation and rotation invariance.) As q tends to 0, more and more Lm's become positive definite. However no matter how small q is, there is always a mode m of which Lm has a negative eigenvalue. This mode grows to infinity like q - 3 / 4 as q → 0.

  3. Short-range order structure and effective pair-interaction energy in Ni-Si alloys

    Energy Technology Data Exchange (ETDEWEB)

    Hasegawa, Takumi [Department of Applied Physics, Graduate School of Engineering, Hokkaido University, Kita-ku, Sapporo 060-8628 (Japan); Hitachi, Ltd., Shinmachi Ome-shi, Tokyo 198-8512 (Japan); Osaka, Keiichi [Department of Applied Physics, Graduate School of Engineering, Hokkaido University, Kita-ku, Sapporo 060-8628 (Japan); Industrial Application Division, Japan Synchrotron Radiation Research Institute (JASRI), 1-1-1 Kouto, Sayo-cho, Sayo-gun, Hyogo 679-5198 (Japan)], E-mail:; Takama, Toshihiko [Department of Applied Physics, Graduate School of Engineering, Hokkaido University, Kita-ku, Sapporo 060-8628 (Japan); Chen, Haydn [Department of Physics and Materials Science, City University of Hong Kong, Kowloon, Hong Kong (China)


    The diffuse X-ray scattering from single crystals of Ni - 11.3 at.% Si and 12.3 at.% Si, both aged at 1293 K followed by a water quench, was measured at room temperature. The measured diffuse intensities were analyzed to determine the Warren-Cowley atomic short-range order (SRO) parameters {alpha}{sub lmn}. The 17 values of {alpha}{sub lmn} obtained were fitted in a 5 x 10{sup 5} atom model crystal to simulate the SRO. It was found that the C16 and the C17 configurations are significantly enhanced in comparison to a random crystal. The pair-interaction energies V{sub lmn} were obtained using an inverse Monte Carlo method from the {alpha}{sub lmn} parameters. Assuming that V{sub lmn} are independent of temperature, the {alpha}{sub lmn} were calculated as a function of temperature on the basis of the Monte Carlo simulation. The curves of {alpha}{sub lmn} for 11.3 at.% Si showed a knee point at 1262 (19) K and for 12.3 at.% Si at 1325 (11) K. Both temperatures are higher by about 100 K than those of the (fcc/fcc + L1{sub 2}) phase boundary in an equilibrium phase diagram.

  4. Scaling and universality in two dimensions: three-body bound states with short-ranged interactions

    Energy Technology Data Exchange (ETDEWEB)

    Bellotti, F F; Frederico, T [Instituto Tecnologico de Aeronautica, DCTA, 12.228-900 Sao Jose dos Campos, SP (Brazil); Yamashita, M T [Instituto de Fisica Teorica, UNESP-Univ Estadual Paulista, CP 70532-2, CEP 01156-970, Sao Paulo, SP (Brazil); Fedorov, D V; Jensen, A S; Zinner, N T, E-mail: [Department of Physics and Astronomy-Aarhus University, Ny Munkegade, bygn. 1520, DK-8000 Arhus C (Denmark)


    The momentum space zero-range model is used to investigate universal properties of three interacting particles confined to two dimensions. The pertinent equations are first formulated for a system of two identical and one distinct particle and the two different two-body subsystems are characterized by two-body energies and masses. The three-body energy in units of one of the two-body energies is a universal function of the other two-body energy and the mass ratio. We derive convenient analytical formulae for calculations of the three-body energy as a function of these two independent parameters and exhibit the results as universal curves. In particular, we show that the three-body system can have any number of stable bound states. When the mass ratio of the distinct to identical particles is greater than 0.22, we find that at most two stable bound states exist, while for two heavy and one light mass an increasing number of bound states is possible. The specific number of stable bound states depends on the ratio of two-body bound state energies and on the mass ratio, and we map out an energy-mass phase diagram of the number of stable bound states. Realizable systems of both fermions and bosons are discussed in this framework.

  5. Non-renewal statistics for electron transport in a molecular junction with electron-vibration interaction (United States)

    Kosov, Daniel S.


    Quantum transport of electrons through a molecule is a series of individual electron tunneling events separated by stochastic waiting time intervals. We study the emergence of temporal correlations between successive waiting times for the electron transport in a vibrating molecular junction. Using the master equation approach, we compute the joint probability distribution for waiting times of two successive tunneling events. We show that the probability distribution is completely reset after each tunneling event if molecular vibrations are thermally equilibrated. If we treat vibrational dynamics exactly without imposing the equilibration constraint, the statistics of electron tunneling events become non-renewal. Non-renewal statistics between two waiting times τ1 and τ2 means that the density matrix of the molecule is not fully renewed after time τ1 and the probability of observing waiting time τ2 for the second electron transfer depends on the previous electron waiting time τ1. The strong electron-vibration coupling is required for the emergence of the non-renewal statistics. We show that in the Franck-Condon blockade regime, extremely rare tunneling events become positively correlated.

  6. Theoretical studies of electronic structure, phonon spectrum and electron-phonon interaction in AlCNi{sub 3}

    Energy Technology Data Exchange (ETDEWEB)

    Tuetuencue, H M [Sakarya ueniversitesi, Fen-Edebiyat Fakueltesi, Fizik Boeluemue, 54140, Adapazari (Turkey); Duman, S [Sakarya ueniversitesi, Fen-Edebiyat Fakueltesi, Fizik Boeluemue, 54140, Adapazari (Turkey); Bagci, S [Sakarya ueniversitesi, Fen-Edebiyat Fakueltesi, Fizik Boeluemue, 54140, Adapazari (Turkey); Srivastava, G P [School of Physics, University of Exeter, Stocker Road, Exeter EX4 4QL (United Kingdom)


    We report results of first-principles calculations for structural properties, electronic structure, phonon spectrum and electron-phonon interaction for the antiperovskite compound AlCNi{sub 3}. The structural properties are calculated using a plane-wave-pseudopotential method and the density functional theory within the generalised gradient approximation. The electronic structure and density of states for AlCNi{sub 3} are presented and compared with previous theoretical calculations. Our structural and electronic results are used, within the implementation of a linear response technique, for calculations of phonon states. We have observed that all phonon modes are stable along the [100] direction while unstable phonon modes are found in the [110] and [111] symmetry directions. At the Brillouin zone edge point X, the electron-phonon coupling parameters for phonon modes in AlCNi{sub 3} are calculated to be smaller than their corresponding values for MgCNi{sub 3}. This result indicates that the electron-phonon interaction is not very strong in AlCNi{sub 3}.

  7. Direct observation of children's preferences and activity levels during interactive and online electronic games. (United States)

    Sit, Cindy H P; Lam, Jessica W K; McKenzie, Thomas L


    Interactive electronic games have recently been popularized and are believed to help promote children's physical activity (PA). The purpose of the study was to examine preferences and PA levels during interactive and online electronic games among overweight and nonoverweight boys and girls. Using a modification of the SOFIT, we systematically observed 70 Hong Kong Chinese children (35 boys, 35 girls; 50 nonoverweight, 20 overweight), age 9 to 12 years, during 2 60-minute recreation sessions and recorded their game mode choices and PA levels. During Session One children could play either an interactive or an online electronic bowling game and during Session Two they could play an interactive or an online electronic running game. Children chose to play the games during 94% of session time and split this time between interactive (52%) and online (48%) versions. They engaged in significantly more moderate-to-vigorous physical activity (MVPA) during interactive games than their online electronic versions (70% vs. 2% of game time). Boys and nonoverweight children expended relatively more energy during the interactive games than girls and overweight children, respectively. New-generation interactive games can facilitate physical activity in children, and given the opportunity children may select them over sedentary versions.

  8. Lattice Model of Fractional Gradient and Integral Elasticity: Long-Range Interaction of Grunwald-Letnikov-Riesz Type


    Tarasov, Vasily E.


    Lattice model with long-range interaction of power-law type that is connected with difference of non-integer order is suggested. The continuous limit maps the equations of motion of lattice particles into continuum equations with fractional Grunwald-Letnikov-Riesz derivatives. The suggested continuum equations describe fractional generalizations of the gradient and integral elasticity. The proposed type of long-range interaction allows us to have united approach to describe of lattice models ...

  9. Quantum dynamics of long-range interacting systems using the positive-P and gauge-P representations


    Wüster, S.; Corney, J. F.; Rost, J. M.; Deuar, P.


    We provide the necessary framework for carrying out stochastic positive-P and gauge-P simulations of bosonic systems with long range interactions. In these approaches, the quantum evolution is sampled by trajectories in phase space, allowing calculation of correlations without truncation of the Hilbert space or other approximations to the quantum state. The main drawback is that the simulation time is limited by noise arising from interactions. We show that the long-range character of these i...

  10. Influence of electron-phonon interaction on quantum phase transition in a triangular triple quantum dot (United States)

    Kim, Chang-Il; Kang, Chol-Jin; Yun, Chol-Song; Choe, Myong-Il; Ahn, Jong-Kwan


    We investigate the quantum phase transition in triple quantum dot system with triangular geometry, in which one of the dots is connected to metallic leads and electrons in the dot interact with a local phonon mode. The influence of electron-phonon interaction on the quantum phase transition between local moment phase and Kondo screened strong coupling phase at the particle-hole symmetric point is studied based on the analytical arguments and the numerical renormalization group method. The results show that the critical value of tunnel-coupling between side dots decreases with the increase of electron-phonon coupling in "spin Kondo" regime. Furthermore, at a certain critical value of electron-phonon coupling, there appears only strong coupling phase, irrespective of tunnel-coupling between dots. The study of the influence of electron-phonon interaction on the quantum phase transition in triple quantum dot has the great importance for clarifying the mechanism of Kondo screening in the system.

  11. Pairing and unpairing electron densities in organic systems: Two-electron three center through space and through bonds interactions

    Energy Technology Data Exchange (ETDEWEB)

    Lobayan, Rosana M., E-mail: [Departamento de Física, Facultad de Ciencias Exactas, Naturales y Agrimensura, Universidad Nacional del Nordeste, 3400, Corrientes (Argentina); Bochicchio, Roberto C., E-mail: [Departamento de Física, Facultad de Ciencias Exactas y Naturales, Universidad de Buenos Aires, and IFIBA, CONICET, Ciudad Universitaria, 1428, Buenos Aires (Argentina)


    Two-electron three-center bonding interactions in organic ions like methonium (CH{sub 5}{sup +}), ethonium (C{sub 2}H{sub 7}{sup +}), and protonated alkanes n−C{sub 4}H{sub 11}{sup +} isomers (butonium cations) are described and characterized within the theoretical framework of the topological analysis of the electron density decomposition into its effectively paired and unpaired contributions. These interactions manifest in some of this type of systems as a concentration of unpaired electron cloud around the bond paths, in contrast to the well known paradigmatic boron hydrids in which it is not only concentrated close to the atomic nucleus and the bond paths but out of them and over the region defined by the involved atoms as a whole. This result permits to propose an attempt of classification for these interactions based in such manifestations. In the first type, it is called as interactions through bonds and in the second type as interactions through space type.

  12. Wave-Particle Interactions on Relativistic Electron Beams. (United States)


    block nuebstj C-, S_ i l iN .... . .6l I~A.S i~In V )d... D D 1473 EDO ,o,, OF 1 NOv i IS 02SOLTE . S/NC 007-014-CL601 , -T ASIeStC4-UIrYl CLAS’.IFICA...differential equation and per- nits the electron orbits to turn in the wave frame, corresponding as one advances along the beam in the direction of...state helical orbits are included. If perturbed, these orbits oscillate about equilibrium, so that substantial gain enhancement can occur if the

  13. Interacting electrons in a 2D quantum dot


    Akman, N.; Tomak, M.


    The exact numerical diagonalization of the Hamiltonian of a 2D circular quantum dot is performed for 2, 3, and 4 electrons.The results are compared with those of the perturbation theory.Our numerical results agree reasonably well for small values of the dimensionles coupling constant \\lambda=a\\over a_B where a is the dot radius and a_B is the effective Bohr radius.Exact diagonalization results are compared with the classical predictions, and they are found to be almost coincident for large \\l...

  14. Unraveling the acoustic electron-phonon interaction in graphene

    DEFF Research Database (Denmark)

    Kaasbjerg, Kristen; Thygesen, Kristian S.; Jacobsen, Karsten W.


    Using a first-principles approach we calculate the electron-phonon couplings in graphene for the transverse and longitudinal acoustic phonons. Analytic forms of the coupling matrix elements valid in the long-wavelength limit are found to give an almost quantitative description of the first...... that the intrinsic effective acoustic deformation potential of graphene is Ξeff=6.8 eV and that the temperature dependence of the mobility μ~T-α in the Bloch-Gru¨neisen regime increases beyond an α=4 dependence even in the absence of screening when the true coupling matrix elements are considered. The α>4...

  15. Specular Reflectivity and Hot-Electron Generation in High-Contrast Relativistic Laser-Plasma Interactions

    Energy Technology Data Exchange (ETDEWEB)

    Kemp, Gregory Elijah [The Ohio State Univ., Columbus, OH (United States)


    Ultra-intense laser (> 1018 W/cm2) interactions with matter are capable of producing relativistic electrons which have a variety of applications in state-of-the-art scientific and medical research conducted at universities and national laboratories across the world. Control of various aspects of these hot-electron distributions is highly desired to optimize a particular outcome. Hot-electron generation in low-contrast interactions, where significant amounts of under-dense pre-plasma are present, can be plagued by highly non-linear relativistic laser-plasma instabilities and quasi-static magnetic field generation, often resulting in less than desirable and predictable electron source characteristics. High-contrast interactions offer more controlled interactions but often at the cost of overall lower coupling and increased sensitivity to initial target conditions. An experiment studying the differences in hot-electron generation between high and low-contrast pulse interactions with solid density targets was performed on the Titan laser platform at the Jupiter Laser Facility at Lawrence Livermore National Laboratory in Livermore, CA. To date, these hot-electrons generated in the laboratory are not directly observable at the source of the interaction. Instead, indirect studies are performed using state-of-the-art simulations, constrained by the various experimental measurements. These measurements, more-often-than-not, rely on secondary processes generated by the transport of these electrons through the solid density materials which can susceptible to a variety instabilities and target material/geometry effects. Although often neglected in these types of studies, the specularly reflected light can provide invaluable insight as it is directly influenced by the interaction. In this thesis, I address the use of (personally obtained) experimental specular reflectivity measurements to indirectly study hot-electron generation in the context of high-contrast, relativistic

  16. Testing and Comparison of Imaging Detectors for Electrons in the Energy Range 10–20 keV (United States)

    Matheson, J.; Moldovan, G.; Kirkland, A.; Allinson, N.; Abrahams, J. P.


    Interest in direct detectors for low-energy electrons has increased markedly in recent years. Detection of electrons in the energy range up to low tens of keV is important in techniques such as photoelectron emission microscopy (PEEM) and electron backscatter diffraction (EBSD) on scanning electron microscopes (SEMs). The PEEM technique is used both in the laboratory and on synchrotron light sources worldwide. The ubiquity of SEMs means that there is a very large market for EBSD detectors for materials studies. Currently, the most widely used detectors in these applications are based on indirect detection of incident electrons. Examples include scintillators or microchannel plates (MCPs), coupled to CCD cameras. Such approaches result in blurring in scintillators/phosphors, distortions in optical systems, and inefficiencies due the limited active area of MCPs. In principle, these difficulties can be overcome using direct detection in a semiconductor device. Growing out of a feasibility study into the use of a direct detector for use on an XPEEM, we have built at Rutherford Appleton Laboratory a system to illuminate detectors with an electron beam of energy up to 20 keV . We describe this system in detail. It has been used to measure the performance of a custom back-thinned monolithic active pixel sensor (MAPS), a detector based on the Medipix2 chip, and a commercial detector based on MCPs. We present a selection of the results from these measurements and compare and contrast different detector types.

  17. Electron probe microanalysis (EPMA) measurement of thin-film thickness in the nanometre range. (United States)

    Procop, M; Radtke, M; Krumrey, M; Hasche, K; Schädlich, S; Frank, W


    The thickness of thin films of platinum and nickel on fused silica and silicon substrates has been determined by EPMA using the commercial software STRATAGEM for calculation of film thickness. Film thickness ranged in the order 10 nm. An attempt was made to estimate the confidence range of the method by comparison with results from other methods of analysis. The data show that in addition to the uncertainty of the spectral intensity measurement and the complicated fitting routine, systematic deviation caused by the underlying model should be added. The scattering in the results from other methods does not enable specification of a range of uncertainty, but deviations from the real thickness are estimated to be less than 20%.

  18. Solid-state pulsed microwave bridge for electron spin echo spectrometers of 8-mm wavelength range

    Directory of Open Access Journals (Sweden)

    Kalabukhova E. N.


    Full Text Available The article presents a construction of a coherent pulsed microwave bridge with an output power up to 10 Wt with a time resolution of 10–8 seconds at a pulse repetition rate of 1 kHz designed for electron spin echo spectrometers. The bridge is built on a homodyne scheme based on IMPATT diodes, which are used for modulation and amplification of microwave power coming from the reference Gunn diode oscillator. The advantages of the bridge are optimal power and minimum pulse width, simple operation, low cost.

  19. Electron - polar acoustical phonon interactions in nitride based diluted magnetic semiconductor quantum well via hot electron magnetotransport

    Energy Technology Data Exchange (ETDEWEB)

    Pandya, Ankur, E-mail: [Institute of Technology, Nirma University, Ahmedabad-382481 (India); Shinde, Satyam, E-mail: [School of Technology, Pandit Din Dayal Petroleum University, Gandhinagar-382007 (India); Jha, Prafulla K., E-mail: [Department of Physics, Faculty of Science, The M.S.University of Baroda, Vadodara-390002 (India)


    In this paper the hot electron transport properties like carrier energy and momentum scattering rates and electron energy loss rates are calculated via interactions of electrons with polar acoustical phonons for Mn doped BN quantum well in BN nanosheets via piezoelectric scattering and deformation potential mechanisms at low temperatures with high electric field. Electron energy loss rate increases with the electric field. It is observed that at low temperatures and for low electric field the phonon absorption is taking place whereas, for sufficient large electric field, phonon emission takes place. Under the piezoelectric (polar acoustical phonon) scattering mechanism, the carrier scattering rate decreases with the reduction of electric field at low temperatures wherein, the scattering rate variation with electric field is limited by a specific temperature beyond which there is no any impact of electric field on such scattering.

  20. Impact of electronic messaging on the patient-physician interaction. (United States)

    Wallwiener, Markus; Wallwiener, Christian Wilhelm; Kansy, Julia Katharina; Seeger, Harald; Rajab, Taufiek Konrad


    Patients are interested in secure electronic communication with their health-care providers, but physicians have been slow to adopt the technique into their practice. We have therefore reviewed the literature on secure patient messaging. Relevant studies were identified by Medline search which produced 1065 publications. Of these, 71 relevant articles were read independently by two reviewers. Currently available messaging systems allow for asynchronous communication, physician reimbursement and automated supporting functions such as triaging of patient messages and integration of messaging into medical records. The review showed that patients are satisfied with the use of secure physician messaging systems and find such services to be convenient, time-saving and useful. Physicians do not report adverse effects from their use. Legal concerns with electronic messaging include compliance with privacy standards. The economic benefits of secure messaging systems are most immediately apparent for larger health-care groups and hospitals, although smaller practices will also benefit in the long run. Secure patient-physician messaging is a convenient and useful addition to the health-care infrastructure. It can be expected that the identification of secure providers, integration with reimbursement systems and initial uptake by larger health-care organizations will speed up the adoption into routine health care.

  1. Interactive electronic storybooks for kindergartners to promote vocabulary growth. (United States)

    Smeets, Daisy J H; Bus, Adriana G


    The goals of this study were to examine (a) whether extratextual vocabulary instructions embedded in electronic storybooks facilitated word learning over reading alone and (b) whether instructional formats that required children to invest more effort were more effective than formats that required less effort. A computer-based "assistant" was added to electronic storybooks. The assistant posed extratextual vocabulary questions. Questions were presented in a multiple-choice format so that children could respond by clicking on the picture that best represented the target word. In Experiment 1 (N=20), children read stories with and without questions. Children learned more words when reading with questions than without. Expressive vocabulary was particularly affected by question insertion. In Experiment 2 (N=27), we used two methods for teaching words: one requiring more effort on the part of children (questions) and one requiring less effort ("hotspots" that provide definitions). Results revealed that questions were more beneficial than just providing a definition or synonym of the target word. Implications for designing new e-book apps are discussed. Copyright © 2011 Elsevier Inc. All rights reserved.

  2. Spectroscopic Studies of the Electron Donor-Acceptor Interaction of ...

    African Journals Online (AJOL)

    Conformity with Beer\\'s law was evident over the concentration range 0.8 – 8.0 mg/100 ml of chloroquine phosphate; thus making it possible for an accurate quantitative determination of the drug. Conclusion: The studied complexation phenomenon formed a basis for the quantitative determination of both pure samples and ...

  3. Electron–electron interactions in the chemical bond: “1/3” Effect in ...

    Indian Academy of Sciences (India)


    Abstract. The prominent “1/3” effect observed in the Hall effect plateaus of two- dimensional electron gas (2DEG) systems has been postulated to indicating 1/3 fractional charge quasiparticle excitations arising from electron–electron interactions. Tunneling shot-noise experiments on 2DEF exhibiting fractional quantum Hall ...

  4. Exploring the Interaction Natures in Plutonyl (VI) Complexes with Topological Analyses of Electron Density


    Jiguang Du; Xiyuan Sun; Gang Jiang


    The interaction natures between Pu and different ligands in several plutonyl (VI) complexes are investigated by performing topological analyses of electron density. The geometrical structures in both gaseous and aqueous phases are obtained with B3LYP functional, and are generally in agreement with available theoretical and experimental results when combined with all-electron segmented all-electron relativistic contracted (SARC) basis set. The Pu– O y l bond orders show significant line...

  5. Dynamics of energetic electrons interacting with sub-packet chorus emissions in the magnetosphere (United States)

    Hiraga, R.; Omura, Y.


    The recent study has revealed RTA and URA processes, the acceleration of relativistic electrons by interaction with chorus emissions. The wave model, however, is found to require some updates based on the recent observations. We develop a new wave model compatible with the observations and study the particle motion under the influence of this new wave model. The most distinctive feature of the new model is its amplitude growth manner. The wave is excited near the equator and grows in amplitude as an absolute instability as a function of time. This amplitude growth is bounded by the optimum and threshold amplitudes. When the amplitude grows to reach the optimum amplitude, it drops down to the threshold value and repeats the growth with a saw-like shape defined as sub-packet wave. The sub-packet wave generated near the equator experiences the convective amplitude growth propagating to the higher latitude region. Since the group velocity of the wave propagation is a function of its frequency, a wave source generated and released from the equator at a certain time and a group velocity could be overtaken by another wave released at a later timing and hence a faster group velocity. In sub-packet case, this frequency value is further affected by the sub-packet amplitude wave form to make the process more complex. Into this new wave form, energetic electrons are inserted and their motions are examined. For example, a resonant electron can be entrapped by the wave, being accelerated and normally detrapped after a certain period of time, but there can be a possibility that the following sub-packet wave in a complex propagation manner coincidently entraps the electron to provide multiple accelerations. We injected a large number of electrons over a wide energy range from 10kev to 10Mev into the sub-packet wave to simulate the nonlinear dynamics of RTA and URA. The electrons motion or more precisely entrapping and detrapping processes are examined under various conditions.

  6. Control of strength and stability of emulsion-gels by a combination of long- and short-range interactions

    NARCIS (Netherlands)

    Blijdenstein, T.B.J.; Hendriks, W.P.G.; Linden, van der E.; Vliet, van T.; Aken, van G.A.


    This paper discusses the change in phase behavior and mechanical properties of oil-in-water emulsion gels brought about by variation of long- and short-range attractive interactions. The model system studied consisted of oil droplets stabilized by the protein -lactoglobulin (-lg). A long-range

  7. Electronic Interactions of n-Doped Perylene Diimide Groups Appended to Polynorbornene Chains: Implications for Electron Transport in Organic Electronics. (United States)

    Nguyen, Minh T; Biberdorf, Joshua D; Holliday, Bradley J; Jones, Richard A


    A polymer consisting of a polynorbornene backbone with perylene diimide (PDI) pendant groups on each monomeric unit is synthesized via ring opening metathesis polymerization. The PDI pendant groups along the polymer backbone, studied by UV-vis absorption, fluorescence emission, and electron paramagnetic resonance spectroscopy in addition to electrochemical methods, show evidence of molecular aggregation and corresponding electronic coupling with neighboring groups, which forms pathways for efficient electron transport from one group to another in a specific reduced form. When n-doped, the title polymer shows redox conductivity of 5.4 × 10-3 S cm-1 , comparable with crystalline PDI materials, and is therefore a promising material for use in organic electronics. © 2017 WILEY-VCH Verlag GmbH & Co. KGaA, Weinheim.

  8. Interactive learning in medicine: socrates in electronic clothes. (United States)

    Brezis, M; Cohen, R


    Traditional lectures have limited ability to maintain attention and to promote changes in behaviour. Active learning, which stimulates the audience to think and participate, may be more effective. We describe our experience with an interactive polling system in lectures to physicians and students. Audience's answers to questions are displayed, providing instant feedback to both lecturer and audience, and promoting the use of case discussions and problem-solving exercises. In our experience, this modality improves the quality of clinical learning and deserves further evaluation.

  9. Results on the Coherent Interaction of High Energy Electrons and Photons in Oriented Single Crystals

    CERN Document Server

    Apyan, A.; Badelek, B.; Ballestrero, S.; Biino, C.; Birol, I.; Cenci, P.; Connell, S.H.; Eichblatt, S.; Fonseca, T.; Freund, A.; Gorini, B.; Groess, R.; Ispirian, K.; Ketel, T.J.; Kononets, Yu.V.; Lopez, A.; Mangiarotti, A.; van Rens, B.; Sellschop, J.P.F.; Shieh, M.; Sona, P.; Strakhovenko, V.; Uggerhoj, E.; Uggerhj, Ulrik Ingerslev; Unel, G.; Velasco, M.; Vilakazi, Z.Z.; Wessely, O.; Kononets, Yu.V.


    The CERN-NA-59 experiment examined a wide range of electromagnetic processes for multi-GeV electrons and photons interacting with oriented single crystals. The various types of crystals and their orientations were used for producing photon beams and for converting and measuring their polarisation. The radiation emitted by 178 GeV unpolarised electrons incident on a 1.5 cm thick Si crystal oriented in the Coherent Bremsstrahlung (CB) and the String-of-Strings (SOS) modes was used to obtain multi-GeV linearly polarised photon beams. A new crystal polarimetry technique was established for measuring the linear polarisation of the photon beam. The polarimeter is based on the dependence of the Coherent Pair Production (CPP) cross section in oriented single crystals on the direction of the photon polarisation with respect to the crystal plane. Both a 1 mm thick single crystal of Germanium and a 4 mm thick multi-tile set of synthetic Diamond crystals were used as analyzers of the linear polarisation. A birefringence ...

  10. Final Report on Investigation of the Electron Interactions in Graphene

    Energy Technology Data Exchange (ETDEWEB)

    Kim, Philip [Columbia University


    In graphene, combined with the real spin degree of freedom, which exhibits SU(2) symmetry, the total internal degrees of freedom of graphene carriers is thus described by a larger SU(4) symmetry, which produces a richer space for potential phenomena of emergent correlated electron phenomena. The major part of this proposal is exploring this unique multicomponent correlated system in the quantum limit. In the current period of DOE BES support we have made several key advances that will serve as a foundation for the new studies in this proposal. Employing the high-mobility encapsulated graphene heterostructures developed during the current phase of research, we have investigated spin and valley quantum Hall ferromagnetism in graphene and discovered a spin phase transition leading to a quantum spin Hall analogue. We have also observed the fractal quantum Hall effect arising from the Hofstadter’s butterfly energy spectrum. In addition, we have discovered multiband transport phenomena in bilayer graphene at high carrier densities.

  11. Measurement of the magnetic interaction between two bound electrons of two separate ions. (United States)

    Kotler, Shlomi; Akerman, Nitzan; Navon, Nir; Glickman, Yinnon; Ozeri, Roee


    Electrons have an intrinsic, indivisible, magnetic dipole aligned with their internal angular momentum (spin). The magnetic interaction between two electronic spins can therefore impose a change in their orientation. Similar dipolar magnetic interactions exist between other spin systems and have been studied experimentally. Examples include the interaction between an electron and its nucleus and the interaction between several multi-electron spin complexes. The challenge in observing such interactions for two electrons is twofold. First, at the atomic scale, where the coupling is relatively large, it is often dominated by the much larger Coulomb exchange counterpart. Second, on scales that are substantially larger than the atomic, the magnetic coupling is very weak and can be well below the ambient magnetic noise. Here we report the measurement of the magnetic interaction between the two ground-state spin-1/2 valence electrons of two (88)Sr(+) ions, co-trapped in an electric Paul trap. We varied the ion separation, d, between 2.18 and 2.76 micrometres and measured the electrons' weak, millihertz-scale, magnetic interaction as a function of distance, in the presence of magnetic noise that was six orders of magnitude larger than the magnetic fields the electrons apply on each other. The cooperative spin dynamics was kept coherent for 15 seconds, during which spin entanglement was generated, as verified by a negative measured value of -0.16 for the swap entanglement witness. The sensitivity necessary for this measurement was provided by restricting the spin evolution to a decoherence-free subspace that is immune to collective magnetic field noise. Our measurements show a d(-3.0(4)) distance dependence for the coupling, consistent with the inverse-cube law.

  12. Characterisation of a detector based on microchannel plates for electrons in the energy range 10 20 keV (United States)

    Moldovan, G.; Matheson, J.; Derbyshire, G.; Kirkland, A.


    As part of a feasibility study into the use of novel electron detectors for an X-ray photoelectron emission microscope (XPEEM), we have characterised a detector based on microchannel plates (MCPs), a phosphor screen and a CCD camera. For XPEEM, an imaging detector is required for electrons in the energy range 10-20 keV. This type of detector is a standard fitment on commercial instruments and we have studied its performance in some detail in order to provide a baseline against which to evaluate future detector technologies. We present detective quantum efficiency (DQE), noise power spectrum (NPS) and modulation transfer function (MTF) measurements of a commercial detector, in the energy range of interest, as a function of the detector bias voltage.

  13. Modular Power Electronic Converters in the Power Range 1 to 10 kW

    DEFF Research Database (Denmark)

    Klimczak, Pawel

    Thanks to CO2 emission reduction policies and increasing prices of fossil fuels a significant growth in field of sustainable energy sources (SES) is being observed during last decade. A government support and take-off projects in Europe and US shall ensure an increasing trend in future too. Some...... of SES based plants , like hydro-, geothermal-, biofuel-plants, use synchronous generators directly connected to the grid. But some other SES technologies, like fuel cell or photovoltaic, require a power electronic converter between the energy source and the load or the grid. Work presented...... in this thesis concentrates on dc-dc non-isolated converters suitable for high voltage gain applications, like uninterruptible power supply (UPS) and some of sustainable energy sources. A special attention is on reduction of power losses and efficiency improvements in non-isolated dc-dc step-up converters...

  14. Variable-range electron hopping, conductivity cross-over and space-charge relaxation in C60Br6


    Manesh, Zachariah; Romanini, Michela; Zygouri, Panagiota; Gournis, Dimitrios; Tamarit Mur, José Luis; Barrio Casado, María del; Macovez, Roberto


    Dielectric spectroscopy is employed to probe the frequency-dependent conductivity and dipolar dielectric response of solid C60Br6. Below approximately 215 K, charge conduction is electronic and well described by Mott's variable-range polaron hopping model, with effective hopping activation energy Ea varying between 0.12 eV at 125 K and 0.16 eV at 220 K, and most probable hopping range varying between 100 and 125% of the decay length of the localized polaron's wavefunction. Above 215 K a new c...

  15. Determination of Chromium Valence Over the Range Cr(0)-Cr(VI) by Electron Energy Loss Spectroscopy (United States)


    be of Cr (VI): Cr (V) [14,40-45] and Cr (IV) [46]. To fully altered by microbes [11-13], green algae [14], higher plants understand the geochemistry of Cr ... Cr (III) by bacteria [42,44,45] and Further, nearly all mineralized Cr in the terrestrial crust is green algae [14], reacts with diphenylcarbazide to...Determination of chromium valence over the range Cr (O)- Cr (VI) by electron energy loss spectroscopy Tyrone L. Daultona , Brenda J. Littleb ’Marine

  16. Magnetic interactions and electronic structure of Pt2Mn1− xYxGa (Y ...

    Indian Academy of Sciences (India)


    Jun 19, 2017 ... We study the magnetic exchange interaction between the atoms for the materials with ferromagnetic and antiferromagnetic configurations to show the effects of Fe and Cr substitution at Mn site on the magnetic interactions of these systems. Detailed analysis of electronic structure in terms of density of states ...

  17. Long-wavelength optical phonon behavior in uniaxial strained graphene: Role of electron-phonon interaction


    Assili, Mohamed; Haddad, Sonia


    We derive the frequency shifts and the broadening of $\\Gamma$ point longitudinal optical (LO) and transverse optical (TO) phonon modes, due to electron-phonon interaction, in graphene under uniaxial strain as a function of the electron density and the disorder amount. We show that, in the absence of a shear strain component, such interaction gives rise to a lifting of the degeneracy of the LO and TO modes which contributes to the splitting of the G Raman band. The anisotropy of the electronic...

  18. Interaction of relativistic short proton bunches with space charge limited electron clouds

    Directory of Open Access Journals (Sweden)

    F. B. Petrov


    Full Text Available The electron cloud buildup and interaction with a train of relativistic, short proton bunches is studied using particle-in-cell codes. The simulation models describe the electron generation at the beam pipe wall as well as the wakefield behind the bunches. The study focuses on the space charge limited (saturated cloud profile between the bunches and on the incoherent tune spread caused by the interaction of the saturated cloud with individual bunches. Analytical expressions describing the pinch of a saturated electron cloud are derived and compared to simulation results.

  19. Attractive electron-electron interactions at the LaAlO3/SrTiO3 Interface

    DEFF Research Database (Denmark)

    Prawiroatmodjo, Guenevere E D K

    The conducting interface between the two insulating oxides LaAlO3 and SrTiO3 (LAO/STO) exhibits many intriguing properties such as high mobility, a gate-tunable superconducting phase, ferroelectricity and ferromagnetism. In this thesis, devices are fabricated at the LAO/STO interface using novel...... state is found, and transport characteristics are described to originate from attractive electron-electron interactions that result in a negative effective charging energy U. Further, the excitation spectrum is explored and compared to calculations based on a single-orbital Anderson model with negative...

  20. Interplay between quantum interference and electron interactions in a Rashba system. (United States)

    Stefański, Piotr


    We investigate theoretically a nanoscopic device in which quantum interference of electron waves takes place in the presence of their mutual Coulomb interaction. The device consists of interacting quantum dots coupled to spin-polarized leads via quantum point contacts with Rashba interaction. The Rashba spin-flip-assisted inter-subband mixing in quantum point contacts induces quantum interference between the tunneling waves, which interact by Coulomb repulsion inside the dot. The spin-dependent Fano resonances, which appear in the conductance through the device, are significantly modified by Coulomb interactions. Their width and shape depend on the quantum dot spin-up and spin-down occupancies, controlled by electron interactions. On the other hand, correlators calculated for the quantum dot spin sub-levels are not influenced by quantum interference between them and depend rather on the degree of localization of these levels.

  1. Effective atomic numbers and electron densities of bacteriorhodopsin and its comprising amino acids in the energy range 1 keV–100 GeV

    Energy Technology Data Exchange (ETDEWEB)

    Ahmadi, Morteza; Lunscher, Nolan [Waterloo Institute for Nanotechnology and Department of Systems Design Engineering, University of Waterloo, 200 University Ave., W., Waterloo, Ontario, Canada N2L 3G1 (Canada); Yeow, John T.W., E-mail: [Waterloo Institute for Nanotechnology and Department of Systems Design Engineering, University of Waterloo, 200 University Ave., W., Waterloo, Ontario, Canada N2L 3G1 (Canada)


    Recently, there has been an interest in fabrication of X-ray sensors based on bacteriorhodopsin, a proton pump protein in cell membrane of Halobacterium salinarium. Therefore, a better understanding of interaction of X-ray photons with bacteriorhodopsin is required. We use WinXCom program to calculate the mass attenuation coefficient of bacteriorhodopsin and its comprising amino acids for photon energies from 1 keV to 100 GeV. These amino acids include alanine, arginine, asparagine, aspartic acid, glutamine, glutamic acid, glycine, isoleucine, leucine, lysine, methionine, phenylalanine, proline, serine, threonine, tryptophan, tyrosine, valine, Asx1, Asx2, Glx1 and Glx2. We then use that data to calculate effective atomic number and electron densities for the same range of energy. We also emphasize on two ranges of energies (10–200 keV and 1–20 MeV) in which X-ray imaging and radiotherapy machines work.

  2. Local electronic structure and ferromagnetic interaction in La(Co,Ni)O3 (United States)

    Schuppler, S.; Nagel, P.; Fuchs, D.; Löhneysen, H. V.; Merz, M.; Huang, M.-J.

    Perovskite-related transition-metal oxides exhibit properties ranging from insulating to superconducting as well as unusual magnetic phases, and cobaltates, in particular, have been known for their propensity for spin-state transitions. Nonmagnetic LaCoO3 and paramagnetic LaNiO3 are parent compounds for the La(Co1-xNix) O3 (LCNO) family, which, for intermediate Ni content x, exhibits ferromagnetism. The local electronic structure and the ferromagnetic interaction in LCNO have been studied by x-ray absorption (XAS) and x-ray magnetic circular dichroism (XMCD). XAS indicates a mixed-valence state for both Co and Ni, with both valences changing systematically with increasing x. Simultaneously, a spin-state redistribution towards HS (Co site) and LS (Ni site) occurs, and temperature-dependent spin-state transitions are increasingly suppressed. XMCD identifies the element-specific contributions to the magnetic moment and interactions. A simple model based on a double-exchange-like mechanism between Co3+ HS and Ni3+HS can qualitatively account for the evolution of ferromagnetism in the LCNO series.

  3. Acceleration of Long-Range Photoinduced Electron Transfer through DNA by Hydroxyquinolines as Artificial Base Pairs. (United States)

    Bätzner, Effi; Liang, Yu; Schweigert, Caroline; Unterreiner, Andreas-Neil; Wagenknecht, Hans-Achim


    The C-nucleoside based on the hydroxyquinoline ligand (Hq) is complementary to itself and forms stable Hq-Hq pairs in double-stranded DNA. These artificial Hq-Hq pairs may serve as artificial electron carriers for long-range photoinduced electron transfer in DNA, as elucidated by a combination of gel electrophoretic analysis of irradiated samples and time-resolved transient absorption spectroscopy. For this study, the Hq-Hq pair was combined with a DNA-based donor-acceptor system consisting of 6-N,N-dimethylaminopyrene conjugated to 2'-deoxyuridine as photoinducible electron donor, and methyl viologen attached to the 2'-position of uridine as electron acceptor. The Hq radical anion was identified in the time-resolved measurements and strand cleavage products support its role as an intermediate charge carrier. Hence, the Hq-Hq pair significantly enhances the electron hopping capability of DNA compared to natural DNA bases over long distances while keeping the self-assembly properties as the most attractive feature of DNA as a supramolecular architecture. © 2015 WILEY-VCH Verlag GmbH & Co. KGaA, Weinheim.

  4. Accurate transport simulation of electron tracks in the energy range 1 keV-4 MeV

    Energy Technology Data Exchange (ETDEWEB)

    Cobut, V. E-mail:; Cirioni, L.; Patau, J.P


    Multipurpose electron transport simulation codes are widely used in the fields of radiation protection and dosimetry. Broadly based on multiple scattering theories and continuous energy loss stopping powers with some mechanism taking straggling into account, they give reliable answers to many problems. However they may be unsuitable in some specific situations. In fact, many of them are not able to accurately describe particle transport through very thin slabs and/or in high atomic number materials, or also when knowledge of high-resolution depth dose distributions is required. To circumvent these deficiencies, we developed a Monte Carlo code simulating each interaction along electron tracks. Gas phase elastic cross sections are corrected to take into account solid state effects. Inelastic interactions are described within the framework of the Martinez et al. [J. Appl. Phys. 67 (1990) 2955] theory intended to deal with energy deposition in both condensed insulators and conductors. The model described in this paper is validated for some materials as aluminium and silicon, encountered in spectrometric and dosimetric devices. Comparisons with experimental, theoretical and other simulation results are made for angular distributions and energy spectra of transmitted electrons through slabs of different thicknesses and for depth energy distributions in semi-infinite media. These comparisons are quite satisfactory.

  5. Two-band electronic metal and neighboring spin Bose-metal on a zigzag strip with longer-ranged repulsion (United States)

    Lai, Hsin-Hua; Motrunich, Olexei I.


    We consider an electronic model for realizing the spin Bose-metal (SBM) phase on a two-leg triangular strip—a spin liquid phase found by Sheng [Phys. Rev. B 79, 205112 (2009)] in a spin-1/2 model with ring exchanges. The SBM can be viewed as a “C1S2” Mott insulator of electrons where the overall charge transporting mode is gapped out. We start from a two-band “C2S2” metal and consider extended repulsion motivated by recent ab initio derivation of electronic model for κ-ET spin liquid material [K. Nakamura , J. Phys. Soc. Jpn. 78, 083710 (2009)]. Using weak coupling renormalization group analysis, we find that the extended interactions allow much wider C2S2 metallic phase than in the Hubbard model with on-site repulsion only. An eight-fermion umklapp term plays a crucial role in producing a Mott insulator but cannot be treated in weak coupling. We use bosonization to extend the analysis to intermediate coupling and study phases obtained out of the C2S2 metal upon increasing overall repulsion strength, finding that the SBM phase is a natural outcome for extended interactions.

  6. Electromagnetic cascade in high-energy electron, positron, and photon interactions with intense laser pulses (United States)

    Bulanov, S. S.; Schroeder, C. B.; Esarey, E.; Leemans, W. P.


    The interaction of high-energy electrons, positrons, and photons with intense laser pulses is studied in head-on collision geometry. It is shown that electrons and/or positrons undergo a cascade-type process involving multiple emissions of photons. These photons can consequently convert into electron-positron pairs. As a result charged particles quickly lose their energy developing an exponentially decaying energy distribution, which suppresses the emission of high-energy photons, thus reducing the number of electron-positron pairs being generated. Therefore, this type of interaction suppresses the development of the electromagnetic avalanche-type discharge, i.e., the exponential growth of the number of electrons, positrons, and photons does not occur in the course of interaction. The suppression will occur when three-dimensional effects can be neglected in the transverse particle orbits, i.e., for sufficiently broad laser pulses with intensities that are not too extreme. The final distributions of electrons, positrons, and photons are calculated for the case of a high-energy e-beam interacting with a counterstreaming, short intense laser pulse. The energy loss of the e-beam, which requires a self-consistent quantum description, plays an important role in this process, as well as provides a clear experimental observable for the transition from the classical to quantum regime of interaction.

  7. Electron spin interactions in chemistry and biology fundamentals, methods, reactions mechanisms, magnetic phenomena, structure investigation

    CERN Document Server

    Likhtenshtein, Gertz


    This book presents the versatile and pivotal role of electron spin interactions in nature. It provides the background, methodologies and tools for basic areas related to spin interactions, such as spin chemistry and biology, electron transfer, light energy conversion, photochemistry, radical reactions, magneto-chemistry and magneto-biology. The book also includes an overview of designing advanced magnetic materials, optical and spintronic devices and photo catalysts. This monograph appeals to scientists and graduate students working in the areas related to spin interactions physics, biophysics, chemistry and chemical engineering.

  8. Self-alignment of Co adatoms on in atomic wires by quasi-one-dimensional electron-gas-meditated interactions. (United States)

    Liu, Canhua; Uchihashi, Takashi; Nakayama, Tomonobu


    Low-density Co atoms are found to self-align on the Si(111)-(4 x 1)-In surface in the direction of In atomic wires at incommensurate adsorption sites. Indirect interaction between a pair of Co adatoms is investigated through a site distribution function of adatoms determined with scanning tunneling microscopy. In the direction of self-alignment, the potential of the mean force between two Co adatoms is long-range and oscillatory with multiple frequencies, which correlate strongly to the electronic scattering vectors of the surface-state bands at the Fermi level. We thus attribute the Co-Co interaction to that mediated by a quasi-one-dimensional electron gas confined within the In atomic wires.

  9. Quantifying electron transfer reactions in biological systems: what interactions play the major role? (United States)

    Sjulstok, Emil; Olsen, Jógvan Magnus Haugaard; Solov'yov, Ilia A


    Various biological processes involve the conversion of energy into forms that are usable for chemical transformations and are quantum mechanical in nature. Such processes involve light absorption, excited electronic states formation, excitation energy transfer, electrons and protons tunnelling which for example occur in photosynthesis, cellular respiration, DNA repair, and possibly magnetic field sensing. Quantum biology uses computation to model biological interactions in light of quantum mechanical effects and has primarily developed over the past decade as a result of convergence between quantum physics and biology. In this paper we consider electron transfer in biological processes, from a theoretical view-point; namely in terms of quantum mechanical and semi-classical models. We systematically characterize the interactions between the moving electron and its biological environment to deduce the driving force for the electron transfer reaction and to establish those interactions that play the major role in propelling the electron. The suggested approach is seen as a general recipe to treat electron transfer events in biological systems computationally, and we utilize it to describe specifically the electron transfer reactions in Arabidopsis thaliana cryptochrome-a signaling photoreceptor protein that became attractive recently due to its possible function as a biological magnetoreceptor.

  10. Ab initio study of He-He interactions in homogeneous electron gas

    Energy Technology Data Exchange (ETDEWEB)

    Wang, Jinlong; Niu, Liang-Liang; Zhang, Ying, E-mail:


    Highlights: • Helium atoms interact via the He induced Friedel oscillations of electron densities. • He-He global binding energy minimum of ∼−0.09 eV is reached at an optimal electron density of 0.04 e/Å{sup 3}, corresponding to an optimal He-He separation of ∼1.7 Å. • The present results can qualitatively interpret the well-known He self-trapping behavior in metals. - Abstract: We have investigated the immersion energy of a single He and the He-He interactions in homogeneous electron gas using ab initio calculations. It is found that He dislikes electrons and He-He interact via the He induced Friedel oscillations of electron densities. A critical electron density at which the global binding energy extremum shifts from the first minimum to the second one is identified. We also discover that the He-He global binding energy minimum of ∼−0.09 eV is reached at an optimal electron density of 0.04 e/Å{sup 3}, corresponding to an optimal He-He separation of ∼1.7 Å. Further, the He atoms are found to gain a trivial amount of 2s and 2p states from the free electrons, inducing a hybridization between the He s- and p-states. The present results can qualitatively interpret the well-known He self-trapping behavior in metals.

  11. Quantifying electron transfer reactions in biological systems: what interactions play the major role? (United States)

    Sjulstok, Emil; Olsen, Jógvan Magnus Haugaard; Solov'Yov, Ilia A.


    Various biological processes involve the conversion of energy into forms that are usable for chemical transformations and are quantum mechanical in nature. Such processes involve light absorption, excited electronic states formation, excitation energy transfer, electrons and protons tunnelling which for example occur in photosynthesis, cellular respiration, DNA repair, and possibly magnetic field sensing. Quantum biology uses computation to model biological interactions in light of quantum mechanical effects and has primarily developed over the past decade as a result of convergence between quantum physics and biology. In this paper we consider electron transfer in biological processes, from a theoretical view-point; namely in terms of quantum mechanical and semi-classical models. We systematically characterize the interactions between the moving electron and its biological environment to deduce the driving force for the electron transfer reaction and to establish those interactions that play the major role in propelling the electron. The suggested approach is seen as a general recipe to treat electron transfer events in biological systems computationally, and we utilize it to describe specifically the electron transfer reactions in Arabidopsis thaliana cryptochrome-a signaling photoreceptor protein that became attractive recently due to its possible function as a biological magnetoreceptor.

  12. Nonlinear interaction of photons and phonons in electron-positron plasmas

    Energy Technology Data Exchange (ETDEWEB)

    Tajima, T.; Taniuti, T.


    Nonlinear interaction of electromagnetic waves and acoustic modes in an electron-positron plasma is investigated. The plasma of electrons and positrons is quite plastic so that the imposition of electromagnetic (EM) waves causes depression of the plasma and other structural imprints on it through either the nonresonant or resonant interaction. Our theory shows that the nonresonant interaction can lead to the coalescence of photons and collapse of plasma cavity in higher ({ge} 2) dimensions. The resonant interaction, in which the group velocity of EM waves is equal to the phase velocity of acoustic waves, is analyzed and a set of basic equations of the system is derived via the reductive perturbation theory. We find new solutions of solitary types: bright solitons, kink solitons, and dark solitons as the solutions to these equations. Our computation hints their stability. An impact of the present theory on astrophysical plasma settings is expected, including the cosmological relativistically hot electron-positron plasma. 20 refs., 9 figs.

  13. Nonlinear interaction of photons and phonons in electron-positron plasmas

    Energy Technology Data Exchange (ETDEWEB)

    Tajima, T.; Taniuti, T. (Institute for Fusion Studies, The University of Texas at Austin, Austin, TX (USA))


    Nonlinear interaction of electromagnetic waves and acoustic modes in an electron-positron plasma is investigated. The plasma of electrons and positrons is quite plastic so that the imposition of electromagnetic (em) waves causes depression of the plasma and other structural imprints on it through either the nonresonant or resonant interaction. Our theory shows that the nonresonant interaction can lead to the coalescence of photons and collapse of plasma cavity in higher ({ge}2) dimensions. The resonant interaction, in which the group velocity of em waves is equal to the phase velocity of acoustic waves, is analyzed and a set of basic equations of the system is derived via the reductive perturbation theory. We find new solutions of solitary types: bright solitons, kink solitons, and dark solitons as the solutions to these equations. An implication of the present theory on astrophysical plasma settings is suggested, including the cosmological relativistically hot electron-positron plasma.

  14. Fast-electron-relaxation measurement for laser-solid interaction at relativistic laser intensities. (United States)

    Chen, H; Shepherd, R; Chung, H K; Kemp, A; Hansen, S B; Wilks, S C; Ping, Y; Widmann, K; Fournier, K B; Dyer, G; Faenov, A; Pikuz, T; Beiersdorfer, P


    We present measurements of the fast-electron-relaxation time in short-pulse (0.5 ps) laser-solid interactions for laser intensities of 10(17), 10(18), and 10(19) Wcm2, using a picosecond time-resolved x-ray spectrometer and a time-integrated electron spectrometer. We find that the laser coupling to hot electrons increases as the laser intensity becomes relativistic, and that the thermalization of fast electrons occurs over time scales on the order of 10 ps at all laser intensities. The experimental data are analyzed using a combination of models that include Kalpha generation, collisional coupling, and plasma expansion.

  15. Interactive stereo electron microscopy enhanced with virtual reality

    Energy Technology Data Exchange (ETDEWEB)

    Bethel, E.Wes; Bastacky, S.Jacob; Schwartz, Kenneth S.


    An analytical system is presented that is used to take measurements of objects perceived in stereo image pairs obtained from a scanning electron microscope (SEM). Our system operates by presenting a single stereo view that contains stereo image data obtained from the SEM, along with geometric representations of two types of virtual measurement instruments, a ''protractor'' and a ''caliper''. The measurements obtained from this system are an integral part of a medical study evaluating surfactant, a liquid coating the inner surface of the lung which makes possible the process of breathing. Measurements of the curvature and contact angle of submicron diameter droplets of a fluorocarbon deposited on the surface of airways are performed in order to determine surface tension of the air/liquid interface. This approach has been extended to a microscopic level from the techniques of traditional surface science by measuring submicrometer rather than millimeter diameter droplets, as well as the lengths and curvature of cilia responsible for movement of the surfactant, the airway's protective liquid blanket. An earlier implementation of this approach for taking angle measurements from objects perceived in stereo image pairs using a virtual protractor is extended in this paper to include distance measurements and to use a unified view model. The system is built around a unified view model that is derived from microscope-specific parameters, such as focal length, visible area and magnification. The unified view model ensures that the underlying view models and resultant binocular parallax cues are consistent between synthetic and acquired imagery. When the view models are consistent, it is possible to take measurements of features that are not constrained to lie within the projection plane. The system is first calibrated using non-clinical data of known size and resolution. Using the SEM, stereo image pairs of grids and spheres of

  16. A wide dynamic range BF{sub 3} neutron monitor with front-end electronics based on a logarithmic amplifier

    Energy Technology Data Exchange (ETDEWEB)

    Ferrarini, M., E-mail: michele.ferrarini@polimi.i [Politecnico di Milano, Dipartimento Energia, via G. Ponzio 34/3, I-20133 Milano (Italy); Fondazione CNAO, via Caminadella 16, 20123 Milano (Italy); Varoli, V. [Politecnico di Milano, Dipartimento Energia, via G. Ponzio 34/3, I-20133 Milano (Italy); Favalli, A. [European Commission, Joint Research Centre, Institute for the Protection and Security of Citizen, TP 800, Via E. Fermi, 21027 Ispra (Vatican City State, Holy See) (Italy); Caresana, M. [Politecnico di Milano, Dipartimento Energia, via G. Ponzio 34/3, I-20133 Milano (Italy); Pedersen, B. [European Commission, Joint Research Centre, Institute for the Protection and Security of Citizen, TP 800, Via E. Fermi, 21027 Ispra (Italy)


    This paper describes a wide dynamic range neutron monitor based on a BF{sub 3} neutron detector. The detector is used in current mode, and front-end electronics based on a logarithmic amplifier are used in order to have a measurement capability ranging over many orders of magnitude. The system has been calibrated at the Polytechnic of Milan, CESNEF, with an AmBe neutron source, and has been tested in a pulsed field at the PUNITA facility at JRC, Ispra. The detector has achieved a dynamic range of over 6 orders of magnitude, being able to measure single neutron pulses and showing saturation-free response for a reaction rate up to 10{sup 6} s{sup -1}. It has also proved effective in measuring the PUNITA facility pulse integral fluence.

  17. Coherent Many-Body Spin Dynamics in a Long-Range Interacting Ising Chain

    DEFF Research Database (Denmark)

    Zeiher, Johannes; Choi, Jae-yoon; Rubio-Abadal, Antonio


    Coherent many-body quantum dynamics lies at the heart of quantum simulation and quantum computation. Both require coherent evolution in the exponentially large Hilbert space of an interacting many-body system. To date, trapped ions have defined the state of the art in terms of achievable coherence...... times in interacting spin chains. Here, we establish an alternative platform by reporting on the observation of coherent, fully interaction-driven quantum revivals of the magnetization in Rydberg-dressed Ising spin chains of atoms trapped in an optical lattice. We identify partialmany-body revivals...

  18. Aromatic amino acids required for pili conductivity and long-range extracellular electron transport in Geobacter sulfurreducens. (United States)

    Vargas, Madeline; Malvankar, Nikhil S; Tremblay, Pier-Luc; Leang, Ching; Smith, Jessica A; Patel, Pranav; Snoeyenbos-West, Oona; Synoeyenbos-West, Oona; Nevin, Kelly P; Lovley, Derek R


    It has been proposed that Geobacter sulfurreducens requires conductive pili for long-range electron transport to Fe(III) oxides and for high-density current production in microbial fuel cells. In order to investigate this further, we constructed a strain of G. sulfurreducens, designated Aro-5, which produced pili with diminished conductivity. This was accomplished by modifying the amino acid sequence of PilA, the structural pilin protein. An alanine was substituted for each of the five aromatic amino acids in the carboxyl terminus of PilA, the region in which G. sulfurreducens PilA differs most significantly from the PilAs of microorganisms incapable of long-range extracellular electron transport. Strain Aro-5 produced pili that were properly decorated with the multiheme c-type cytochrome OmcS, which is essential for Fe(III) oxide reduction. However, pili preparations of the Aro-5 strain had greatly diminished conductivity and Aro-5 cultures were severely limited in their capacity to reduce Fe(III) compared to the control strain. Current production of the Aro-5 strain, with a graphite anode serving as the electron acceptor, was less than 10% of that of the control strain. The conductivity of the Aro-5 biofilms was 10-fold lower than the control strain's. These results demonstrate that the pili of G. sulfurreducens must be conductive in order for the cells to be effective in extracellular long-range electron transport. Extracellular electron transfer by Geobacter species plays an important role in the biogeochemistry of soils and sediments and has a number of bioenergy applications. For example, microbial reduction of Fe(III) oxide is one of the most geochemically significant processes in anaerobic soils, aquatic sediments, and aquifers, and Geobacter organisms are often abundant in such environments. Geobacter sulfurreducens produces the highest current densities of any known pure culture, and close relatives are often the most abundant organisms colonizing anodes

  19. Analytical Determination of the Confinement Potential and Coupling Constant of Spin--Orbit Interactions of Electrons in Nanostructures

    CERN Document Server

    Dineykhan, M; Zhaugasheva, S A; Al Farabi Kazakh State National University. Almaty


    Multilayer nanocrystalline structure is represented by the electrostatic field inducted by total image charge, and the confinement potential for electrons is determined. Assuming that at a given distance the confinement potential is equal to the Coulomb repulsion and an interaction between electrons becomes spin-orbit, the constant of the spin-orbit interaction of electrons in nanostructures is determined. The dependence of the constant of the spin-orbit interaction on environment parameters and the distance between electrons is studied.

  20. Quantitative Assessment of MeV Electron Acceleration in Non-Linear Interactions with VLF Chorus (United States)

    Foster, J. C.; Erickson, P. J.; Omura, Y.; Baker, D. N.


    For occurrences of apparent rapid acceleration of radiation belt electrons to MeV energies at L 4, we examine the energy gained by seed electrons in non-linear (NL) interactions with VLF chorus rising tones. For the 17-18 March 2013 storm, observations of outer zone radiation belt electron populations were made with the magEIS and REPT instruments on Van Allen Probes A & B. These reveal that MeV electron fluxes at L=4.2 increased 10-fold in 30 min at the times of 30 - 100 keV electron injections during "substorm" dipolarizations. Simultaneous enhancements of VLF chorus were observed with the EMFISIS wave instruments. Three-axis burst mode observations of wave electric and magnetic fields have been used to investigate electron interactions with individual chorus rising tones on a sub millisecond time scale. Wave amplitudes at 2500 Hz were 1 nT (|B|) and 30 mV/m (|E|). Frequency - time characteristics of the observed chorus elements closely match those predicted by NL electron-chorus interaction modeling [Omura et al., 2015, J. Geophys. Res. Space Phys., 120, doi:10.1002/2015JA021563]. For seed electrons with initial energies 50 keV to 8 MeV, subpacket wave analysis was used to quantify resonant electron energy gain both by relativistic turning acceleration and by ultrarelativistic acceleration through nonlinear trapping by the chorus waves. Electrons with 1-2 MeV initial energy can experience a 300 keV total energy gain in NL interactions with a single 200 msec rising tone. Maximum energy gain from interaction with a single 10 msec subpacket was 100 keV for a 2 MeV seed electron. Examining a number of chorus elements at different locations during the rapid local acceleration of the radiation belt during this event, we conclude that seed electrons (100s keV - 5 MeV) can be accelerated by 50 keV - 500 keV in resonant NL interactions with a single VLF rising tone on a time scale of 10-100 msec.

  1. Condensation versus long-range interaction: Competing quantum phases in bosonic optical lattice systems at near-resonant Rydberg dressing (United States)

    Geißler, Andreas; Vasić, Ivana; Hofstetter, Walter


    Recent experiments have shown that (quasi)crystalline phases of Rydberg-dressed quantum many-body systems in optical lattices (OL) are within reach. Rydberg systems naturally possess strong long-range interactions due to the large polarizability of Rydberg atoms. Thus a wide range of quantum phases has been predicted, such as a devil's staircase of lattice-incommensurate density wave phases as well as the more exotic lattice supersolid order for bosonic systems, as considered in our work. Guided by results in the "frozen"-gas limit, we study the ground-state phase diagram at finite hopping amplitudes and in the vicinity of resonant Rydberg driving while fully including the long-range tail of the van der Waals interaction. Simulations within real-space bosonic dynamical mean-field theory yield an extension of the devil's staircase into the supersolid regime where the competition of condensation and interaction leads to a sequence of crystalline phases.

  2. Non-covalent interactions and thermochemistry using XDM-corrected hybrid and range-separated hybrid density functionals. (United States)

    Otero-de-la-Roza, A; Johnson, Erin R


    The exchange-hole dipole-moment model (XDM) for dispersion is combined with a collection of semilocal, hybrid, and range-separated hybrid functionals. The resulting XDM-corrected functionals are tested against standard benchmarks for non-covalent interactions at and away from equilibrium, conformer ranking in water clusters, thermochemistry, and kinetics. We show that functionals with the correct -1∕r tail of the exchange potential yield superior accuracy for weak interactions. Thus, balancing long-range exchange with dispersion interactions in XDM is essential in the correct description of dimers with significant non-dispersion contributions to binding. With the exception of the noble gases, the performance of PW86PBE-XDM is improved upon at the semilocal (BLYP), hybrid (B3LYP), and range-separated hybrid (LC-ωPBE) levels. Based on its excellent performance, we propose LC-ωPBE-XDM as an accurate functional for hard and soft matter.

  3. Interaction quench in the Holstein model: Thermalization crossover from electron- to phonon-dominated relaxation (United States)

    Murakami, Yuta; Werner, Philipp; Tsuji, Naoto; Aoki, Hideo


    We study the relaxation of the Holstein model after a sudden switch-on of the interaction by means of the nonequilibrium dynamical mean field theory, with the self-consistent Migdal approximation as an impurity solver. We show that there exists a qualitative change in the thermalization dynamics as the interaction is varied in the weak-coupling regime. On the weaker interaction side of this crossover, the phonon oscillations are damped more rapidly than the electron thermalization time scale, as determined from the relaxation of the electron momentum distribution function. On the stronger interaction side, the relaxation of the electrons becomes faster than the phonon damping. In this regime, despite long-lived phonon oscillations, a thermalized momentum distribution is realized temporarily. The origin of the "thermalization crossover" found here is traced back to different behaviors of the electron and phonon self-energies as a function of the electron-phonon coupling. In addition, the importance of the phonon dynamics is demonstrated by comparing the self-consistent Migdal results with those obtained with a simpler Hartree-Fock impurity solver that neglects the phonon self-energy. The latter scheme does not properly describe the evolution and thermalization of isolated electron-phonon systems.

  4. The interaction of O2 with the surface of polycrystalline gadolinium at the temperature range 300-670 K (United States)

    Cohen, S.; Shamir, N.; Mintz, M. H.; Jacob, I.; Zalkind, S.


    Auger-Electron-Spectroscopy (AES) and Direct-Recoils-Spectrometry (DRS) were applied to study the interaction of O2 with a polycrystalline gadolinium surface, in the temperature range 300-670 K and oxygen pressure up to 2 × 10- 6 Torr. It has been found that initial uptake of oxygen, at coverage measurable by the techniques used here, results in rapid oxide island formation. The subsurface is believed to be a mixture of oxide particles and oxygen dissolved in the Gd metal, the latter being the mobile species, even at relatively low temperatures.Enhanced inward diffusion of oxygen starts as early as 420 K and dictates the surface oxygen concentration and effective thickness of the forming oxide. The oxygen accumulation rate at the near-surface region, as measured by the O(KLL) AES signal intensity, goes through a maximum as a function of temperature at 420 K. This is a result of the combination of still efficient oxygen chemisorption that increases surface occupation and slow inward diffusion. The thickest oxide, ~ 1.7 nm, is formed at 300 K and its effective thickness was found to decrease with increasing temperature (due to oxygen dissolution into the metal bulk).Diffusion coefficients of the oxygen dissolution into the bulk were evaluated for various temperatures utilizing models for infinitely thin oxide layer and thick oxide layer, respectively. The best fit under our experimental procedure was obtained by the thick layer model, and the coefficients that were calculated are D0 = 2.2 × 10- 16m2s- 1 and Ea = 46kJ/mol.

  5. Exploring the Interaction Natures in Plutonyl (VI) Complexes with Topological Analyses of Electron Density. (United States)

    Du, Jiguang; Sun, Xiyuan; Jiang, Gang


    The interaction natures between Pu and different ligands in several plutonyl (VI) complexes are investigated by performing topological analyses of electron density. The geometrical structures in both gaseous and aqueous phases are obtained with B3LYP functional, and are generally in agreement with available theoretical and experimental results when combined with all-electron segmented all-electron relativistic contracted (SARC) basis set. The Pu- O y l bond orders show significant linear dependence on bond length and the charge of oxygen atoms in plutonyl moiety. The closed-shell interactions were identified for Pu-Ligand bonds in most complexes with quantum theory of atoms in molecules (QTAIM) analyses. Meanwhile, we found that some Pu-Ligand bonds, like Pu-OH(-), show weak covalent. The interactive nature of Pu-ligand bonds were revealed based on the interaction quantum atom (IQA) energy decomposition approach, and our results indicate that all Pu-Ligand interactions is dominated by the electrostatic attraction interaction as expected. Meanwhile it is also important to note that the quantum mechanical exchange-correlation contributions can not be ignored. By means of the non-covalent interaction (NCI) approach it has been found that some weak and repulsion interactions existed in plutonyl(VI) complexes, which can not be distinguished by QTAIM, can be successfully identified.

  6. Exploring the Interaction Natures in Plutonyl (VI Complexes with Topological Analyses of Electron Density

    Directory of Open Access Journals (Sweden)

    Jiguang Du


    Full Text Available The interaction natures between Pu and different ligands in several plutonyl (VI complexes are investigated by performing topological analyses of electron density. The geometrical structures in both gaseous and aqueous phases are obtained with B3LYP functional, and are generally in agreement with available theoretical and experimental results when combined with all-electron segmented all-electron relativistic contracted (SARC basis set. The Pu– O y l bond orders show significant linear dependence on bond length and the charge of oxygen atoms in plutonyl moiety. The closed-shell interactions were identified for Pu-Ligand bonds in most complexes with quantum theory of atoms in molecules (QTAIM analyses. Meanwhile, we found that some Pu–Ligand bonds, like Pu–OH−, show weak covalent. The interactive nature of Pu–ligand bonds were revealed based on the interaction quantum atom (IQA energy decomposition approach, and our results indicate that all Pu–Ligand interactions is dominated by the electrostatic attraction interaction as expected. Meanwhile it is also important to note that the quantum mechanical exchange-correlation contributions can not be ignored. By means of the non-covalent interaction (NCI approach it has been found that some weak and repulsion interactions existed in plutonyl(VI complexes, which can not be distinguished by QTAIM, can be successfully identified.

  7. Hepatitis C virus RNA: molecular switches mediated by long-range RNA-RNA interactions? (United States)

    Shetty, Sumangala; Stefanovic, Snezana; Mihailescu, Mihaela Rita


    Multiple conserved structural cis-acting regulatory elements have been recognized both in the coding and untranslated regions (UTRs) of the hepatitis C virus (HCV) genome. For example, the cis-element 5BSL3.2 in the HCV-coding region has been predicted to use both its apical and internal loops to interact with the X RNA in the 3'-UTR, with the IIId domain in the 5'-UTR and with the Alt sequence in the coding region. Additionally, the X RNA region uses a palindromic sequence that overlaps the sequence required for the interaction with 5BSL3.2, to dimerize with another HCV genome. The ability of the 5BSL3.2 and X RNA regions to engage in multi-interactions suggests the existence of one or more molecular RNA switches which may regulate different steps of the HCV life cycle. In this study, we used biophysical methods to characterize the essential interactions of these HCV cis-elements at the molecular level. Our results indicate that X RNA interacts with 5BSL3.2 and another X RNA molecule by adopting two different conformations and that 5BSL3.2 engages simultaneously in kissing interactions using its apical and internal loops. Based on these results, we propose a mode of action for possible molecular switches involving the HCV RNA.

  8. Spin-polarized free electron beam interaction with radiation and superradiant spin-flip radiative emission

    Directory of Open Access Journals (Sweden)

    A. Gover


    Full Text Available The problems of spin-polarized free-electron beam interaction with electromagnetic wave at electron-spin resonance conditions in a magnetic field and of superradiant spin-flip radiative emission are analyzed in the framework of a comprehensive classical model. The spontaneous emission of spin-flip radiation from electron beams is very weak. We show that the detectivity of electron spin resonant spin-flip and combined spin-flip/cyclotron-resonance-emission radiation can be substantially enhanced by operating with ultrashort spin-polarized electron beam bunches under conditions of superradiant (coherent emission. The proposed radiative spin-state modulation and the spin-flip radiative emission schemes can be used for control and noninvasive diagnostics of polarized electron/positron beams. Such schemes are of relevance in important scattering experiments off nucleons in nuclear physics and off magnetic targets in condensed matter physics.

  9. Electron-phonon interaction in three-barrier nanosystems as active elements of quantum cascade detectors

    Energy Technology Data Exchange (ETDEWEB)

    Tkach, N. V., E-mail:; Seti, Ju. A.; Grynyshyn, Yu. B. [Chernivtsy National University (Ukraine)


    The theory of electron tunneling through an open nanostructure as an active element of a quantum cascade detector is developed, which takes into account the interaction of electrons with confined and interface phonons. Using the method of finite-temperature Green’s functions and the electron-phonon Hamiltonian in the representation of second quantization over all system variables, the temperature shifts and electron-level widths are calculated and the contributions of different electron-phonon-interaction mechanisms to renormalization of the spectral parameters are analyzed depending on the geometrical configuration of the nanosystem. Due to weak electron-phonon coupling in a GaAs/Al{sub 0.34}Ga{sub 0.66}As-based resonant tunneling nanostructure, the temperature shift and rf field absorption peak width are not very sensitive to the electron-phonon interaction and result from a decrease in potential barrier heights caused by a difference in the temperature dependences of the well and barrier band gaps.

  10. Evidence for the absence of electron-electron Coulomb interaction quantum correction to the anomalous Hall effect in Co2FeSi Heusler-alloy thin films (United States)

    Hazra, Binoy Krishna; Kaul, S. N.; Srinath, S.; Raja, M. Manivel; Rawat, R.; Lakhani, Archana


    Electrical (longitudinal) resistivity ρx x, at H =0 and H =80 kOe, anomalous Hall resistivity ρxy A H, and magnetization M , have been measured at different temperatures in the range 5-300 K on the Co2FeSi (CFS) Heusler-alloy thin films, grown on Si(111) substrate, with thickness ranging from 12 to 100 nm. At fixed fields H =0 and H =80 kOe, ρx x(T ) goes through a minimum at T =Tmin (which depends on the film thickness) in all the CFS thin films. In sharp contrast, both the anomalous Hall coefficient RA and ρxy A H monotonously increase with temperature without exhibiting a minimum. Elaborate analyses of ρx x, RA, and ρxy A H establishes the following. (i) The enhanced electron-electron Coulomb interaction (EEI) quantum correction (QC) is solely responsible for the upturn in "zero-field" and "in-field" ρx x(T ) at T value of 103 S/cm when the Fermi level is located near the anticrossing of band dispersions split by spin-orbit interaction. This suppression is shown to correspond to one or both of the possibilities: the resonance condition is not satisfied, or the interband spin-flip inelastic electron-magnon scattering enhances the side-jump contribution at the expense of the intrinsic contribution. We demonstrate that RA, or equivalently ρxy A H, scales with ρx x T, the temperature-dependent part of ρx x, over a considerably wide temperature range (5-300 K) only when ρxy A H is corrected for the observed temperature dependence of spontaneous magnetization and ρx x for the EEI effects.

  11. Coherent diffraction and Cherenkov radiation of relativistic electrons from a dielectric target in the millimeter wavelength range

    Energy Technology Data Exchange (ETDEWEB)

    Bleko, V.V., E-mail:; Konkov, A.S., E-mail:; Soboleva, V.V.


    The coherent diffraction radiation (DR) and Cherenkov radiation (ChR) emitted by bunched electron beam of 6.1 MeV passing near a flat dielectric target have been observed in the millimeter wavelength range. The simple geometry of experiment allows testing different theoretical approaches, which consider the process of simultaneous emission of DR and ChR from dielectric targets. Properties of the radiation have been experimentally investigated in far-field zone. The angular distribution of the observed radiation at various tilt angles of the target in respect to the electron beam have shown the effect of interference between DR and ChR. The comparison of experimental results with the theoretical calculations based on the approach of polarization currents has been done.

  12. Block-copolymer-induced long-range depletion interaction and clustering of silica nanoparticles in aqueous solution (United States)

    Kumar, Sugam; Lee, M.-J.; Aswal, V. K.; Choi, S.-M.


    Small-angle neutron scattering (SANS) has been carried out to examine the block-copolymer-induced depletion interaction of charged silica nanoparticles in aqueous solution. The measurements have been performed on fixed concentrations (1 and 10 wt. %) of anionic Ludox silica nanoparticles having sizes of 8 and 16 nm in the presence of 0.1M NaCl and varying concentration of polyethylene oxide-polypropylene oxide-polyethylene oxide P85 [(EO)26(PO)39(EO)26] block copolymer. The presence of the block copolymer induces an attractive depletion interaction between charge-stabilized nanoparticles. The effective interaction of silica nanoparticles is modeled by a combination of two Yukawa potentials accounting for attractive depletion and repulsive electrostatic forces. The depletion interaction is found to be a long-range attraction whose magnitude and range increase with block-copolymer concentration. The depletion interaction is further enhanced by tuning the self-assembly of the block copolymer through the variation of temperature. The increase of the depletion interaction ultimately leads to clustering of nanoparticles and is confirmed by the presence of a Bragg peak in the SANS data. The positioning of the Bragg peak suggests simple-cubic-type packing of particles within the clusters. The scattering from the clusters in the low-Q region is governed by the Porod scattering, indicating that clusters are quite large (order of microns). The depletion interaction is also found to be strongly dependent on the size of the nanoparticles.

  13. Collagen mimetic peptide discs promote assembly of a broad range of natural protein fibers through hydrophobic interactions. (United States)

    McGuinness, Kenneth; Nanda, Vikas


    Collagen mimetic peptides that alone formed two-dimensional nanoscale discs driven by hydrophobic interactions were shown in electron microscopy studies to also co-assemble with natural fibrous proteins to produce discs-on-a-string (DoS) nanostructures. In most cases, peptide discs also facilitated bundling of the protein fibers. This provides insight into how synthetic and natural proteins may be combined to develop multicomponent, multi-dimensional architectures at the nanoscale.

  14. Electronic metal-support interaction enhanced oxygen reduction activity and stability of boron carbide supported platinum (United States)

    Jackson, Colleen; Smith, Graham T.; Inwood, David W.; Leach, Andrew S.; Whalley, Penny S.; Callisti, Mauro; Polcar, Tomas; Russell, Andrea E.; Levecque, Pieter; Kramer, Denis


    Catalysing the reduction of oxygen in acidic media is a standing challenge. Although activity of platinum, the most active metal, can be substantially improved by alloying, alloy stability remains a concern. Here we report that platinum nanoparticles supported on graphite-rich boron carbide show a 50-100% increase in activity in acidic media and improved cycle stability compared to commercial carbon supported platinum nanoparticles. Transmission electron microscopy and x-ray absorption fine structure analysis confirm similar platinum nanoparticle shapes, sizes, lattice parameters, and cluster packing on both supports, while x-ray photoelectron and absorption spectroscopy demonstrate a change in electronic structure. This shows that purely electronic metal-support interactions can significantly improve oxygen reduction activity without inducing shape, alloying or strain effects and without compromising stability. Optimizing the electronic interaction between the catalyst and support is, therefore, a promising approach for advanced electrocatalysts where optimizing the catalytic nanoparticles themselves is constrained by other concerns.

  15. Total projectile electron loss cross sections of U^{28+} ions in collisions with gaseous targets ranging from hydrogen to krypton

    Directory of Open Access Journals (Sweden)

    G. Weber


    Full Text Available Beam lifetimes of stored U^{28+} ions with kinetic energies of 30 and 50  MeV/u, respectively, were measured in the experimental storage ring of the GSI accelerator facility. By using the internal gas target station of the experimental storage ring, it was possible to obtain total projectile electron loss cross sections for collisions with several gaseous targets ranging from hydrogen to krypton from the beam lifetime data. The resulting experimental cross sections are compared to predictions by two theoretical approaches, namely the CTMC method and a combination of the DEPOSIT code and the RICODE program.

  16. Ranges, Reflection and Secondary Electron Emission for keV Hydrogen Ions Incident on Solid N2

    DEFF Research Database (Denmark)

    Børgesen, P.; Sørensen, H.; Hao-Ming, Chen


    Ranges were measured for 0.67–3.3 keV/amu hydrogen and deuterium ions in solid N2. Comparisons with similar results for N2-gas confirm the previously observed large phase effect in the stopping cross section. Measurements of the secondary electron emission coefficient for bulk solid N2 bombarded...... by 0.67–9 keV/amu ions also seem to support such a phase effect. It is argued that we may also extract information about the charge state of reflected projectiles....

  17. Quantifying electron transfer reactions in biological systems: what interactions play the major role?


    Emil Sjulstok; Jógvan Magnus Haugaard Olsen; Ilia A. Solov’yov


    Various biological processes involve the conversion of energy into forms that are usable for chemical transformations and are quantum mechanical in nature. Such processes involve light absorption, excited electronic states formation, excitation energy transfer, electrons and protons tunnelling which for example occur in photosynthesis, cellular respiration, DNA repair, and possibly magnetic field sensing. Quantum biology uses computation to model biological interactions in light of quantum me...

  18. Analysis of low energy electron emission arising during slow multicharged ion-surface interactions

    Energy Technology Data Exchange (ETDEWEB)

    Emmichoven, P.A.Z.v. (Oak Ridge National Laboratory, Oak Ridge, TN 37831-6372 (United States) Joint Institute for Heavy Ion Research, Holified Heavy Ion Research Facility, Oak Ridge, TN 37831-6734 (United States)); Havener, C.C. (Oak Ridge National Laboratory, Oak Ridge, TN 37831-6372 (United States)); Hughes, I.G. (Oak Ridge National Laboratory, Oak Ridge, TN 37831-6372 (United States) Joint Institute for Heavy Ion Research, Holifield Heavy Ion Research Facility, Oak Ridge, TN 37831-6374 (United States)); Zehner, D.M.; Meyer, F.W. (Oak Ridge National Laboratory, Oak Ridge, TN 37831-6732 (United States))


    We have undertaken a search for low energy electrons expected to arise in low energy multicharged ion-surface interactions when electrons captured into Rydberg levels of the projectile are promoted to the continuum as the projectile impacts the surface. Measurements are presented for 30--100 keV N[sup 2+] -N[sup 6+] ions incident at 20[degree] with the surface on Cu(001) and Au(011) single crystals, for a series of observation angles.

  19. Analysis of low energy electron emission arising during slow multicharged ion-surface interactions

    Energy Technology Data Exchange (ETDEWEB)

    Zeijlmans van Emmichoven, P.A.; Hughes, I.G. (Oak Ridge National Lab., TN (United States) Joint Institute for Heavy Ion Research, Holifield Heavy Ion Research Facility, Oak Ridge, TN (United States)); Havener, C.C.; Zehner, D.M.; Meyer, F.W. (Oak Ridge National Lab., TN (United States))


    We have undertaken a search for low energy electrons expected to arise in low energy multicharged ion-surface interactions when electrons captured into Rydberg levels of the projectile are promoted to the continuum as the projectile impacts the surface. Measurements are presented for 30--100 keV N{sup 2+} -- N{sup 6+} ions incident at 20{sup o} with the surface on Cu(001) and Au(0ll) single crystals, for a series of observation angles.

  20. Extending the range and physical accuracy of coarse-grained models: Order parameter dependent interactions (United States)

    Wagner, Jacob W.; Dannenhoffer-Lafage, Thomas; Jin, Jaehyeok; Voth, Gregory A.


    Order parameters (i.e., collective variables) are often used to describe the behavior of systems as they capture different features of the free energy surface. Yet, most coarse-grained (CG) models only employ two- or three-body non-bonded interactions between the CG particles. In situations where these interactions are insufficient for the CG model to reproduce the structural distributions of the underlying fine-grained (FG) model, additional interactions must be included. In this paper, we introduce an approach to expand the basis sets available in the multiscale coarse-graining (MS-CG) methodology by including order parameters. Then, we investigate the ability of an additive local order parameter (e.g., density) and an additive global order parameter (i.e., distance from a hard wall) to improve the description of CG models in interfacial systems. Specifically, we study methanol liquid-vapor coexistence, acetonitrile liquid-vapor coexistence, and acetonitrile liquid confined by hard-wall plates, all using single site CG models. We find that the use of order parameters dramatically improves the reproduction of structural properties of interfacial CG systems relative to the FG reference as compared with pairwise CG interactions alone.

  1. Electron-phonon interaction and pairing mechanism in superconducting Ca-intercalated bilayer graphene. (United States)

    Margine, E R; Lambert, Henry; Giustino, Feliciano


    Using the ab initio anisotropic Eliashberg theory including Coulomb interactions, we investigate the electron-phonon interaction and the pairing mechanism in the recently-reported superconducting Ca-intercalated bilayer graphene. We find that C6CaC6 can support phonon-mediated superconductivity with a critical temperature Tc = 6.8-8.1 K, in good agreement with experimental data. Our calculations indicate that the low-energy Caxy vibrations are critical to the pairing, and that it should be possible to resolve two distinct superconducting gaps on the electron and hole Fermi surface pockets.

  2. The role of electron-phonon interactions on the coherence lifetime of monolayer transition metal dichalcogenides (United States)

    Stevens, C. E.; Dey, P.; Paul, J.; Wang, Z.; Zhang, H.; Romero, A. H.; Shan, J.; Hilton, D. J.; Karaiskaj, D.


    We investigate the excitonic dephasing of transition metal dichalcogenides, namely MoS2, MoSe2 and WSe2 atomic monolayer thick and bulk crystals, in order to understand the factors that determine the optical coherence in these materials. Coherent nonlinear optical spectroscopy, temperature dependent absorption combined with theoretical calculations of the phonon spectra, reveal the important role electron-phonon interactions plat in dephasing process. The temperature dependence of the electronic band gap and the excitonic linewidth combined with 'ab initio' calculations of the phonon energies and the phonon density of state reveal strong interaction with the E‧ and E″ phonon modes.

  3. Optical transitions and electronic interactions in self-assembled cobalt-fullerene mixture films (United States)

    Lavrentiev, V.; Chvostova, D.; Lavrentieva, I.; Vacik, J.; Daskal, Ye; Barchuk, M.; Rafaja, D.; Dejneka, A.


    Optical spectra of Co x C60 mixture films (x  <  10) were studied in order to obtain insights into electronic interactions in an organometallic system that is attractive for spin-transfer electronics. The optical absorption (OA) spectra were described in terms of the Lorentz oscillators model, allowing the quantification of the spectral variations driven by Co concentration x. The variations are found to be most pronounced for 0  <  x  <  2–4, suggesting the effects of the electronic interactions in the Co2C60 fulleride formed in the mixture. The Co–C60 electronic interactions evidenced by the OA edge shift and by the OA peak detected at approximately 1 eV give rise to the Jahn–Teller (JT) splitting of the t 1u electronic levels in C60 occupied by the electrons transferred from Co. The JT effect was confirmed by observation of the downshifted T 1u(4) infrared-active mode modified by electron–phonon coupling at the t 1u levels.

  4. Ultrafast Gap Dynamics and Electronic Interactions in a Photoexcited Cuprate Superconductor

    Directory of Open Access Journals (Sweden)

    S. Parham


    Full Text Available We perform time- and angle-resolved photoemission spectroscopy (trARPES on optimally doped Bi_{2}Sr_{2}CaCu_{2}O_{8+δ} (BSCCO-2212 using sufficient energy resolution (9 meV to resolve the k-dependent near-nodal gap structure on time scales where the concept of an electronic pseudotemperature is a useful quantity, i.e., after electronic thermalization has occurred. We study the ultrafast evolution of this gap structure, uncovering a very rich landscape of decay rates as a function of angle, temperature, and energy. We explicitly focus on the quasiparticle states at the gap edge as well as on the spectral weight inside the gap that “fills” the gap—understood as an interaction, or self-energy effect—and we also make high resolution measurements of the nodal states, enabling a direct and accurate measurement of the electronic temperature (or pseudotemperature of the electrons in the system. Rather than the standard method of interpreting these results using individual quasiparticle scattering rates that vary significantly as a function of angle, temperature, and energy, we show that the entire landscape of relaxations can be understood by modeling the system as following a nonequilibrium, electronic pseudotemperature that controls all electrons in the zone. Furthermore, this model has zero free parameters, as we obtain the crucial information of the SC gap Δ and the gap-filling strength Γ_{TDoS} by connecting to static ARPES measurements. The quantitative and qualitative agreement between data and model suggests that the critical parameters and interactions of the system, including the pairing interactions, follow parametrically from the electronic pseudotemperature. We expect that this concept will be relevant for understanding the ultrafast response of a great variety of electronic materials, even though the electronic pseudotemperature may not be directly measurable.

  5. Long-range interactions of excited He atoms with the alkaline earth atoms Mg, Ca, and Sr

    KAUST Repository

    Zhang, J.-Y.


    Dispersion coefficients for the long-range interactions of the first four excited states of He, i.e., He(2 1, 3 S) and He(2 1, 3 P), with the low-lying states of the alkaline earth atoms Mg, Ca, and Sr are calculated by summing over the reduced matrix elements of multipole transition operators.

  6. The multitrophic consequences of concurrent insect invasions: a range-expanding herbivore and its associated parasitoid affect native tritrophic interactions (United States)

    Global climatic changes may lead to the arrival of range-expanding species into new environments. Species from different trophic levels sharing the same climatic niche may invade new habitats simultaneously or in quick succession, causing the formation of multiple novel interactions into native food...

  7. Real space probe of short-range interaction between Cr in a ferromagnetic semiconductor ZnCrTe. (United States)

    Kanazawa, Ken; Nishimura, Taku; Yoshida, Shoji; Shigekawa, Hidemi; Kuroda, Shinji


    The short-range interaction between Cr atoms was directly examined by scanning tunneling microscopy measurements on a Zn(0.95)Cr(0.05)Te film. Our measurements revealed that a Cr atom formed a localized state within the bandgap of ZnTe and this state was broadened for a pair of Cr atoms within a distance of ∼ 1 nm.

  8. Quantum Monte Carlo study of the two-dimensional electron gas in presence of Rashba interaction (United States)

    Ambrosetti, A.; Pederiva, F.; Lipparini, E.; Gandolfi, S.


    We introduce a variant to the diffusion Monte Carlo algorithm that can be employed to study the effects of the Rashba interaction in many-electron systems. Because of the spin-orbit nature of Rashba interaction a standard algorithm cannot be applied and therefore a specific imaginary time spin-dependent propagator has been developed and implemented following previous work developed in the framework of nuclear physics. We computed the ground-state energy of the two-dimensional electron gas at different densities for several values of the Rashba interaction strength as a function of “Rashba spin states” polarization. Comparison is given with analytically known Hartree-Fock results and for the system in absence of Coulomb interaction.

  9. Electron paramagnetic resonance and transmission electron microscopy study of the interactions between asbestiform zeolite fibers and model membranes. (United States)

    Cangiotti, Michela; Battistelli, Michela; Salucci, Sara; Falcieri, Elisabetta; Mattioli, Michele; Giordani, Matteo; Ottaviani, Maria Francesca


    Different asbestiform zeolite fibers of the erionite (termed GF1 and MD8, demonstrated carcinogenic) and offretite (termed BV12, suspected carcinogenic) families were investigated by analyzing the electron paramagnetic resonance (EPR) spectra of selected surfactant spin probes and transmission electron microscopy (TEM) images in the presence of model membranes-cetyltrimethylammonium (CTAB) micelles, egg-lecithin liposomes, and dimyristoylphosphatidylcholine (DMPC) liposomes. This was undertaken to obtain information on interactions occurring at a molecular level between fibers and membranes which correlate with entrance of fibers into the membrane model or location of the fibers at the external or internal membrane interfaces. For CTAB micelles, all fibers were able to enter the micelles, but the hair-like structure and chemical surface characteristics of GF1 modified the micelle structure toward a bilayer-like organization, while MD8 and BV12, being shorter fibers and with a high density of surface interacting groups, partially destroyed the micelles. For liposomes, GF1 fibers partially penetrated the core solution, but DMPC liposomes showed increasing rigidity and organization of the bilayer. Conversely, for MD8 and BV12, the fibers did not cross the membrane demonstrating a smaller membrane structure perturbation. Scolecite fibers (termed SC1), used for comparison, presented poor interactions with the model membranes. The carcinogenicity of the zeolites, as postulated in the series SC1fibers.

  10. High flux, narrow bandwidth compton light sources via extended laser-electron interactions (United States)

    Barty, V P


    New configurations of lasers and electron beams efficiently and robustly produce high flux beams of bright, tunable, polarized quasi-monoenergetic x-rays and gamma-rays via laser-Compton scattering. Specifically, the use of long-duration, pulsed lasers and closely-spaced, low-charge and low emittance bunches of electron beams increase the spectral flux of the Compton-scattered x-rays and gamma rays, increase efficiency of the laser-electron interaction and significantly reduce the overall complexity of Compton based light sources.

  11. Effect of electron-phonon interaction on resistivity of some heavy fermion (HF) systems

    Energy Technology Data Exchange (ETDEWEB)

    Sahoo, J., E-mail: [Assistant Director, Regional Office of Vocational Education, Sambalpur, Odisha-768004 (India); Shadangi, N. [Dept. of Physics, Silicon Institute of Technology, Sambalpur, Odisha-768200 (India); Nayak, P. [School of Physics, Sambalpur University, Sambalpur, Odisha-768019 (India)


    Here, we have analyzed the electron-phonon interaction in the Periodic Anderson Model (PAM) to describe the temperature dependence of resistivity in some heavy fermion (HF) systems for finite wave vector (q) and for finite temperature (T). Since the resistivity is related to the imaginary part of the electron self energy, the expression for the same is evaluated through double time temperature dependant Green function technique of the Zubarev type. The effect of different system parameters namely the position of 4f level, E{sub 0} and the electron - phonon coupling strengths on resistivity have been studied. The results obtained give satisfactory explanations to the experimental observations.

  12. Electromagnetic microwaves in metal films with electron-phonon interaction and a dc magnetic field

    DEFF Research Database (Denmark)

    Hasselberg, L.E.


    A quantum-mechanical treatment of electromagnetic microwaves is performed for a metal film. The directions of the exterior ac and dc fields are taken to be arbitrary and boundary conditions for the electrons are assumed to be specular. The relation between the current and the electromagnetic fiel...... in the transmission spectrum can perhaps be obtained by assuming a finite Debye temperature and specular reflections of the electrons at the boundary surfaces. A sharp peak entirely caused by the finite electron-phonon interaction is also discussed....

  13. Sub-picosecond snapshots of fast electrons from high intensity laser-matter interactions. (United States)

    Pompili, R; Anania, M P; Bisesto, F; Botton, M; Castellano, M; Chiadroni, E; Cianchi, A; Curcio, A; Ferrario, M; Galletti, M; Henis, Z; Petrarca, M; Schleifer, E; Zigler, A


    The interaction of a high-intensity short-pulse laser with thin solid targets produces electron jets that escape the target and positively charge it, leading to the formation of the electrostatic potential that in turn governs the ion acceleration. The typical timescale of such phenomena is on the sub-picosecond level. Here we show, for the first time, temporally-resolved measurements of the first released electrons that escaped from the target, so-called fast electrons. Their total charge, energy and temporal profile are provided by means of a diagnostics based on Electro-Optical Sampling with temporal resolution below 100 fs.

  14. Searches for possible T-odd and P-odd short range interactions using polarized nuclei

    Directory of Open Access Journals (Sweden)

    Chu P. H.


    Full Text Available Various theories predict the possible existence of T-odd and P-odd shortrange forces between spin ½ fermions, proportional to S・r where S is the fermion spin and r is the separation between particles. We use ensembles of polarized nuclei and an un-polarized mass to search for such a force over sub-mm ranges. We established an improved upper bound on the product gsgpn of the scalar coupling to particles in the un-polarized mass and the pseudo-scalar coupling of polarized neutrons for force ranges from 10−4 to 10−2 m, corresponding to a mass range of 2・10−3 to 2・10−5 eV for the exchange boson [1].

  15. Time-resolved photoemission electron microscopy imaging of mode coupling between three interacting magnetic vortices

    Energy Technology Data Exchange (ETDEWEB)

    Wang, Xiao; Cheng, X. M., E-mail: [Department of Physics, Bryn Mawr College, Bryn Mawr, Pennsylvania 19010 (United States); Keavney, D. J. [Advanced Photon Source, Argonne National Laboratory, Argonne, Illinois 60439 (United States); Asmat-Uceda, M.; Buchanan, K. S. [Department of Physics, Colorado State University, Fort Collins, Colorado 80523 (United States); Melikyan, A. [American Physical Society, Ridge, New York 11961 (United States)


    The interactions between three magnetic vortices in a planar equilateral triangular arrangement were studied by time-resolved photoemission electron microscopy. The gyrotropic resonance frequencies of the three individual vortices in the tri-disk system are different from one another and also shifted from that of an isolated vortex by as much as 12%. A comparison with analytical calculations and numerical simulations shows that the observed frequency shifts result from the dipolar interaction between the vortices.

  16. Interaction studies between periplasmic cytochromes provide insights into extracellular electron transfer pathways of Geobacter sulfurreducens. (United States)

    Fernandes, Ana P; Nunes, Tiago C; Paquete, Catarina M; Salgueiro, Carlos A


    Geobacter bacteria usually prevail among other microorganisms in soils and sediments where Fe(III) reduction has a central role. This reduction is achieved by extracellular electron transfer (EET), where the electrons are exported from the interior of the cell to the surrounding environment. Periplasmic cytochromes play an important role in establishing an interface between inner and outer membrane electron transfer components. In addition, periplasmic cytochromes, in particular nanowire cytochromes that contain at least 12 haem groups, have been proposed to play a role in electron storage in conditions of an environmental lack of electron acceptors. Up to date, no redox partners have been identified in Geobacter sulfurreducens, and concomitantly, the EET and electron storage mechanisms remain unclear. In this work, NMR chemical shift perturbation measurements were used to probe for an interaction between the most abundant periplasmic cytochrome PpcA and the dodecahaem cytochrome GSU1996, one of the proposed nanowire cytochromes in G. sulfurreducens The perturbations on the haem methyl signals of GSU1996 and PpcA showed that the proteins form a transient redox complex in an interface that involves haem groups from two different domains located at the C-terminal of GSU1996. Overall, the present study provides for the first time a clear evidence for an interaction between periplasmic cytochromes that might be relevant for the EET and electron storage pathways in G. sulfurreducens. © 2017 The Author(s); published by Portland Press Limited on behalf of the Biochemical Society.

  17. Protein-nanoparticle interaction in bioconjugated silver nanoparticles: A transmission electron microscopy and surface enhanced Raman spectroscopy study (United States)

    Reymond-Laruinaz, Sébastien; Saviot, Lucien; Potin, Valérie; Marco de Lucas, María del Carmen


    Understanding the mechanisms of interaction between proteins and noble metal nanoparticles (NPs) is crucial to extend the use of NPs in biological applications and nanomedicine. We report the synthesis of Ag-NPs:protein bioconjugates synthesized in total absence of citrates or other stabilizing agents in order to study the NP-protein interaction. Four common proteins (lysozyme, bovine serum albumin, cytochrome-C and hemoglobin) were used in this work. Transmission electron microscopy (TEM) and surface enhanced Raman spectroscopy (SERS) were mainly used to study these bioconjugated NPs. TEM images showed Ag NPs with sizes in the 5-40 nm range. The presence of a protein layer surrounding the Ag NPs was also observed by TEM. Moreover, the composition at different points of single bioconjugated NPs was probed by electron energy loss spectroscopy (EELS). The thickness of the protein layer varies in the 3-15 nm range and the Ag NPs are a few nanometers away. This allowed to obtain an enhancement of the Raman signal of the proteins in the analysis of water suspensions of bioconjugates. SERS results showed a broadening of the Raman bands of the proteins which we attribute to the contribution of different configurations of the proteins adsorbed on the Ag NPs surface. Moreover, the assignment of an intense and sharp peak in the low-frequency range to Ag-N vibrations points to the chemisorption of the proteins on the Ag-NPs surface.

  18. Disordered non-interacting electronic systems near criticality in two dimensions (United States)

    Bhardwaj, Shanthanu

    The nature of the plateau transition in the integer quantum Hall (IQH) effect is an intriguing problem that has been the focus of intense experimental and theoretical research. The vast majority of existing theories of the IQH effect focus on models of non-interacting electrons in a strong magnetic field subject to disorder. There are two complementary approaches to this problem -- the first, a field-theoretic approach, was developed for short-range (Gaussian white-noise) disorder, where the correlation length of the disorder potential is much shorter than the magnetic length. A different, ``network model'', approach was developed for strong magnetic fields and smooth disorder where the correlation length is much longer than the magnetic length. In this thesis, we will initially use the former approach to calculate the multifractal exponents of the wavefunction in the IQH state in the bulk as well as near the boundary. The rest of the thesis will focus on using the network model approach to study the IQH and spin quantum Hall effect by mapping the network models to a superspin ladder and then studying this system as well as the sigma model which is its continuum limit.

  19. Long-range rapidity correlations in soft interactions at high energies

    Energy Technology Data Exchange (ETDEWEB)

    Gotsman, E.; Maor, U. [Tel Aviv University, Department of Particle Physics, School of Physics and Astronomy, Raymond and Beverly Sackler Faculty of Exact Science, Tel Aviv (Israel); Levin, E. [Tel Aviv University, Department of Particle Physics, School of Physics and Astronomy, Raymond and Beverly Sackler Faculty of Exact Science, Tel Aviv (Israel); Universidad Tecnica Federico Santa Maria and Centro Cientifico-Tecnologico de Valparaiso, Departamento de Fisica, Valparaiso (Chile)


    In this paper we take the next step (following the successful description of inclusive hadron production) in describing the structure of the bias events without the aid of Monte Carlo codes. Two new results are presented: (i) a method for calculating the two particle correlation functions in the BFKL pomeron calculus in zero transverse dimension; and (ii) an estimation of the values of these correlations in a model of soft interactions. Comparison with the multiplicity data at the LHC is given. (orig.)

  20. Measurement of cervical range of motion (CROM) by electronic CROM goniometer: a test of reliability and validity. (United States)

    Law, Ellis Yuk Hung; Chiu, Thomas Tai-Wing


    To investigate the reliability and validity of the Electronic Cervical Range of Motion (CROM) Goniometer in measurement of cervical spine mobility in adults with and without neck pain. A cross-sectional reliability study was conducted on 54 subjects (26 neck pain and 26 non-neck pain) aged from 20-70 years old. The Numerical Pain Rating Scale and Chinese version of Northwick Park Neck Pain Questionnaire were used to assess neck pain severity and disability respectively. The CROM was measured in sitting position except left to right rotation was measured in supine lying. All the cervical active movements were measured by using the Electronic CROM Goniometer from ARCON TM Functional Capacity Evaluation (FCE) systems. The intra-tester and inter-tester reliability were high in both normal and chronic neck pain groups with ICC coefficients ranged from 0.75-*0.92. There was significant difference in the total CROM between the normal (374.7°) and chronic neck pain group (292.6°). The ACRON cervical goniometer was found to be reliable for measuring cervical mobility in 3 planes for both normal and patient subjects. Construct validity of the goniometer was supported as the test's result documented significant difference in CROM between the control and the neck pain groups.

  1. Employing Range Separation on the meta-GGA Rung: New Functional Suitable for Both Covalent and Noncovalent Interactions

    CERN Document Server

    Modrzejewski, Marcin; Chalasinski, Grzegorz; Szczesniak, Malgorzata M


    We devise a scheme for converting an existing exchange functional into its range-separated hybrid variant. The underlying exchange hole of the Becke-Roussel type has the exact second-order expansion in the interelectron distance. The short-range part of the resulting range-separated exchange energy depends on the kinetic energy density and the Laplacian even if the base functional lacks the dependence on these variables. The most successful practical realization of the scheme, named LC-PBETPSS, combines the range-separated PBE exchange lifted to the hybrid meta-GGA rung and the TPSS correlation. The value of the range-separation parameter is estimated theoretically and confirmed by empirical optimization. The D3 dispersion correction is recommended for all energy computations employing the presented functional. Numerical tests show remarkably robust performance of the method for noncovalent interaction energies, barrier heights, main-group thermochemistry, and excitation energies.

  2. How disturbance, competition, and dispersal interact to prevent tree range boundaries from keeping pace with climate change. (United States)

    Liang, Yu; Duveneck, Matthew J; Gustafson, Eric J; Serra-Diaz, Josep M; Thompson, Jonathan R


    Climate change is expected to cause geographic shifts in tree species' ranges, but such shifts may not keep pace with climate changes because seed dispersal distances are often limited and competition-induced changes in community composition can be relatively slow. Disturbances may speed changes in community composition, but the interactions among climate change, disturbance and competitive interactions to produce range shifts are poorly understood. We used a physiologically based mechanistic landscape model to study these interactions in the northeastern United States. We designed a series of disturbance scenarios to represent varied disturbance regimes in terms of both disturbance extent and intensity. We simulated forest succession by incorporating climate change under a high-emissions future, disturbances, seed dispersal, and competition using the landscape model parameterized with forest inventory data. Tree species range boundary shifts in the next century were quantified as the change in the location of the 5th (the trailing edge) and 95th (the leading edge) percentiles of the spatial distribution of simulated species. Simulated tree species range boundary shifts in New England over the next century were far below (usually change (usually more than 110 km over 100 years) under a high-emissions scenario. Simulated species` ranges shifted northward at both the leading edge (northern boundary) and trailing edge (southern boundary). Disturbances may expedite species' recruitment into new sites, but they had little effect on the velocity of simulated range boundary shifts. Range shifts at the trailing edge tended to be associated with photosynthetic capacity, competitive ability for light and seed dispersal ability, whereas shifts at the leading edge were associated only with photosynthetic capacity and competition for light. This study underscores the importance of understanding the role of interspecific competition and disturbance when studying tree range

  3. Electron-phonon interactions in manganites: efect on the electronic transport and magnetization

    Directory of Open Access Journals (Sweden)

    Otero-Leal, M.


    Full Text Available Mixed-valent manganese oxides with perovskite structure offer a certain degree of chemical flexibility that allows making systematic studies of the relationship between the electric and magnetic properties with the crystalline structure. Here we present magnetic measurements in La2/3(Ca1-xSrx1/3MnO3 that demonstrate that the adiabatic approximation breaks down at low x, due to the strong coupling of the electronic and the lattice degrees of freedom.

    Los óxidos de manganeso con valencia mixta y estructura de perovskita poseen un cierto grado de flexibilidad química que permite hacer estudios sistemáticos entre las propiedades eléctricas y magnéticas, con la estructura cristalina. En este trabajo presentamos medidas magnéticas en la serie La2/3(Ca1-xSrx1/3MnO3 donde se demuestra que la aproximación adiabática falla para pequeñas x, debido el fuerte acoplamiento de los grados de libertad electrónicos y de la red.

  4. Effects of short-ranged interactions on the Kane-Mele model without discrete particle-hole symmetry (United States)

    Lai, Hsin-Hua; Hung, Hsiang-Hsuan


    We study the effects of short-ranged interactions on the Z2 topological insulator phase, also known as the quantum spin Hall phase, in the Kane-Mele model at half-filling with staggered potentials, which explicitly breaks the discrete particle-hole symmetry. Within Hartree-Fock mean-field analysis, we conclude that the on-site repulsive interactions help stabilize the topological phase (quantum spin Hall) against the staggered potentials by enlarging the regime of the topological phase along the axis of the ratio of the staggered potential strength and the spin-orbit coupling. In sharp contrast, the on-site attractive interactions destabilize the topological phase. We also examine the attractive interaction case by means of the unbiased determinant projector quantum Monte Carlo and the results are qualitatively consistent with the Hartree-Fock picture.

  5. Optimal all-optical switching of a microcavity resonance in the telecom range using the electronic Kerr effect. (United States)

    Yüce, Emre; Ctistis, Georgios; Claudon, Julien; Gérard, Jean-Michel; Vos, Willem L


    We have switched GaAs/AlAs and AlGaAs/AlAs planar microcavities that operate in the "Original" (O) telecom band by exploiting the instantaneous electronic Kerr effect. We observe that the resonance frequency reversibly shifts within one picosecond when the nanostructure is pumped with low-energy photons. We investigate experimentally and theoretically the role of several parameters: the material backbone and its electronic bandgap, the quality factor, and the duration of the switch pulse. The magnitude of the frequency shift is reduced when the backbone of the central λ-layer has a greater electronic bandgap compared to the cavity resonance frequency and the frequency of the pump. This observation is caused by the fact that pumping with photon energies near the bandgap resonantly enhances the switched magnitude. We thus find that cavities operating in the telecom O-band are more amenable to ultrafast Kerr switching than those operating at lower frequencies, such as the C-band. Our results indicate that the large bandgap of AlGaAs/AlAs cavity allows to tune both the pump and the probe to the telecom range to perform Kerr switching without detrimental two-photon absorption. We observe that the magnitude of the resonance frequency shift decreases with increasing quality factor of the cavity. Our model shows that the magnitude of the resonance frequency shift depends on the pump pulse duration and is maximized when the duration matches the cavity storage time to within a factor two. In our experiments, we obtain a maximum shift of the cavity resonance relative to the cavity linewidth of 20%. We project that the shift of the cavity resonance can be increased twofold with a pump pulse duration that better matches the cavity storage time. We provide the essential parameter settings for different materials so that the frequency shift of the cavity resonance can be maximized using the electronic Kerr effect.

  6. Revealing Long-Range Interconnected Hubs in Human Chromatin Interaction Data Using Graph Theory (United States)

    Boulos, R. E.; Arneodo, A.; Jensen, P.; Audit, B.


    We use graph theory to analyze chromatin interaction (Hi-C) data in the human genome. We show that a key functional feature of the genome—“master” replication origins—corresponds to DNA loci of maximal network centrality. These loci form a set of interconnected hubs both within chromosomes and between different chromosomes. Our results open the way to a fruitful use of graph theory concepts to decipher DNA structural organization in relation to genome functions such as replication and transcription. This quantitative information should prove useful to discriminate between possible polymer models of nuclear organization.

  7. Identification of coupling DNA motif pairs on long-range chromatin interactions in human K562 cells

    KAUST Repository

    Wong, Ka-Chun


    Motivation: The protein-DNA interactions between transcription factors (TFs) and transcription factor binding sites (TFBSs, also known as DNA motifs) are critical activities in gene transcription. The identification of the DNA motifs is a vital task for downstream analysis. Unfortunately, the long-range coupling information between different DNA motifs is still lacking. To fill the void, as the first-of-its-kind study, we have identified the coupling DNA motif pairs on long-range chromatin interactions in human. Results: The coupling DNA motif pairs exhibit substantially higher DNase accessibility than the background sequences. Half of the DNA motifs involved are matched to the existing motif databases, although nearly all of them are enriched with at least one gene ontology term. Their motif instances are also found statistically enriched on the promoter and enhancer regions. Especially, we introduce a novel measurement called motif pairing multiplicity which is defined as the number of motifs that are paired with a given motif on chromatin interactions. Interestingly, we observe that motif pairing multiplicity is linked to several characteristics such as regulatory region type, motif sequence degeneracy, DNase accessibility and pairing genomic distance. Taken into account together, we believe the coupling DNA motif pairs identified in this study can shed lights on the gene transcription mechanism under long-range chromatin interactions. © The Author 2015. Published by Oxford University Press.

  8. The long-range interaction in the scattering of positronium by hydrogen atoms (United States)

    Meredith, D. G.; Fraser, P. A.


    Elastic scattering of positronium by hydrogen atoms is investigated. A method is devised wherein the effects of the long-range van der Waals attraction between the two atoms are accurately incorporated into a trial wave function in the form of a pseudo-state. The properly adjusted trial function yields a van der Waals coefficient that is within 0.03% of the known value. Improved phase shifts in the absence of exchange are reported.

  9. Long-Range Near-Side Angular Correlations in Proton-Proton Interactions in CMS.

    CERN Multimedia

    CERN. Geneva; Roland, Gunther


    The CMS Collaboration Results on two-particle angular correlations for charged particles emitted in proton-proton collisions at center of mass energies of 0.9, 2.36 and 7TeV over a broad range of pseudorapidity (η) and azimuthal angle (φ) are presented using data collected with the CMS detector at the LHC. Short-range correlations in ∆η, which are studied in minimum bias events, are characterized using a simple independent cluster parameterization in order to quantify their strength (cluster size) and their extent in η (cluster decay width). Long-range azimuthal correlations are studied more differentially as a function of charged particle multiplicity and particle transverse momentum using a 980nb−1 data set at 7TeV. In high multiplicity events, a pronounced structure emerges in the two-dimensional correlation function for particles in intermediate pT’s of 1-3GeV/c, 2.0 EVO Universe, password "seminar"; Phone Bridge ID: 2330444 Password: 5142

  10. Atom Core Interactive Electronic Book to Develop Self Efficacy and Critical Thinking Skills (United States)

    Pradina, Luthfia Puspa; Suyatna, Agus


    The purpose of this research is to develop interactive atomic electronic school book (IESB) to cultivate critical thinking skills and confidence of students grade 12. The method used in this research was the ADDIE (Analyze Design Development Implementation Evaluation) development procedure which is limited to the test phase of product design…

  11. Merging of Landau levels in a strongly-interacting two-dimensional electron system in silicon


    Shashkin, A.A.; Dolgopolov, V.T.; Clark, J. W.; Shaginyan, V. R.; Zverev, M. V.; Khodel, V. A.


    We show that the merging of the spin- and valley-split Landau levels at the chemical potential is an intrinsic property of a strongly-interacting two-dimensional electron system in silicon. Evidence for the level merging is given by available experimental data.

  12. Merging of Landau levels in a strongly interacting two-dimensional electron system in silicon. (United States)

    Shashkin, A A; Dolgopolov, V T; Clark, J W; Shaginyan, V R; Zverev, M V; Khodel, V A


    We show that the merging of the spin- and valley-split Landau levels at the chemical potential is an intrinsic property of a strongly interacting two-dimensional electron system in silicon. Evidence for the level merging is given by available experimental data.

  13. Three-wave interaction during electron cyclotron resonance heating and current drive

    DEFF Research Database (Denmark)

    Nielsen, Stefan Kragh; Jacobsen, Asger Schou; Hansen, Søren Kjer


    Non-linear wave-wave interactions in fusion plasmas, such as the parametric decay instability (PDI) of gyrotron radiation, can potentially hamper the use of microwave diagnostics. Here we report on anomalous scattering in the ASDEX Upgrade tokamak during electron cyclotron resonance heating...

  14. Electron-phonon interaction in a semiconductor quantum wire embedded into the semiconductor medium

    CERN Document Server

    Zharkoj, V P


    The renormalization of electron ground state energy due to the different types of interaction with confined (L) and interface (I) phonons in a semiconductor cylindrical quantum wire (QW) embedded into the semiconductor medium by the example of a HgS/CdS nanosystem.

  15. Development and Assessment of Electronic Structure Approaches for Non-Covalent Interactions (United States)

    Witte, Jonathon Kendall

    This thesis is primarily concerned with the development and assessment of electronic structure approaches for intermolecular interactions. Various aspects of existing approaches - most notably the choices of method, grid, and basis set - are examined with respect to performance in novel ways, and new semi-empirical corrections intended to rectify deficiencies in standard methods are introduced.

  16. Dependence of Xmax and multiplicity of electron and muon on different high energy interaction models

    Directory of Open Access Journals (Sweden)

    G Rastegarzadeh


    Full Text Available Different high energy interaction models are the applied in CORSIKA code to simulate Extensive Air Showers (EAS generated by Cosmic Rays (CR. In this work the effects of QGSJET01, QGSJETII, DPMJET, SIBYLL models on Xmax and multiplicity of secondary electrons and muons at observation level are studied.

  17. Do electromagnetic fields interact with electrons in the Na,K-ATPase? (United States)

    Blank, Martin


    The effects of low frequency electric and magnetic fields on several biochemical systems, including the Na,K-ATPase, indicate that electromagnetic (EM) fields interact with electrons. The frequency optima for two enzymes in response to EM fields are very close to their turnover numbers, suggesting that these interactions directly affect reaction rates. Nevertheless, generally accepted ideas about Na,K-ATPase function and ion transport mechanisms do not consider interactions with electrons. To resolve the clash of paradigms, we hypothesize interaction with transient electrons and protons that arise from flickering of H-bonds in the hydrated protein. These transient charges in the enzyme could provide a trigger for the sequence of conformation changes that are part of the ion transport mechanism. If the distributions of transient electrons and protons in the membrane are affected by their concentration and the membrane potential, as expected from electric double layer theory, this can account for the different effects of low frequency electric and magnetic fields, as well as for the observation that membrane hyperpolarization reverses the ATPase reaction to generate ATP. Bioelectromagnetics (c) 2005 Wiley-Liss, Inc.

  18. Exact and variational calculations of eigenmodes for three-dimensional free electron laser interaction with a warm electron beam

    Energy Technology Data Exchange (ETDEWEB)

    Xie, M. [Lawrence Berkeley Lab., CA (United States)


    I present an exact calculation of free-electron-laser (FEL) eigenmodes (fundamental as well as higher order modes) in the exponential-gain regime. These eigenmodes specify transverse profiles and exponential growth rates of the laser field, and they are self-consistent solutions of the coupled Maxwell-Vlasov equations describing the FEL interaction taking into account the effects due to energy spread, emittance and betatron oscillations of the electron beam, and diffraction and guiding of the laser field. The unperturbed electron distribution is assumed to be of Gaussian shape in four dimensional transverse phase space and in the energy variable, but uniform in longitudinal coordinate. The focusing of the electron beam is assumed to be matched to the natural wiggler focusing in both transverse planes. With these assumptions the eigenvalue problem can be reduced to a numerically manageable integral equation and solved exactly with a kernel iteration method. An approximate, but more efficient solution of the integral equation is also obtained for the fundamental mode by a variational technique, which is shown to agree well with the exact results. Furthermore, I present a handy formula, obtained from interpolating the numerical results, for a quick calculation of FEL exponential growth rate. Comparisons with simulation code TDA will also be presented. Application of these solutions to the design and multi-dimensional parameter space optimization for an X-ray free electron laser driven by SLAC linac will be demonstrated. In addition, a rigorous analysis of transverse mode degeneracy and hence the transverse coherence of the X-ray FEL will be presented based on the exact solutions of the higher order guided modes.

  19. Chromatin insulator factors involved in long-range DNA interactions and their role in the folding of the Drosophila genome. (United States)

    Vogelmann, Jutta; Le Gall, Antoine; Dejardin, Stephanie; Allemand, Frederic; Gamot, Adrien; Labesse, Gilles; Cuvier, Olivier; Nègre, Nicolas; Cohen-Gonsaud, Martin; Margeat, Emmanuel; Nöllmann, Marcelo


    Chromatin insulators are genetic elements implicated in the organization of chromatin and the regulation of transcription. In Drosophila, different insulator types were characterized by their locus-specific composition of insulator proteins and co-factors. Insulators mediate specific long-range DNA contacts required for the three dimensional organization of the interphase nucleus and for transcription regulation, but the mechanisms underlying the formation of these contacts is currently unknown. Here, we investigate the molecular associations between different components of insulator complexes (BEAF32, CP190 and Chromator) by biochemical and biophysical means, and develop a novel single-molecule assay to determine what factors are necessary and essential for the formation of long-range DNA interactions. We show that BEAF32 is able to bind DNA specifically and with high affinity, but not to bridge long-range interactions (LRI). In contrast, we show that CP190 and Chromator are able to mediate LRI between specifically-bound BEAF32 nucleoprotein complexes in vitro. This ability of CP190 and Chromator to establish LRI requires specific contacts between BEAF32 and their C-terminal domains, and dimerization through their N-terminal domains. In particular, the BTB/POZ domains of CP190 form a strict homodimer, and its C-terminal domain interacts with several insulator binding proteins. We propose a general model for insulator function in which BEAF32/dCTCF/Su(HW) provide DNA specificity (first layer proteins) whereas CP190/Chromator are responsible for the physical interactions required for long-range contacts (second layer). This network of organized, multi-layer interactions could explain the different activities of insulators as chromatin barriers, enhancer blockers, and transcriptional regulators, and suggest a general mechanism for how insulators may shape the organization of higher-order chromatin during cell division.

  20. Quantum dynamics of long-range interacting systems using the positive-P and gauge-P representations (United States)

    Wüster, S.; Corney, J. F.; Rost, J. M.; Deuar, P.


    We provide the necessary framework for carrying out stochastic positive-P and gauge-P simulations of bosonic systems with long-range interactions. In these approaches, the quantum evolution is sampled by trajectories in phase space, allowing calculation of correlations without truncation of the Hilbert space or other approximations to the quantum state. The main drawback is that the simulation time is limited by noise arising from interactions. We show that the long-range character of these interactions does not further increase the limitations of these methods, in contrast to the situation for alternatives such as the density matrix renormalization group. Furthermore, stochastic gauge techniques can also successfully extend simulation times in the long-range-interaction case, by making using of parameters that affect the noise properties of trajectories, without affecting physical observables. We derive essential results that significantly aid the use of these methods: estimates of the available simulation time, optimized stochastic gauges, a general form of the characteristic stochastic variance, and adaptations for very large systems. Testing the performance of particular drift and diffusion gauges for nonlocal interactions, we find that, for small to medium systems, drift gauges are beneficial, whereas for sufficiently large systems, it is optimal to use only a diffusion gauge. The methods are illustrated with direct numerical simulations of interaction quenches in extended Bose-Hubbard lattice systems and the excitation of Rydberg states in a Bose-Einstein condensate, also without the need for the typical frozen gas approximation. We demonstrate that gauges can indeed lengthen the useful simulation time.

  1. Energetic electron precipitation in weak to moderate corotating interaction region-driven storms (United States)

    Ødegaard, Linn-Kristine Glesnes; Tyssøy, Hilde Nesse; Søraas, Finn; Stadsnes, Johan; Sandanger, Marit Irene


    High-energy electron precipitation from the radiation belts can penetrate deep into the mesosphere and increase the production rate of NOx and HOx, which in turn will reduce ozone in catalytic processes. The mechanisms for acceleration and loss of electrons in the radiation belts are not fully understood, and most of the measurements of the precipitating flux into the atmosphere have been insufficient for estimating the loss cone flux. In the present study the electron flux measured by the NOAA POES Medium Energy Proton and Electron Detectors 0° and 90° detectors is combined together with theory of pitch angle diffusion by wave-particle interaction to quantify the electron flux lost below 120 km altitude. Using this method, 41 weak and moderate geomagnetic storms caused by corotating interaction regions during 2006-2010 are studied. The dependence of the energetic electron precipitation fluxes upon solar wind parameters and geomagnetic indices is investigated. Nine storms give increased precipitation of >˜750 keV electrons. Nineteen storms increase the precipitation of >˜300 keV electrons, but not the >˜750 keV population. Thirteen storms either do not change or deplete the fluxes at those energies. Storms that have an increase in the flux of electrons with energy >˜300 keV are characterized by an elevated solar wind velocity for a longer period compared to the storms that do not. Storms with increased precipitation of >˜750 keV flux are distinguished by higher-energy input from the solar wind quantified by the ɛ parameter and corresponding higher geomagnetic activity.

  2. Electron Lifetimes from Narrowband Wave-Particle Interactions within the Plasmasphere (United States)

    Ripoll, J. F.; Albert, J.; Cunningham, G.


    This work is devoted to the systematic study of electron lifetimes from narrowband wave-particle interactions in the plasmasphere. It relies on a new formulation of the bounce-averaged quasi-linear pitch angle diffusion coefficients parameterized by a single frequency, w, and wave-normal angle, theta [Albert, 2012]. We first show that the diffusion coefficients scale with w/Wce, where Wce is the equatorial electron gyrofrequency, and that maximal pitch angle diffusion occurs along the line alpha0=pi/2-theta, where alpha0 is the equatorial pitch angle. Lifetimes are computed for L-shell values in the range [1.5, 3.5] and energies, E, in the range [0.1, 6] MeV as a function of frequency and wave-normal angle. The lifetimes are relatively independent of frequency and wave-normal angle after taking into consideration the scaling law, with a weak dependence on wave-normal angle up to 60-70°, increasing to infinity as the wave-normal angle approaches the resonance cone. We identify regions in the (L, E) plane in which a single wave type (hiss, VLF transmitters, or lightning-generated waves) is dominant relative to the others. We find that VLF waves dominate the lifetime for 0.2-0.4 MeV at L~2 and for 0.5-0.8 MeV at L~1.5, while hiss dominates the lifetime for 2-3 MeV at L=3-3.5. The influence of lightning-generated waves is always mixed with the other two and cannot be easily differentiated. Limitations of the method for addressing effects due to restricted latitude or pitch angle domains are also discussed. Finally, for each (L, E) we search for the minimum lifetime and find that the "optimal" frequency that produces this lifetime increases as L diminishes. Restricting the search to very oblique waves, which could be emitted during the DSX satellite mission, we find that the optimal frequency is always close to 0.16Wce.

  3. Long-wavelength optical phonon behavior in uniaxial strained graphene: Role of electron-phonon interaction (United States)

    Assili, M.; Haddad, S.


    We derive the frequency shifts and the broadening of Γ-point longitudinal optical (LO) and transverse optical (TO) phonon modes, due to electron-phonon interaction, in graphene under uniaxial strain as a function of the electron density and the disorder amount. We show that, in the absence of a shear strain component, such interaction gives rise to a lifting of the degeneracy of the LO and TO modes which contributes to the splitting of the G Raman band. The anisotropy of the electronic spectrum, induced by the strain, results in a polarization dependence of the LO and TO modes. This dependence is in agreement with the experimental results showing a periodic modulation of the Raman intensity of the split G peak. Moreover, the anomalous behavior of the frequency shift reported in undeformed graphene is found to be robust under strain.

  4. Soft Electronics Enabled Ergonomic Human-Computer Interaction for Swallowing Training (United States)

    Lee, Yongkuk; Nicholls, Benjamin; Sup Lee, Dong; Chen, Yanfei; Chun, Youngjae; Siang Ang, Chee; Yeo, Woon-Hong


    We introduce a skin-friendly electronic system that enables human-computer interaction (HCI) for swallowing training in dysphagia rehabilitation. For an ergonomic HCI, we utilize a soft, highly compliant (“skin-like”) electrode, which addresses critical issues of an existing rigid and planar electrode combined with a problematic conductive electrolyte and adhesive pad. The skin-like electrode offers a highly conformal, user-comfortable interaction with the skin for long-term wearable, high-fidelity recording of swallowing electromyograms on the chin. Mechanics modeling and experimental quantification captures the ultra-elastic mechanical characteristics of an open mesh microstructured sensor, conjugated with an elastomeric membrane. Systematic in vivo studies investigate the functionality of the soft electronics for HCI-enabled swallowing training, which includes the application of a biofeedback system to detect swallowing behavior. The collection of results demonstrates clinical feasibility of the ergonomic electronics in HCI-driven rehabilitation for patients with swallowing disorders.

  5. The Effect of Background Pressure on Electron Acceleration from Ultra-Intense Laser-Matter Interactions (United States)

    Le, Manh; Ngirmang, Gregory; Orban, Chris; Morrison, John; Chowdhury, Enam; Roquemore, William


    We present two-dimensional particle-in-cell (PIC) simulations that investigate the role of background pressure on the acceleration of electrons from ultra intense laser interaction at normal incidence with liquid density ethylene glycol targets. The interaction was simulated at ten different pressures varying from 7.8 mTorr to 26 Torr. We calculated conversion efficiencies from the simulation results and plotted the efficiencies with respect to the background pressure. The results revealed that the laser to > 100 keV electron conversion efficiency remained flat around 0.35% from 7.8 mTorr to 1.2 Torr and increased exponentially from 1.2 Torr onward to about 1.47% at 26 Torr. Increasing the background pressure clearly has a dramatic effect on the acceleration of electrons from the target. We explain how electrostatic effects, in particular the neutralization of the target by the background plasma, allows electrons to escape more easily and that this effect is strengthened with higher densities. This work could facilitate the design of future experiments in increasing laser to electron conversion efficiency and generating substantial bursts of electrons with relativistic energies. This research is supported by the Air Force Office of Scientific Research under LRIR Project 17RQCOR504 under the management of Dr. Riq Parra and Dr. Jean-Luc Cambier. Support was also provided by the DOD HPCMP Internship Program.

  6. Ab initio study of He-He interactions in homogeneous electron gas (United States)

    Wang, Jinlong; Niu, Liang-Liang; Zhang, Ying


    We have investigated the immersion energy of a single He and the He-He interactions in homogeneous electron gas using ab initio calculations. It is found that He dislikes electrons and He-He interact via the He induced Friedel oscillations of electron densities. A critical electron density at which the global binding energy extremum shifts from the first minimum to the second one is identified. We also discover that the He-He global binding energy minimum of ∼-0.09 eV is reached at an optimal electron density of 0.04 e/Å3, corresponding to an optimal He-He separation of ∼1.7 Å. Further, the He atoms are found to gain a trivial amount of 2s and 2p states from the free electrons, inducing a hybridization between the He s- and p-states. The present results can qualitatively interpret the well-known He self-trapping behavior in metals.

  7. Density of states of two-dimensional systems with long-range logarithmic interactions

    Energy Technology Data Exchange (ETDEWEB)

    Somoza, Andrés M.; Ortuño, Miguel; Baturina, Tatyana I.; Vinokur, Valerii M.


    We investigate a single-particle density of states (DOS) in strongly disordered two- dimensional high dielectric permittivity systems with logarithmic Coulomb interaction between particles. We derive self-consistent DOS at zero temperature and show that it is appreciably suppressed as compared to the DOS expected from the Efros-Shklovskii approach.We carry out zero- and finite-temperature Monte Carlo numerical studies of the DOS and find the perfect agreement between the numerical and analytical results at zero temperature, observing, in particular, a hardening of the Coulomb gap with the increasing electrostatic screening length. At finite temperatures, we reveal a striking scaling of the DOS as a function of energy normalized to the temperature of the system.

  8. Long-range dispersion interactions between Li and rare-gas atoms (United States)

    Zhang, Deng-Hong; Xu, Ya-Bin; Jiang, Jun; Jiang, Li; Xie, Lu-You; Dong, Chen-Zhong


    The energy levels, oscillator strength and dipole scalar polarizabilities of Li atoms are calculated by using the relativistic semiempirical-core-potential method (RCICP). The dispersion coefficients C6 between ground 2s1/2 2p1/2,2p3/2 states of Li atom and the ground state of rare gas atoms (Ne, Ar, Kr, Xe) are calculated in JJ coupled states, in which the spin-orbital interactions are included. Present results are in good agreement with other available results. Contribution to the Topical Issue "Atomic and Molecular Data and their Applications", edited by Gordon W.F. Drake, Jung-Sik Yoon, Daiji Kato, Grzegorz Karwasz.

  9. Amplitude equation and long-range interactions in underwater sand ripples in one dimension

    DEFF Research Database (Denmark)

    Schnipper, Teis; Mertens, Keith; Ellegaard, Clive


    ) which, due to the first term, is neither completely local (it has long-range coupling through the average height (h) over bar) nor has local sand conservation. We argue that this is reasonable and show that the equation compares well with experimental observations in narrow channels. We focus...... in particular on the so-called doubling transition, a secondary instability caused by the sudden decrease in the amplitude of the water motion, leading to the appearance of a new ripple in each trough. This transition is well reproduced for sufficiently large delta (asymmetry between trough and crest). We...

  10. A Range-Wide Experiment to Investigate Nutrient and Soil Moisture Interactions in Loblolly Pine Plantations

    Directory of Open Access Journals (Sweden)

    Rodney E. Will


    Full Text Available The future climate of the southeastern USA is predicted to be warmer, drier and more variable in rainfall, which may increase drought frequency and intensity. Loblolly pine (Pinus taeda is the most important commercial tree species in the world and is planted on ~11 million ha within its native range in the southeastern USA. A regional study was installed to evaluate effects of decreased rainfall and nutrient additions on loblolly pine plantation productivity and physiology. Four locations were established to capture the range-wide variability of soil and climate. Treatments were initiated in 2012 and consisted of a factorial combination of throughfall reduction (approximate 30% reduction and fertilization (complete suite of nutrients. Tree and stand growth were measured at each site. Results after two growing seasons indicate a positive but variable response of fertilization on stand volume increment at all four sites and a negative effect of throughfall reduction at two sites. Data will be used to produce robust process model parameterizations useful for simulating loblolly pine growth and function under future, novel climate and management scenarios. The resulting improved models will provide support for developing management strategies to increase pine plantation productivity and carbon sequestration under a changing climate.

  11. Generation of femtosecond soft x-ray pulse by interaction between laser and electron beam in an electron storage ring

    CERN Document Server

    Inoue, T; Amano, S; Mochizuki, T; Yatsuzaka, M


    A femtosecond synchrotron radiation pulse train can be extracted from an electron storage ring by interaction between an ultrashort laser pulse and an electron beam in an undulator. Generation system of a femtosecond soft x-ray pulse by the slicing technique was studied with numerical calculations for its performance, as applicable for the NewSUBARU synchrotron radiation facility at LASTI. The femtosecond electron pulse, that is energy-modulated with a Ti:sapphire laser at a pulse energy of 100 mu J, a pulse width of 150 fs, and repetition frequency of 20 kHz, can be sufficiently separated in a bending magnet. A femtosecond soft x-ray pulse (the critical photon energy of 0.69 keV and a pulse width of 250 fs) is obtained with a collimator (diameter of 800 mu m phi), and it has an average brightness 3 x 10 sup 6 photons/s/mm sup 2 /mrad sup 2 /0.1 %BW and an average photon flux 10 sup 5 photons/s/0.1 %BW. (author)

  12. Photoinduced Change in the Charge Order Pattern in the Quarter-Filled Organic Conductor (EDO-TTF)2PF6 with a Strong Electron-Phonon Interaction (United States)

    Onda, Ken; Ogihara, Sho; Yonemitsu, Kenji; Maeshima, Nobuya; Ishikawa, Tadahiko; Okimoto, Yoichi; Shao, Xiangfeng; Nakano, Yoshiaki; Yamochi, Hideki; Saito, Gunzi; Koshihara, Shin-Ya


    The quasistable state in the photoinduced phase transition for the quasi-one-dimensional quarter-filled organic conductor (EDO-TTF)2PF6 has been examined by ultrafast reflective measurements and time-dependent model calculations incorporating both electron-electron and electron-phonon interactions. The transient optical conductivity spectrum over a wide probe photon-energy range revealed that photoexcitation induced a new type of charge-disproportionate state. Additionally, coherent and incoherent oscillations dependent on probe photon energies were found, as predicted by the calculation.

  13. The effects of transverse magnetic field and local electronic interaction on thermoelectric properties of monolayer graphene (United States)

    Rezania, Hamed; Azizi, Farshad


    We study the effects of a transverse magnetic field and electron doping on the thermoelectric properties of monolayer graphene in the context of Hubbard model at the antiferromagnetic sector. In particular, the temperature dependence of thermal conductivity and Seebeck coefficient has been investigated. Mean field approximation has been employed in order to obtain the electronic spectrum of the system in the presence of local electron-electron interaction. Our results show the peak in thermal conductivity moves to higher temperatures with increase of both chemical potential and Hubbard parameter. Moreover the increase of magnetic field leads to shift of peak in temperature dependence of thermal conductivity to higher temperatures. Finally the behavior of Seebeck coefficient in terms of temperature has been studied and the effects of magnetic field and Hubbard parameter on this coefficient have been investigated in details.

  14. Electron Fluid Description of Wave-Particle Interactions in Strong Buneman Turbulence

    CERN Document Server

    Che, H


    To understand the nature of anomalous resistivity in magnetic reconnection, we investigate turbulence-induced momentum transport and energy dissipation during Buneman instability in force-free current sheets. Using 3D particle-in-cell simulations, we find that the macroscopic effects generated by wave-particle interactions in Buneman instability can be approximately described by a set of electron fluid equations. These equations show that the energy dissipation and momentum transports along current sheets are locally quasi-static but globally non-static and irreversible. Turbulence drag dissipates both the streaming energy of current sheets and the associated magnetic energy. The decrease of magnetic field maintains an inductive electric field that re-accelerates electrons. The net loss of streaming energy is converted into the heat of electrons moving along the magnetic field and increases the electron Boltzmann entropy. The growth of self-sustained Buneman waves satisfies a Bernoulli-like equation that rela...

  15. Opto-electronic device for frequency standard generation and terahertz-range optical demodulation based on quantum interference (United States)

    Georgiades, Nikos P.; Polzik, Eugene S.; Kimble, H. Jeff


    An opto-electronic system and technique for comparing laser frequencies with large frequency separations, establishing new frequency standards, and achieving phase-sensitive detection at ultra high frequencies. Light responsive materials with multiple energy levels suitable for multi-photon excitation are preferably used for nonlinear mixing via quantum interference of different excitation paths affecting a common energy level. Demodulation of a carrier with a demodulation frequency up to 100's THZ can be achieved for frequency comparison and phase-sensitive detection. A large number of materials can be used to cover a wide spectral range including the ultra violet, visible and near infrared regions. In particular, absolute frequency measurement in a spectrum from 1.25 .mu.m to 1.66 .mu.m for fiber optics can be accomplished with a nearly continuous frequency coverage.

  16. Tilt-pair analysis of images from a range of different specimens in single-particle electron cryomicroscopy. (United States)

    Henderson, Richard; Chen, Shaoxia; Chen, James Z; Grigorieff, Nikolaus; Passmore, Lori A; Ciccarelli, Luciano; Rubinstein, John L; Crowther, R Anthony; Stewart, Phoebe L; Rosenthal, Peter B


    The comparison of a pair of electron microscope images recorded at different specimen tilt angles provides a powerful approach for evaluating the quality of images, image-processing procedures, or three-dimensional structures. Here, we analyze tilt-pair images recorded from a range of specimens with different symmetries and molecular masses and show how the analysis can produce valuable information not easily obtained otherwise. We show that the accuracy of orientation determination of individual single particles depends on molecular mass, as expected theoretically since the information in each particle image increases with molecular mass. The angular uncertainty is less than 1° for particles of high molecular mass (~50 MDa), several degrees for particles in the range 1-5 MDa, and tens of degrees for particles below 1 MDa. Orientational uncertainty may be the major contributor to the effective temperature factor (B-factor) describing contrast loss and therefore the maximum resolution of a structure determination. We also made two unexpected observations. Single particles that are known to be flexible showed a wider spread in orientation accuracy, and the orientations of the largest particles examined changed by several degrees during typical low-dose exposures. Smaller particles presumably also reorient during the exposure; hence, specimen movement is a second major factor that limits resolution. Tilt pairs thus enable assessment of orientation accuracy, map quality, specimen motion, and conformational heterogeneity. A convincing tilt-pair parameter plot, where 60% of the particles show a single cluster around the expected tilt axis and tilt angle, provides confidence in a structure determined using electron cryomicroscopy. Copyright © 2011 Elsevier Ltd. All rights reserved.

  17. Sustained Spatial Attention to Vibrotactile Stimulation in the Flutter Range: Relevant Brain Regions and Their Interaction (United States)

    Goltz, Dominique; Pleger, Burkhard; Thiel, Sabrina; Villringer, Arno; Müller, Matthias M.


    The present functional magnetic resonance imaging (fMRI) study was designed to get a better understanding of the brain regions involved in sustained spatial attention to tactile events and to ascertain to what extent their activation was correlated. We presented continuous 20 Hz vibrotactile stimuli (range of flutter) concurrently to the left and right index fingers of healthy human volunteers. An arrow cue instructed subjects in a trial-by-trial fashion to attend to the left or right index finger and to detect rare target events that were embedded in the vibrotactile stimulation streams. We found blood oxygen level-dependent (BOLD) attentional modulation in primary somatosensory cortex (SI), mainly covering Brodmann area 1, 2, and 3b, as well as in secondary somatosensory cortex (SII), contralateral to the to-be-attended hand. Furthermore, attention to the right (dominant) hand resulted in additional BOLD modulation in left posterior insula. All of the effects were caused by an increased activation when attention was paid to the contralateral hand, except for the effects in left SI and insula. In left SI, the effect was related to a mixture of both a slight increase in activation when attention was paid to the contralateral hand as well as a slight decrease in activation when attention was paid to the ipsilateral hand (i.e., the tactile distraction condition). In contrast, the effect in left posterior insula was exclusively driven by a relative decrease in activation in the tactile distraction condition, which points to an active inhibition when tactile information is irrelevant. Finally, correlation analyses indicate a linear relationship between attention effects in intrahemispheric somatosensory cortices, since attentional modulation in SI and SII were interrelated within one hemisphere but not across hemispheres. All in all, our results provide a basis for future research on sustained attention to continuous vibrotactile stimulation in the range of flutter

  18. Jaguar interactions with pumas and prey at the northern edge of jaguars’ range

    Directory of Open Access Journals (Sweden)

    Carmina E. Gutiérrez-González


    Full Text Available We present the first study that evaluates jaguar-puma interactions in the arid lands of northern Mexico, where jaguars have their northernmost breeding population and both predators are persecuted for livestock depredation. We tested whether jaguars are the dominant species in this unique ecosystem, where: (1 pumas outnumber jaguars, (2 pumas are better adapted to arid environments, and (3 jaguars and pumas are of similar size. We analyzed four years of data with two approaches; a two species conditional occupancy model and an activity patterns analysis. We used camera location and prey presence as covariates for jaguar and puma detection and presence probabilities. We also explored overlap in activities of predators and prey. Where both species were detected, peccary presence was positively correlated with both jaguar and puma presence, whereas in areas where jaguars were detected but pumas were not, deer presence explained the probability of jaguar presence. We found that both predators were more likely to co-occur together than to be found independently, and so we rejected the hypothesis that jaguars were the dominant species in our study area. Predators were mainly nocturnal and their activity patterns overlapped by 60%. Jaguar, as compared with puma, overlapped more with deer and calves; puma overlapped with calves more than with other prey, suggesting a preference. We believe exploring predator relationships at different scales may help elucidate mechanisms that regulate their coexistence.

  19. Quantum ballistic transport by interacting two-electron states in quasi-one-dimensional channels

    Energy Technology Data Exchange (ETDEWEB)

    Huang, Danhong [Air Force Research Laboratory, Space Vehicles Directorate, Kirtland Air Force Base, New Mexico 87117 (United States); Center for High Technology Materials, University of New Mexico, 1313 Goddard St SE, Albuquerque, New Mexico 87106 (United States); Gumbs, Godfrey [Center for High Technology Materials, University of New Mexico, 1313 Goddard St SE, Albuquerque, New Mexico 87106 (United States); Abranyos, Yonatan [Department of Physics and Astronomy, Hunter College of the City University of New York, 695 Park Avenue, New York, New York 10065 (United States); Pepper, Michael; Kumar, Sanjeev [Department of Electronic and Electrical Engineering, University College London, London, WC1E 7JE (United Kingdom); London Centre for Nanotechnology, 17-19 Gordon Street, London, WC1H 0AH (United Kingdom)


    For quantum ballistic transport of electrons through a short conduction channel, the role of Coulomb interaction may significantly modify the energy levels of two-electron states at low temperatures as the channel becomes wide. In this regime, the Coulomb effect on the two-electron states is calculated and found to lead to four split energy levels, including two anticrossing-level and two crossing-level states. Moreover, due to the interplay of anticrossing and crossing effects, our calculations reveal that the ground two-electron state will switch from one anticrossing state (strong confinement) to a crossing state (intermediate confinement) as the channel width gradually increases and then back to the original anticrossing state (weak confinement) as the channel width becomes larger than a threshold value. This switching behavior leaves a footprint in the ballistic conductance as well as in the diffusion thermoelectric power of electrons. Such a switching is related to the triple spin degeneracy as well as to the Coulomb repulsion in the central region of the channel, which separates two electrons away and pushes them to different channel edges. The conductance reoccurrence region expands from the weak to the intermediate confinement regime with increasing electron density.

  20. Latitudinal dependence of nonlinear interaction between electromagnetic ion cyclotron wave and radiation belt relativistic electrons (United States)

    Su, Zhenpeng; Zhu, Hui; Xiao, Fuliang; Zheng, Huinan; Shen, Chao; Wang, Yuming; Wang, Shui


    Electromagnetic ion cyclotron (EMIC) waves are long suggested to account for the rapid loss of radiation belt relativistic electrons. Here we perform both theoretical analysis and numerical simulation to comprehensively investigate the nonlinear interaction between EMIC wave and relativistic electrons. In particular, we emphasize the dependence of nonlinear processes on the electron initial latitude. The nonlinear phase trapping yields negative equatorial pitch angle transport, with efficiency varying over the electron initial latitude, implying that it can increase the loss rate predicted by quasilinear theory. The nonlinear channel effect phase bunching produces positive equatorial pitch angle transport, less dependent on the electron initial latitude, suggesting that it can decrease the loss rate predicted by quasilinear theory. The nonlinear cluster effect phase bunching alternately causes positive and negative equatorial pitch angle transport, quasi-periodically dependent on the electron initial latitude, suggesting that it can either decrease or increase the loss rate predicted by the quasilinear theory. Such latitudinal dependence of nonlinear processes should be taken into account in the evaluation of radiation belt electron loss rate driven by EMIC waves.

  1. Charge transfer dynamics from adsorbates to surfaces with single active electron and configuration interaction based approaches

    Energy Technology Data Exchange (ETDEWEB)

    Ramakrishnan, Raghunathan, E-mail: [Institute of Physical Chemistry, National Center for Computational Design and Discovery of Novel Materials (MARVEL), Department of Chemistry, University of Basel, Klingelbergstrasse 80, CH-4056 Basel (Switzerland); Nest, Mathias [Theoretische Chemie, Technische Universität München, Lichtenbergstr. 4, 85747 Garching (Germany)


    Highlights: • We model electron dynamics across cyano alkanethiolates attached to gold cluster. • We present electron transfer time scales from TD-DFT and TD-CI based simulations. • Both DFT and CI methods qualitatively predict the trend in time scales. • TD-CI predicts the experimental relative time scale very accurately. - Abstract: We employ wavepacket simulations based on many-body time-dependent configuration interaction (TD-CI), and single active electron theories, to predict the ultrafast molecule/metal electron transfer time scales, in cyano alkanethiolates bonded to model gold clusters. The initial states represent two excited states where a valence electron is promoted to one of the two virtual π{sup ∗} molecular orbitals localized on the cyanide fragment. The ratio of the two time scales indicate the efficiency of one charge transfer channel over the other. In both our one-and many-electron simulations, this ratio agree qualitatively with each other as well as with the previously reported experimental time scales (Blobner et al., 2012), measured for a macroscopic metal surface. We study the effect of cluster size and the description of electron correlation on the charge transfer process.

  2. Multiplexed chromosome conformation capture sequencing for rapid genome-scale high-resolution detection of long-range chromatin interactions. (United States)

    Stadhouders, Ralph; Kolovos, Petros; Brouwer, Rutger; Zuin, Jessica; van den Heuvel, Anita; Kockx, Christel; Palstra, Robert-Jan; Wendt, Kerstin S; Grosveld, Frank; van Ijcken, Wilfred; Soler, Eric


    Chromosome conformation capture (3C) technology is a powerful and increasingly popular tool for analyzing the spatial organization of genomes. Several 3C variants have been developed (e.g., 4C, 5C, ChIA-PET, Hi-C), allowing large-scale mapping of long-range genomic interactions. Here we describe multiplexed 3C sequencing (3C-seq), a 4C variant coupled to next-generation sequencing, allowing genome-scale detection of long-range interactions with candidate regions. Compared with several other available techniques, 3C-seq offers a superior resolution (typically single restriction fragment resolution; approximately 1-8 kb on average) and can be applied in a semi-high-throughput fashion. It allows the assessment of long-range interactions of up to 192 genes or regions of interest in parallel by multiplexing library sequencing. This renders multiplexed 3C-seq an inexpensive, quick (total hands-on time of 2 weeks) and efficient method that is ideal for the in-depth analysis of complex genetic loci. The preparation of multiplexed 3C-seq libraries can be performed by any investigator with basic skills in molecular biology techniques. Data analysis requires basic expertise in bioinformatics and in Linux and Python environments. The protocol describes all materials, critical steps and bioinformatics tools required for successful application of 3C-seq technology.

  3. Universal Quantum Criticality in the Metal-Insulator Transition of Two-Dimensional Interacting Dirac Electrons

    Directory of Open Access Journals (Sweden)

    Yuichi Otsuka


    Full Text Available The metal-insulator transition has been a subject of intense research since Mott first proposed that the metallic behavior of interacting electrons could turn to an insulating one as electron correlations increase. Here, we consider electrons with massless Dirac-like dispersion in two spatial dimensions, described by the Hubbard models on two geometrically different lattices, and perform numerically exact calculations on unprecedentedly large systems that, combined with a careful finite-size scaling analysis, allow us to explore the quantum critical behavior in the vicinity of the interaction-driven metal-insulator transition. Thereby, we find that the transition is continuous, and we determine the quantum criticality for the corresponding universality class, which is described in the continuous limit by the Gross-Neveu model, a model extensively studied in quantum field theory. Furthermore, we discuss a fluctuation-driven scenario for the metal-insulator transition in the interacting Dirac electrons: The metal-insulator transition is triggered only by the vanishing of the quasiparticle weight, not by the Dirac Fermi velocity, which instead remains finite near the transition. This important feature cannot be captured by a simple mean-field or Gutzwiller-type approximate picture but is rather consistent with the low-energy behavior of the Gross-Neveu model.

  4. Van Allen Probes observations of prompt MeV radiation belt electron acceleration in nonlinear interactions with VLF chorus (United States)

    Foster, J. C.; Erickson, P. J.; Omura, Y.; Baker, D. N.; Kletzing, C. A.; Claudepierre, S. G.


    Prompt recovery of MeV (millions of electron Volts) electron populations in the poststorm core of the outer terrestrial radiation belt involves local acceleration of a seed population of energetic electrons in interactions with VLF chorus waves. Electron interactions during the generation of VLF rising tones are strongly nonlinear, such that a fraction of the relativistic electrons at resonant energies are trapped by waves, leading to significant nonadiabatic energy exchange. Through detailed examination of VLF chorus and electron fluxes observed by Van Allen Probes, we investigate the efficiency of nonlinear processes for acceleration of electrons to MeV energies. We find through subpacket analysis of chorus waveforms that electrons with initial energy of hundreds of keV to 3 MeV can be accelerated by 50 keV-200 keV in resonant interactions with a single VLF rising tone on a time scale of 10-100 ms.

  5. Dynamic electron correlation in interactions of light with matter formulated in b ⃗ space (United States)

    Kaplan, Lev; McGuire, J. H.


    Scattering of beams of light and matter from multielectron atomic targets is formulated in the position representation of quantum mechanics. This yields expressions for the probability amplitude a (b ⃗) for a wide variety of processes. Here the spatial parameter b ⃗ is the distance of closest approach of incoming particles traveling on a straight line with the center of the atomic target. The correlated probability amplitude a (b ⃗) reduces to a relatively simple product of single-electron probability amplitudes in the widely used independent electron approximation limit, where the correlation effects of the Coulomb interactions between the atomic electrons disappear. As an example in which a (b ⃗) has an explicit dependence on b ⃗, we consider transversely finite vortex beams of twisted photons that lack the translational invariance of infinite plane-wave beams. Relatively simple calculations, illustrating the b ⃗ dependence in transition probabilities for photon beams interacting with a two-state degenerate single-electron atomic target, are included. Further application for many-electron systems is discussed. Possible practical uses are briefly considered.

  6. Noncovalent interactions from electron density topology and solvent effects on spectral properties of Schiff bases (United States)

    Gandhimathi, S.; Balakrishnan, C.; Theetharappan, M.; Neelakantan, M. A.; Venkataraman, R.


    Two Schiff bases were prepared by the condensation of o-allyl substituted 2,4-dihydroxy acetophenone with 1,2-diaminopropane (L1) and ethanediamine (L2) and characterized by elemental analysis, and ESI-MS, IR, UV-Vis, 1H and 13C NMR spectral techniques. The effect of solvents with respect to different polarities on UV-Vis and emission spectra of L1 and L2 was investigated at room temperature show that the compounds exist in keto and enol forms in solution and may be attributed to the intramolecular proton transfer in the ground state. The solute-solvent interactions, change in dipole moment and solvatochromic properties of the compounds were studied based on the solvent polarity parameters. For L1 and L2, the ground and excited state electronic structure calculations were carried out by DFT and TD-DFT at B3LYP/6-311G (d,p) level, respectively. The IR, NMR and electronic absorption spectra computed were compared with the experimental observations. The intramolecular charge transfer within the molecule is evidenced from the HOMO and LUMO energy levels and surface analysis. The noncovalent interactions like hydrogen bonding and van der Waals interactions were identified from the molecular geometry and electron localization function. These interactions in molecules have been studied by using reduced density gradient and graphed by Multiwfn.

  7. Multilevel summation methods for efficient evaluation of long-range pairwise interactions in atomistic and coarse-grained molecular simulation.

    Energy Technology Data Exchange (ETDEWEB)

    Bond, Stephen D.


    The availability of efficient algorithms for long-range pairwise interactions is central to the success of numerous applications, ranging in scale from atomic-level modeling of materials to astrophysics. This report focuses on the implementation and analysis of the multilevel summation method for approximating long-range pairwise interactions. The computational cost of the multilevel summation method is proportional to the number of particles, N, which is an improvement over FFTbased methods whos cost is asymptotically proportional to N logN. In addition to approximating electrostatic forces, the multilevel summation method can be use to efficiently approximate convolutions with long-range kernels. As an application, we apply the multilevel summation method to a discretized integral equation formulation of the regularized generalized Poisson equation. Numerical results are presented using an implementation of the multilevel summation method in the LAMMPS software package. Preliminary results show that the computational cost of the method scales as expected, but there is still a need for further optimization.

  8. Controlling the Electronic Structure of Graphene Using Surface-Adsorbate Interactions (United States)


    et al., Electronic structure of graphene on single-crystal copper substrates. Physical Review B, 2011. 84(19): p. 195443-195443. 8. Amft, M., et...1 Controlling the electronic structure of graphene using surface-adsorbate interactions Piotr Matyba, Adra V. Carr, Cong Chen, David L. Miller...atomic orbitals in graphene on Ni(111) opens a large energy gap of ≈2.8 eV between non-hybridized states at the K-point. Here we use alkali metal

  9. Interlayer Interaction and Electronic Screening in Multilayer Graphene Investigated with Angle-Resolved Photoemission Spectroscopy (United States)

    Ohta, Taisuke; Bostwick, Aaron; McChesney, J. L.; Seyller, Thomas; Horn, Karsten; Rotenberg, Eli


    The unusual transport properties of graphene are the direct consequence of a peculiar band structure near the Dirac point. We determine the shape of the π bands and their characteristic splitting, and find the transition from two-dimensional to bulk character for 1 to 4 layers of graphene by angle-resolved photoemission. By detailed measurements of the π bands we derive the stacking order, layer-dependent electron potential, screening length, and strength of interlayer interaction by comparison with tight binding calculations, yielding a comprehensive description of multilayer graphene’s electronic structure.

  10. Intermolecular interaction effect on the inelastic electron tunneling spectroscopy of bi-octane-monothiol junctions (United States)

    Leng, Jiancai; Zhao, Liyun; Zhang, Yujin; Ma, Hong


    The inelastic electron tunneling spectroscopy (IETS) of bi-octane-monothiol junctions is theoretically studied based on first-principles calculations. The results reveal that IETS is very sensitive to the vertical and lateral distance of the two molecules in the bimolecular junctions owing to the changes of interaction between the two molecules. It is further demonstrated that the transverse vibrational modes ν(C-H) around 0.38 V will be triggered when the two molecules are close to each other and open a new path for electron tunneling. Our theoretical results provide new insight into understanding the origin of the IETS peaks around 0.38 V.

  11. Chirped Auger electron emission due to field-assisted post-collision interaction

    Directory of Open Access Journals (Sweden)

    Bonitz M.


    Full Text Available We have investigated the Auger decay in the temporal domain by applying a terahertz streaking light field. Xenon and krypton atoms were studied by implementing the free-electron laser in Hamburg (FLASH as well as a source of high-order harmonic radiation combined with terahertz pulses from an optical rectification source. The observed linewidth asymmetries in the streaked spectra suggest a chirped Auger electron emission which is understood in terms of field-assisted post-collision interaction. The experimentally obtained results agree well with model calculations.

  12. Incident ion charge state dependence of electron emission during slow multicharged ion-surface interactions

    Energy Technology Data Exchange (ETDEWEB)

    Hughes, I.G. (Oak Ridge National Laboratory, Oak Ridge, TN 37831-6372 (United States) Joint Institute for Heavy Ion Research, Holifield Heavy Ion Research, Facility, Oak Ridge, TN 37831-6734 (United States)); Havener, C.C.; Overbury, S.H.; Robinson, M.T.; Zehner, D.M. (Oak Ridge National Laboratory, Oak Ridge, TN 37831-6732 (United States)); Zeijlmans van Emmichoven, P.A. (Oak Ridge National Laboratory, Oak Ridge, TN 37831-6732 (United States) Joint Institute for Heavy Ion Research, Holifield Heavy Ion Research Facility, Oak Ridge, TN 37821-6734 (United States)); Meyer, F.W. (Oak Ridge National Laboratory, Oak Ridge, TN 37831-6732 (United States))


    Characteristic variations in the total electron yield [gamma] as a function of crystal azimuthal orientation are reported for slow N[sup 2+], N[sup 5+] and N[sup 6+] ions incident on a Au(011) single crystal, together with measurements of [gamma] as a function of incident ion velocity. Kinetic electron emission is shown to arise predominantly in close collisions between incident ions and target atoms, and potential electron emission is found to be essentially constant within our present velocity range. The incident ion charge state is shown to play no role in kinetic electron emission. Extremely fast neutralization times of the order of 10[sup [minus]15] secs are needed to explain the observations.

  13. Interaction of electron beams with optical nanostructures and metamaterials: from coherent photon sources towards shaping the wave function (United States)

    Talebi, Nahid


    Investigating the interaction of electron beams with materials and light has been a field of research for more than a century. The field was advanced theoretically by the rise of quantum mechanics and technically by the introduction of electron microscopes and accelerators. It is possible nowadays to uncover a multitude of information from electron-induced excitations in matter by means of advanced techniques like holography, tomography, and, most recently, photon-induced near-field electron microscopy. The question is whether the interaction can be controlled in an even, more efficient way in order to unravel important questions like modal decomposition of the electron-induced polarization by performing experiments with better spatial, temporal, and energy resolutions. This review discusses recent advances in controlling electron and light interactions at the nanoscale. Theoretical and numerical aspects of the interaction of electrons with nanostructures and metamaterials will be discussed with the aim of understanding the mechanisms of radiation in the interaction of electrons with even more sophisticated structures. Based on these mechanisms of radiation, state-of-the art and novel electron-driven few-photon sources will be discussed. Applications of such sources to gain an understanding of quantum optical effects and also to perform spectral interferometry with electron microscopes will be covered. In an inverse approach, as in the case of the inverse Smith-Purcell effect, laser-induced excitations of nanostructures can cause electron beams traveling in the near-field of such structures to accelerate, provided a synchronization criterion is satisfied. This effect is the basis for linear dielectric and metallic electron accelerators. Moreover, acceleration is accompanied by bunching of the electrons. When single electrons are considered, an efficient design of nanostructures can lead to the shaping of the electron wave function travelling adjacent to them, for

  14. Electron Generation and Transport in Intense Relativistic Laser-Plasma Interactions Relevant to Fast Ignition ICF

    Energy Technology Data Exchange (ETDEWEB)

    Ma, Tammy Yee Wing [Univ. of California, San Diego, CA (United States)


    The reentrant cone approach to Fast Ignition, an advanced Inertial Confinement Fusion scheme, remains one of the most attractive because of the potential to efficiently collect and guide the laser light into the cone tip and direct energetic electrons into the high density core of the fuel. However, in the presence of a preformed plasma, the laser energy is largely absorbed before it can reach the cone tip. Full scale fast ignition laser systems are envisioned to have prepulses ranging between 100 mJ to 1 J. A few of the imperative issues facing fast ignition, then, are the conversion efficiency with which the laser light is converted to hot electrons, the subsequent transport characteristics of those electrons, and requirements for maximum allowable prepulse this may put on the laser system. This dissertation examines the laser-to-fast electron conversion efficiency scaling with prepulse for cone-guided fast ignition. Work in developing an extreme ultraviolet imager diagnostic for the temperature measurements of electron-heated targets, as well as the validation of the use of a thin wire for simultaneous determination of electron number density and electron temperature will be discussed.

  15. Mobility and bulk electron-phonon interaction in two-dimensional materials

    DEFF Research Database (Denmark)

    Gunst, Tue; Brandbyge, Mads; Markussen, Troels


    We present calculations of the phonon-limited mobility in intrinsic n-type monolayer graphene, silicene and MoS2. The material properties, including the electron-phonon interaction, are calculated from first principles. Unlike graphene, the carriers in silicene show strong interaction with the out......-of-plane modes. However, we find that graphene only has a slightly higher mobility compared to silicene. For MoS2 we obtain several orders of magnitude lower mobilities and in agreement with other recent theoretical results. The simulations illustrate the predictive capabilities of the newly implemented...

  16. Interaction of suprathermal solar wind electron fluxes with sheared whistler waves: fan instability

    Directory of Open Access Journals (Sweden)

    C. Krafft

    Full Text Available Several in situ measurements performed in the solar wind evidenced that solar type III radio bursts were some-times associated with locally excited Langmuir waves, high-energy electron fluxes and low-frequency electrostatic and electromagnetic waves; moreover, in some cases, the simultaneous identification of energetic electron fluxes, Langmuir and whistler waves was performed. This paper shows how whistlers can be excited in the disturbed solar wind through the so-called "fan instability" by interacting with energetic electrons at the anomalous Doppler resonance. This instability process, which is driven by the anisotropy in the energetic electron velocity distribution along the ambient magnetic field, does not require any positive slope in the suprathermal electron tail and thus can account for physical situations where plateaued reduced electron velocity distributions were observed in solar wind plasmas in association with Langmuir and whistler waves. Owing to linear calculations of growth rates, we show that for disturbed solar wind conditions (that is, when suprathermal particle fluxes propagate along the ambient magnetic field, the fan instability can excite VLF waves (whistlers and lower hybrid waves with characteristics close to those observed in space experiments.

    Key words. Space plasma physics (waves and instabilities – Radio Science (waves in plasma – Solar physics, astrophysics and astronomy (radio emissions

  17. Hot electron production in laser solid interactions with a controlled pre-pulse

    Energy Technology Data Exchange (ETDEWEB)

    Culfa, O.; Tallents, G. J.; Wagenaars, E.; Ridgers, C. P.; Dance, R. J.; Rossall, A. K.; Woolsey, N. C. [York Plasma Institute, Department of Physics, The University of York, York YO10 5DD (United Kingdom); Gray, R. J.; McKenna, P. [Department of Physics, SUPA, University of Strathclyde, Glasgow G4 0NG (United Kingdom); Brown, C. D. R.; James, S. F.; Hoarty, D. J. [AWE, Aldermaston, Reading, Berkshire RG7 4PR (United Kingdom); Booth, N.; Robinson, A. P. L. [CLF, STFC Rutherford Appleton Laboratory, Didcot, Oxfordshire OX11 0QX (United Kingdom); Lancaster, K. L. [York Plasma Institute, Department of Physics, The University of York, York YO10 5DD (United Kingdom); CLF, STFC Rutherford Appleton Laboratory, Didcot, Oxfordshire OX11 0QX (United Kingdom); Pikuz, S. A. [Joint Institute for High Temperatures, Russian Academy of Sciences, Moscow 125412 (Russian Federation); Faenov, A. Ya. [Joint Institute for High Temperatures, Russian Academy of Sciences, Moscow 125412 (Russian Federation); Quantum Beam Science Directorate, Japan Atomic Energy Agency, Kizugawa, Kyoto 619-0215 (Japan); Kampfer, T.; Schulze, K. S.; Uschmann, I. [Friedrich Schiller University of Jena, D-07743 Jena (Germany)


    Hot electron generation plays an important role in the fast ignition approach to inertial confinement fusion (ICF) and other applications with ultra-intense lasers. Hot electrons of temperature up to 10–20 MeV have been produced by high contrast picosecond duration laser pulses focussed to intensities of ∼10{sup 20} W cm{sup −2} with a deliberate pre-pulse on solid targets using the Vulcan Petawatt Laser facility. We present measurements of the number and temperature of hot electrons obtained using an electron spectrometer. The results are correlated to the density scale length of the plasma produced by a controlled pre-pulse measured using an optical probe diagnostic. 1D simulations predict electron temperature variations with plasma density scale length in agreement with the experiment at shorter plasma scale lengths (<7.5μm), but with the experimental temperatures (13–17 MeV) dropping below the simulation values (20–25 MeV) at longer scale lengths. The experimental results show that longer interaction plasmas produced by pre-pulses enable significantly greater number of hot electrons to be produced.

  18. The high luminosity interaction region for a ring-ring Large Hadron Electron Collider (United States)

    Appleby, R. B.; Thompson, L.; Holzer, B.; Fitterer, M.; Bernard, N.; Kostka, P.


    The Large Hadron Electron Collider (LHeC) project is a proposal for high luminosity TeV-scale electron-proton (ep) collisions at the LHC. The LHeC Conceptual Design Report presented an early overview of the machine, including an electron linac solution and a solution involving a 60 GeV electron storage ring. Here we present a new complete solution for the collision insertion of this electron ring, incorporating all constraints including those imposed by the LHC and, for the first time, proving the feasibility of ep collisions at a luminosity of ˜1033 cm-2s-1 in the LHC era. The solution presented offers high luminosity while maintaining the large detector coverage required by the particle physics programme. This negates the earlier need for two separate interaction region designs, one optimized for high luminosity at the cost of detector coverage, and the other for lower luminosity but higher coverage. Synchrotron radiation emission is also a major factor in electron accelerator design, and studies are presented showing the feasibility of the design in this regard. The design is found to be technically viable, solving the problem of TeV-scale, high luminosity and high coverage ep collisions at a ring-ring LHeC.

  19. A new fluorogenic sensing platform for salicylic acid derivatives based on π-π and NH-π interactions between electron-deficient and electron-rich aromatics (United States)

    Pandith, Anup; Hazra, Giridhari; Kim, Hong-Seok


    A novel simple fluorescent probe was designed for the recognition of electron-rich salicylic acid derivatives (SAs). The imidazole-appended aminomethyl perylene probe 1 selectively differentiated between electron-rich amino-SAs and electron-deficient nitro-SAs in EtOH, exhibiting the highest selectivity and sensitivity toward 5-aminosalicylic acid (5-ASA) and showing strong 1:1 binding (Ka = 1.37 × 107 M- 1). This high selectivity and sensitivity resulted from the synergistic multiple hydrogen bonding interactions of secondary amine and imidazole units and π-π interactions between electron-rich and electron-deficient rings, along with the unusual NH-π interactions between 5-ASA and the perylene moiety of 1. The limit of detection (LOD) for 5-ASA in EtOH was 0.012 ppb.

  20. Electron-phonon interaction effect on the energy levels and diamagnetic susceptibility of quantum wires: Parallelogram and triangle cross section (United States)

    Khordad, R.; Bahramiyan, H.


    In this paper, optical phonon modes are studied within the framework of dielectric continuum approach for parallelogram and triangular quantum wires, including the derivation of the electron-phonon interaction Hamiltonian and a discussion on the effects of this interaction on the electronic energy levels. The polaronic energy shift is calculated for both ground-state and excited-state electron energy levels by applying the perturbative approach. The effects of the electron-phonon interaction on the expectation value of r2 and diamagnetic susceptibility for both quantum wires are discussed.

  1. Radiation-Hardening of Best-in-Class SiGe Mixed-Signal and RF Electronics for Ultra-Wide Temperature Range Project (United States)

    National Aeronautics and Space Administration — Innovative, reliable, low-power, and low-noise electronics that can operate over a wide temperature range and high radiation are critical for future NASA missions....

  2. Beam-beam interaction studies at the Cornell Electron Storage Ring

    Directory of Open Access Journals (Sweden)

    M. G. Billing


    Full Text Available The Cornell Electron Storage Ring (CESR operates with 2 GeV multibunch electron and positron beams in a single beam pipe. Electrostatic separators are used to separate the two counterrotating beams at the parasitic crossings. When the beam energy was lowered from 5 GeV in 2003, the strength of the beam-beam interaction became a more important factor in beam-current limitations, resulting in extensive experimental and modeling studies of their characteristics. The CESR lattice design procedure has been modified recently to account explicitly for their dynamic consequences. We describe our modeling of the beam-beam interaction, experimental validation techniques, and investigations into compensation strategies.

  3. Emerging trends in molecular interactions between plants and the broad host range fungal pathogens Botrytis cinerea and Sclerotinia sclerotiorum

    Directory of Open Access Journals (Sweden)

    Malick eMbengue


    Full Text Available Fungal plant pathogens are major threats to food security worldwide. Sclerotinia sclerotiorum and Botrytis cinerea are closely related Ascomycete plant pathogens causing mold diseases on hundreds of plant species. There is no genetic source of complete plant resistance to these broad host range pathogens known to date. Instead, natural plant populations show a continuum of resistance levels controlled by multiple genes, a phenotype designated as quantitative disease resistance. Little is known about the molecular mechanisms controlling the interaction between plants and S. sclerotiorum and B. cinerea but significant advances were made on this topic in the last years. This minireview highlights a selection of nine themes that emerged in recent research reports on the molecular bases of plant-S. sclerotiorum and plant-B. cinerea interactions. On the fungal side, this includes progress on understanding the role of oxalic acid, on the study of fungal small secreted proteins. Next, we discuss the exchanges of small RNA between organisms and the control of cell death in plant and fungi during pathogenic interactions. Finally on the plant side, we highlight defense priming by mechanical signals, the characterization of plant Receptor-like proteins and the hormone abscisic acid in the response to B. cinerea and S. sclerotiorum , the role of plant general transcription machinery and plant small bioactive peptides. These represent nine trends we selected as remarkable in our understanding of fungal molecules causing disease and plant mechanisms associated with disease resistance to two devastating broad host range fungi.

  4. Aharonov-Bohm effect in a helical ring with long-range hopping: Effects of Rashba spin-orbit interaction and disorder (United States)

    Dutta, Paramita; Saha, Arijit; Jayannavar, A. M.


    We study the Aharonov-Bohm effect in a two-terminal helical ring with long-range hopping in the presence of Rashba spin-orbit interaction. We explore how the spin polarization behavior changes depending on the applied magnetic flux and the incoming electron energy. The most interesting feature that we articulate in this system is that zero-energy crossings appear in the energy spectra at Φ =0 and also at integer multiples of half-flux quantum values (n Φ0/2 ,n being an integer) of the applied magnetic flux. We investigate the transport properties of the ring using Green's function formalism and find that the zero-energy transmission peaks corresponding to those zero-energy crossings vanish in the presence of Rashba spin-orbit interaction. We also incorporate static random disorder in our system and show that the zero-energy crossings and transmission peaks are not immune to disorder even in the absence of Rashba spin-orbit interaction. The latter prevents the possibility of these helical states in the ring behaving like topological insulator edge states.

  5. Monte Carlo configuration interaction applied to multipole moments, ionisation energies and electron affinities. (United States)

    Coe, Jeremy P; Taylor, Daniel J; Paterson, Martin J


    The method of Monte Carlo configuration interaction (MCCI) (Greer, J. Chem. Phys. 1995a, 103, 1821; Tong, Nolan, Cheng, and Greer, Comp. Phys. Comm. 2000, 142, 132) is applied to the calculation of multipole moments. We look at the ground and excited state dipole moments in carbon monoxide. We then consider the dipole of NO, the quadrupole of N2 and of BH. An octupole of methane is also calculated. We consider experimental geometries and also stretched bonds. We show that these nonvariational quantities may be found to relatively good accuracy when compared with full configuration interaction results, yet using only a small fraction of the full configuration interaction space. MCCI results in the aug-cc-pVDZ basis are seen to generally have reasonably good agreement with experiment. We also investigate the performance of MCCI when applied to ionisation energies and electron affinities of atoms in an aug-cc-pVQZ basis. We compare the MCCI results with full configuration interaction quantum Monte Carlo (Booth and Alavi, J. Chem. Phys. 2010, 132, 174104; Cleland, Booth, and Alavi, J. Chem. Phys. 2011, 134, 024112) and "exact" nonrelativistic results (Booth and Alavi, J. Chem. Phys. 2010, 132, 174104; Cleland, Booth, and Alavi, J. Chem. Phys. 2011, 134, 024112). We show that MCCI could be a useful alternative for the calculation of atomic ionisation energies however electron affinities appear much more challenging for MCCI. Due to the small magnitude of the electron affinities their percentage errors can be high, but with regards to absolute errors MCCI performs similarly for ionisation energies and electron affinities. Copyright © 2013 Wiley Periodicals, Inc.

  6. Interaction-induced huge magnetoresistance in a high mobility two-dimensional electron gas

    Energy Technology Data Exchange (ETDEWEB)

    Bockhorn, L.; Haug, R. J. [Institut für Festkörperphysik, Leibniz Universität Hannover, D-30167 Hannover (Germany); Gornyi, I. V. [Institut für Nanotechnologie, Karlsruher Institut of Technology, D-76021 Karlsruhe (Germany); Schuh, D. [Institut für Experimentelle und Angewandte Physik, Universität Regensburg, D-93053 Regensburg (Germany); Wegscheider, W. [ETH Zürich (Switzerland)


    A strong negative magnetoresistance is observed in a high-mobility two-dimensional electron gas in a GaAs/Al{sub 0.3}Ga{sub 0.7}As quantum well. We discuss that the negative magnetoresistance consists of a small peak induced by a combination of two types of disorder and a huge magnetoresistance explained by the interaction correction to the conductivity for mixed disorder.

  7. Excessive production of electron pairs by soft photons in low multiplicity ion interactions (United States)

    Burnett, T. H.; Dake, S.; Fuki, M.; Gregory, J. C.; Hayashi, T.; Holynski, R.; Iwai, J.; Jones, W. V.; Jurak, A.; Lord, J. J.


    Three multiply charged primary cosmic ray interactions with carbon nuclei are reported, in which the number of materialized electron pairs within a distance of about 0.3 conversion length is larger than predicted from isospin considerations. These are the most energetic (sigma E gamma 4 TeV) of the low multiplicity ( 15 tracks) events observed in the Japanese-American Cooperative Experiment (JACEE-2) emulsion chamber.

  8. The weak π − π interaction originated resonant tunneling and fast switching in the carbon based electronic devices

    Directory of Open Access Journals (Sweden)

    Jun He


    Full Text Available By means of the nonequilibrium Green's functions and the density functional theory, we have investigated the electronic transport properties of C60 based electronic device with different intermolecular interactions. It is found that the electronic transport properties vary with the types of the interaction between two C60 molecules. A fast electrical switching behavior based on negative differential resistance has been found when two molecules are coupled by the weak π − π interaction. Compared to the solid bonding, the weak interaction is found to induce resonant tunneling, which is responsible for the fast response to the applied electric field and hence the velocity of switching.

  9. Simulating the Agostic Interaction in Electron-deficient (16-e) Group ...

    African Journals Online (AJOL)


    tion exist or not is the structure of the complex. The distance that separates the hydrogen atom and the metal is in the range of. 1.8–2.3 Å, while the M-H-C angle is in the range 90–140°. With recent advances in the computational chemistry theoretical methods have became powerful tools in characterizing such interactions.

  10. Ultrafast unequilibrium electron dynamics of aluminium interacting with an ultra-intense x-ray pulse (United States)

    Gao, Cheng; Zeng, Jiaolong; Yuan, Jianmin


    Ultrafast nonequilibrium dynamics of free electrons in an ultra-intense and ultrafast x-ray pulse interacting with a solid-density aluminium is investigated by solving Fokker-Planck equation. X-ray propagation through aluminium is determined by solving a one-dimensional radiative transfer equation which is coupled with a time-dependent rate equation. Although high energy electrons are evidently nonequilibrium, they account for a small population fraction in the total free electrons. The transmission of an ultra-intense x-ray pulse through a 1 um thick solid-density aluminium sample is calculated and compared with a recent experiment, where good agreement is found and saturable absorption is evidently observed.

  11. Interaction of magnetized electrons with a boundary sheath: investigation of a specular reflection model (United States)

    Krüger, Dennis; Brinkmann, Ralf Peter


    This publication reports analytical and numerical results concerning the interaction of gyrating electrons with a plasma boundary sheath, with focus on partially magnetized technological plasmas. It is assumed that the electron Debye length {λ }{{D}} is much smaller than the electron gyroradius {r}{{L}}, and {r}{{L}} in turn much smaller than the mean free path λ and the gradient length L of the fields. Focusing on the scale of the gyroradius, the sheath is assumed as infinitesimally thin ({λ }{{D}}\\to 0), collisions are neglected (λ \\to ∞ ), the magnetic field is taken as homogeneous, and electric fields (=potential gradients) in the bulk are neglected (L\\to ∞ ). The interaction of an electron with the electric field of the plasma boundary sheath is represented by a specular reflection {v}\\to {v}-2{v}\\cdot {{e}}z {{e}}z of the velocity {v} at the plane z = 0 of a naturally oriented Cartesian coordinate system (x,y,z). The electron trajectory is then given as sequences of helical sections, with the kinetic energy ɛ and the canonical momenta p x and p y conserved, but not the position of the axis (base point {{R}}0), the slope (pitch angle χ), and the phase (gyrophase φ). A ‘virtual interaction’ which directly maps the incoming electrons to the outgoing ones is introduced and studied in dependence of the angle γ between the field and the sheath normal {{e}}z. The corresponding scattering operator is constructed, mathematically characterized, and given as an infinite matrix. An equivalent boundary condition for a transformed kinetic model is derived.

  12. Critical Behavior of a Strongly-Interacting 2D Electron System (United States)

    Sarachik, Myriam P.


    Two-dimensional (2D) electron systems that obey Fermi liquid theory at high electron densities are expected to undergo one or more transitions to spatially and/or spin-ordered phases as the density is decreased, ultimately forming a Wigner crystal in the dilute, strongly-interacting limit. Interesting, unexpected behavior is observed with decreasing electron density as the electrons' interactions become increasingly important relative to their kinetic energy: the resistivity undergoes a transition from metallic to insulating temperature dependence; the resistance increases sharply and then saturates abruptly with increasing in-plane magnetic field; a number of experiments indicate that the electrons' effective mass exhibits a substantial increase approaching a finite ``critical'' density. There has been a great deal of debate concerning the underlying physics in these systems, and many have questioned whether the change of the resistivity from metallic to insulating signals a phase transition or a crossover. In this talk, I will report measurements that show that with decreasing density ns, the thermopower S of a low-disorder 2D electron system in silicon exhibits a sharp increase by more than an order of magnitude, tending to a divergence at a finite, disorder-independent density nt, consistent with the critical form (- T / S) ~(ns -nt) x with x = 1 . 0 +/- 0 . 1 (T is the temperature). Unlike the resistivity which may not clearly distinguish between a transition and crossover behavior, the thermopower provides clear evidence that a true phase transition occurs with decreasing density to a new low-density phase. Work supported by DOE Grant DE-FG02-84ER45153, BSF grant 2006375, RFBR, RAS, and the Russian Ministry of Science.

  13. Soluto-inertial phenomena: Designing long-range, long-lasting, surface-specific interactions in suspensions. (United States)

    Banerjee, Anirudha; Williams, Ian; Azevedo, Rodrigo Nery; Helgeson, Matthew E; Squires, Todd M


    Equilibrium interactions between particles in aqueous suspensions are limited to distances less than 1 μm. Here, we describe a versatile concept to design and engineer nonequilibrium interactions whose magnitude and direction depends on the surface chemistry of the suspended particles, and whose range may extend over hundreds of microns and last thousands of seconds. The mechanism described here relies on diffusiophoresis, in which suspended particles migrate in response to gradients in solution. Three ingredients are involved: a soluto-inertial "beacon" designed to emit a steady flux of solute over long time scales; suspended particles that migrate in response to the solute flux; and the solute itself, which mediates the interaction. We demonstrate soluto-inertial interactions that extend for nearly half a millimeter and last for tens of minutes, and which are attractive or repulsive, depending on the surface chemistry of the suspended particles. Experiments agree quantitatively with scaling arguments and numerical computations, confirming the basic phenomenon, revealing design strategies, and suggesting a broad set of new possibilities for the manipulation and control of suspended particles.

  14. Spin-orbit interaction in a two-dimensional electron gas in a InAs/AlSb quantum well with gate-controlled electron density

    NARCIS (Netherlands)

    Heida, J.P.; Wees, B.J. van; Kuipers, J.J.; Klapwijk, T.M.; Borghs, G.


    We present experiments on the tuning of the spin-orbit interaction in a two-dimensional electron gas in an asymmetric InAs/AlSb quantum well using a gate. The observed dependence of the spin splitting energy on the electron density can be attributed solely to the change in the Fermi wave vector. The

  15. Protein–nanoparticle interaction in bioconjugated silver nanoparticles: A transmission electron microscopy and surface enhanced Raman spectroscopy study

    Energy Technology Data Exchange (ETDEWEB)

    Reymond-Laruinaz, Sébastien; Saviot, Lucien; Potin, Valérie; Marco de Lucas, María del Carmen, E-mail:


    Highlights: • Synthesis of protein-conjugated Ag nanoparticles (NPs) in absence of citrates. • NPs size and protein layer thickness determined by TEM. • SERS spectra showed the chemisorption of proteins on the surface of Ag-NPs. - Abstract: Understanding the mechanisms of interaction between proteins and noble metal nanoparticles (NPs) is crucial to extend the use of NPs in biological applications and nanomedicine. We report the synthesis of Ag-NPs:protein bioconjugates synthesized in total absence of citrates or other stabilizing agents in order to study the NP-protein interaction. Four common proteins (lysozyme, bovine serum albumin, cytochrome-C and hemoglobin) were used in this work. Transmission electron microscopy (TEM) and surface enhanced Raman spectroscopy (SERS) were mainly used to study these bioconjugated NPs. TEM images showed Ag NPs with sizes in the 5–40 nm range. The presence of a protein layer surrounding the Ag NPs was also observed by TEM. Moreover, the composition at different points of single bioconjugated NPs was probed by electron energy loss spectroscopy (EELS). The thickness of the protein layer varies in the 3–15 nm range and the Ag NPs are a few nanometers away. This allowed to obtain an enhancement of the Raman signal of the proteins in the analysis of water suspensions of bioconjugates. SERS results showed a broadening of the Raman bands of the proteins which we attribute to the contribution of different configurations of the proteins adsorbed on the Ag NPs surface. Moreover, the assignment of an intense and sharp peak in the low-frequency range to Ag–N vibrations points to the chemisorption of the proteins on the Ag-NPs surface.

  16. Effective oscillator strength distributions of spherically symmetric atoms for calculating polarizabilities and long-range atom–atom interactions

    Energy Technology Data Exchange (ETDEWEB)

    Jiang, Jun, E-mail: [Key Laboratory of Atomic and Molecular Physics and Functional Materials of Gansu Province, College of Physics and Electronic Engineering, Northwest Normal University, Lanzhou 730070 (China); School of Engineering, Charles Darwin University, Darwin, Northern Territory, 0909 (Australia); Mitroy, J. [School of Engineering, Charles Darwin University, Darwin, Northern Territory, 0909 (Australia); Cheng, Yongjun, E-mail: [School of Engineering, Charles Darwin University, Darwin, Northern Territory, 0909 (Australia); Academy of Fundamental and Interdisciplinary Science, Harbin Institute of Technology, Harbin 150080 (China); Bromley, M.W.J., E-mail: [School of Mathematics and Physics, The University of Queensland, Brisbane, Queensland 4075 (Australia)


    Effective oscillator strength distributions are systematically generated and tabulated for the alkali atoms, the alkaline-earth atoms, the alkaline-earth ions, the rare gases and some miscellaneous atoms. These effective distributions are used to compute the dipole, quadrupole and octupole static polarizabilities, and are then applied to the calculation of the dynamic polarizabilities at imaginary frequencies. These polarizabilities can be used to determine the long-range C{sub 6}, C{sub 8} and C{sub 10} atom–atom interactions for the dimers formed from any of these atoms and ions, and we present tables covering all of these combinations.

  17. Cluster decay half-lives of trans-lead nuclei based on a finite-range nucleon–nucleon interaction

    Energy Technology Data Exchange (ETDEWEB)

    Adel, A., E-mail: [Physics Department, Faculty of Science, Cairo University, Giza (Egypt); Physics Department, College of Science, Majmaah University, Zulfi (Saudi Arabia); Alharbi, T. [Physics Department, College of Science, Majmaah University, Zulfi (Saudi Arabia)


    Nuclear cluster radioactivity is investigated using microscopic potentials in the framework of the Wentzel–Kramers–Brillouin approximation of quantum tunneling by considering the Bohr–Sommerfeld quantization condition. The microscopic cluster–daughter potential is numerically constructed in the well-established double-folding model. A realistic M3Y-Paris NN interaction with the finite-range exchange part as well as the ordinary zero-range exchange NN force is considered in the present work. The influence of nuclear deformations on the cluster decay half-lives is investigated. Based on the available experimental data, the cluster preformation factors are extracted from the calculated and the measured half lives of cluster radioactivity. Some useful predictions of cluster emission half-lives are made for emissions of known clusters from possible candidates, which may guide future experiments.

  18. Experimental and theoretical studies of picosecond laser interactions with electronic materials-laser ablation

    Energy Technology Data Exchange (ETDEWEB)

    Mao, Samuel S. [Univ. of California, Berkeley, CA (United States)


    Lasers having picosecond and shorter pulse duration are receiving much attention due to their capabilities for direct-write micromachining on many materials with minimal substrate damage. Substantial progress has been made in the understanding of laser ablation processes, particularly the creation of plasmas that often shield the target and reduce the material processing efficiency at nanosecond time scales. However, a considerable challenge that still remains is the understanding of the underlying mechanisms during picosecond laser interactions with electronic solids. In this work we first study picosecond laser-induced electron emission from semiconductor surfaces. A theoretical model was set up based on carrier transport inside the semiconductor material during picosecond laser-semiconductor interactions. We demonstrate that nonequilibrium carrier dynamics plays a significant role for picosecond, as well as short nanosecond, laser induced electron emission from semiconductors. Photoelectric effect is found to be responsible for electron emission at low incident laser fluences, whereas thermionic emission is dominant at higher fluences. We have also performed experimental and theoretical studies on the formation and subsequent evolution of plasmas during laser-metal interactions at the picosecond time scale. Using picosecond time-resolved shadowgrams ahd interferograms, a novel type of plasma is observed, which has an electron density on the order of 1020cm-3.The origin of this picosecond plasma is attributed to gas breakdown, which is caused by laser-induced electron emission fi-om the target surface. After the laser pulse is completed, the longitudinal expansion of the plasma is suppressed. This suppression is found to result from an electric field above the target that prevents, after laser irradiation, fbrther movement of the electrons inside the plasma. Measurements of lateral plasma expansion indicate that the picosecond plasma may absorb

  19. Tables and graphs of electron-interaction cross sections from 10 eV to 100 GeV derived from the LLNL Evaluated Electron Data Library (EEDL), Z = 1--100

    Energy Technology Data Exchange (ETDEWEB)

    Perkins, S.T.; Cullen, D.E. (Lawrence Livermore National Lab., CA (United States)); Seltzer, S.M. (National Inst. of Standards and Technology (NML), Gaithersburg, MD (United States). Center for Radiation Research)


    Energy-dependent evaluated electron interaction cross sections and related parameters are presented for elements H through Fm (Z = 1 to 100). Data are given over the energy range from 10 eV to 100 GeV. Cross sections and average energy deposits are presented in tabulated and graphic form. In addition, ionization cross sections and average energy deposits for each shell are presented in graphic form. This information is derived from the Livermore Evaluated Electron Data Library (EEDL) as of July, 1991.

  20. Helium like impurity in CdTe/ Cd1-xMnxTe semimagnetic semiconductors under magnetic field: Dimensionality effect on electron - Electron interaction (United States)

    Kalpana, Panneer Selvam; Jayakumar, Kalyanasundaram


    We study the effect of magnetic field on the Coulomb interaction between the two electrons confined inside a CdTe/Cd1-xMnxTe Quantum Well (QW), Quantum Well Wire (QWW) and Quantum Dot (QD) for the composition of Mn2+ ion, x = 0.3. The two particle Schrodinger equation has been solved using variational technique in the effective mass approximation. The results show that the applied magnetic field tremendously alters the Coulomb interaction of the electrons and their binding to the donor impurity by shrinking the spatial extension of the two particle wavefunction and leads to tunnelling through the barrier. The qualitative phenomenon involved in such variation of electron - electron interaction with the magnetic field has also been explained through the 3D - plot of the probability density function.

  1. Exact Wave Packet Dynamics of Singlet Fission in Unsubstituted and Substituted Polyene Chains within Long-Range Interacting Models

    CERN Document Server

    Prodhan, Suryoday


    Singlet fission is a potential pathway for significant enhancement of efficiency in organic solar cells. In this article, we have studied singlet fission in a pair of polyene molecules employing exact many-body wave packet dynamics. The individual molecules are treated within Hubbard and Pariser-Parr-Pople (PPP) models and the interaction between them involves transfer terms, intersite electron repulsions and site charge-bond charge repulsion terms. Initial wave packet is constructed from excited singlet state of one molecule and ground state of the other. Time development of this wave packet under the influence of intermolecular interactions is followed within the Schr\\"{o}dinger picture by an efficient predictor-corrector scheme. In unsubstituted Hubbard and PPP chains, $2{}^1A$ excited singlet state leads to significant fission yield while the $1{}^1B$ state gives negligible fission yield. On substitution by donor-acceptor groups of moderate strength, singlet state derived from $1{}^1B$ state also gives si...

  2. Nonlinear complexity of random visibility graph and Lempel-Ziv on multitype range-intensity interacting financial dynamics (United States)

    Zhang, Yali; Wang, Jun


    In an attempt to investigate the nonlinear complex evolution of financial dynamics, a new financial price model - the multitype range-intensity contact (MRIC) financial model, is developed based on the multitype range-intensity interacting contact system, in which the interaction and transmission of different types of investment attitudes in a stock market are simulated by viruses spreading. Two new random visibility graph (VG) based analyses and Lempel-Ziv complexity (LZC) are applied to study the complex behaviors of return time series and the corresponding random sorted series. The VG method is the complex network theory, and the LZC is a non-parametric measure of complexity reflecting the rate of new pattern generation of a series. In this work, the real stock market indices are considered to be comparatively studied with the simulation data of the proposed model. Further, the numerical empirical study shows the similar complexity behaviors between the model and the real markets, the research confirms that the financial model is reasonable to some extent.

  3. DNA binding by FOXP3 domain-swapped dimer suggests mechanisms of long-range chromosomal interactions

    Energy Technology Data Exchange (ETDEWEB)

    Chen, Yongheng; Chen, Chunxia; Zhang, Zhe; Liu, Chun-Chi; Johnson, Matthew E.; Espinoza, Celso A.; Edsall, Lee E.; Ren, Bing; Zhou, Xianghong Jasmine; Grant, Struan F.A.; Wells, Andrew D.; Chen, Lin (LICR); (UPENN); (USC)


    FOXP3 is a lineage-specific transcription factor that is required for regulatory T cell development and function. In this study, we determined the crystal structure of the FOXP3 forkhead domain bound to DNA. The structure reveals that FOXP3 can form a stable domain-swapped dimer to bridge DNA in the absence of cofactors, suggesting that FOXP3 may play a role in long-range gene interactions. To test this hypothesis, we used circular chromosome conformation capture coupled with high throughput sequencing (4C-seq) to analyze FOXP3-dependent genomic contacts around a known FOXP3-bound locus, Ptpn22. Our studies reveal that FOXP3 induces significant changes in the chromatin contacts between the Ptpn22 locus and other Foxp3-regulated genes, reflecting a mechanism by which FOXP3 reorganizes the genome architecture to coordinate the expression of its target genes. Our results suggest that FOXP3 mediates long-range chromatin interactions as part of its mechanisms to regulate specific gene expression in regulatory T cells.

  4. The importance of the on-site electron-electron interaction for the magnetic coupling in the zigzag spin-chain compound In2VO5

    KAUST Repository

    Wang, Hao


    We present first-principles electronic structure calculations for the zigzag spin-chain compound In2VO5 using the generalized gradient approximation both with and without inclusion of an on-site Coulomb interaction. It has been proposed that In2VO5 is characterized by itinerant V 3d electrons at high temperature and localized electrons at low temperature. Consequently, it is to be expected that electronic correlations play an important role for the magnetic transition from ferromagnetic to antiferromagnetic exchange around 120 K. In this context, we study the electronic and magnetic properties of a set of possible spin configurations. Our calculations show that inclusion of an on-site Coulomb interaction in fact changes the ground state from ferromagnetic to antiferromagnetic. © 2010 IOP Publishing Ltd.

  5. Yeast silent mating type loci form heterochromatic clusters through silencer protein-dependent long-range interactions.

    Directory of Open Access Journals (Sweden)

    Adriana Miele


    Full Text Available The organization of eukaryotic genomes is characterized by the presence of distinct euchromatic and heterochromatic sub-nuclear compartments. In Saccharomyces cerevisiae heterochromatic loci, including telomeres and silent mating type loci, form clusters at the nuclear periphery. We have employed live cell 3-D imaging and chromosome conformation capture (3C to determine the contribution of nuclear positioning and heterochromatic factors in mediating associations of the silent mating type loci. We identify specific long-range interactions between HML and HMR that are dependent upon silencing proteins Sir2p, Sir3p, and Sir4p as well as Sir1p and Esc2p, two proteins involved in establishment of silencing. Although clustering of these loci frequently occurs near the nuclear periphery, colocalization can occur equally at more internal positions and is not affected in strains deleted for membrane anchoring proteins yKu70p and Esc1p. In addition, appropriate nucleosome assembly plays a role, as deletion of ASF1 or combined disruption of the CAF-1 and HIR complexes abolishes the HML-HMR interaction. Further, silencer proteins are required for clustering, but complete loss of clustering in asf1 and esc2 mutants had only minor effects on silencing. Our results indicate that formation of heterochromatic clusters depends on correctly assembled heterochromatin at the silent loci and, in addition, identify an Asf1p-, Esc2p-, and Sir1p-dependent step in heterochromatin formation that is not essential for gene silencing but is required for long-range interactions.

  6. submitter Parametric study of transport beam lines for electron beams accelerated by laser-plasma interaction

    CERN Document Server

    Scisciò, M; Migliorati, M; Mostacci, A; Palumbo, L; Papaphilippou, Y; Antici, P


    In the last decade, laser-plasma acceleration of high-energy electrons has attracted strong attention in different fields. Electrons with maximum energies in the GeV range can be laser-accelerated within a few cm using multi-hundreds terawatt (TW) lasers, yielding to very high beam currents at the source (electron bunches with up to tens-hundreds of pC in a few fs). While initially the challenge was to increase the maximum achievable electron energy, today strong effort is put in the control and usability of these laser-generated beams that still lack of some features in order to be used for applications where currently conventional, radio-frequency (RF) based, electron beam lines represent the most common and efficient solution. Several improvements have been suggested for this purpose, some of them acting directly on the plasma source, some using beam shaping tools located downstream. Concerning the latter, several studies have suggested the use of conventional accelerator magnetic devices (such as quadrupo...

  7. Tunable insulator-quantum Hall transition in a weakly interacting two-dimensional electron system. (United States)

    Lo, Shun-Tsung; Wang, Yi-Ting; Lin, Sheng-Di; Strasser, Gottfried; Bird, Jonathan P; Chen, Yang-Fang; Liang, Chi-Te


    We have performed low-temperature measurements on a gated two-dimensional electron system in which electron-electron (e-e) interactions are insignificant. At low magnetic fields, disorder-driven movement of the crossing of longitudinal and Hall resistivities (ρxx and ρxy) can be observed. Interestingly, by applying different gate voltages, we demonstrate that such a crossing at ρxx ~ ρxy can occur at a magnetic field higher, lower, or equal to the temperature-independent point in ρxx which corresponds to the direct insulator-quantum Hall transition. We explicitly show that ρxx ~ ρxy occurs at the inverse of the classical Drude mobility 1/μD rather than the crossing field corresponding to the insulator-quantum Hall transition. Moreover, we show that the background magnetoresistance can affect the transport properties of our device significantly. Thus, we suggest that great care must be taken when calculating the renormalized mobility caused by e-e interactions.

  8. Study on mutual interactions and electronic structures of hyaluronan with Lysine, 6-Aminocaproic acid and Arginine. (United States)

    Chytil, Martin; Trojan, Martin; Kovalenko, Alexander


    Interactions between polyelectrolytes and oppositely charged surfactants have been in a great interest for several decades, yet the conventional surfactants may cause a problem in medical applications. Interactivity between polysaccharide hyaluronan (HA) and amino acids Lysine, 6-Aminocaproic acid (6-AcA), and Arginine as an alternative system is reported. The interactions were investigated by means of rheology and electric conductance and the electronic structures were explored by the density functional theory (DFT). Lysine exhibits the strongest interaction of all, which was manifested, e.g. by nearly 6-time drop of the initial viscosity comparing with only 1.3-time lower value in the case of 6-AcA. Arginine interaction with HA was surprisingly weaker in terms of viscosity than that of Lysine due to a lower and delocalized charge density on its guanidine group. According to the DFT calculations, the binding of Lysine to HA was found to be more flexible, while Arginine creates more rigid structure with HA. Copyright © 2016 Elsevier Ltd. All rights reserved.

  9. Molecular-scale tribology of amorphous carbon coatings: effects of film thickness, adhesion, and long-range interactions. (United States)

    Gao, G T; Mikulski, Paul T; Harrison, Judith A


    Classical molecular dynamics simulations have been conducted to investigate the atomic-scale friction and wear when hydrogen-terminated diamond (111) counterfaces are in sliding contact with diamond (111) surfaces coated with amorphous, hydrogen-free carbon films. Two films, with approximately the same ratio of sp(3)-to-sp(2) carbon, but different thicknesses, have been examined. Both systems give a similar average friction in the load range examined. Above a critical load, a series of tribochemical reactions occur resulting in a significant restructuring of the film. This restructuring is analogous to the "run-in" observed in macroscopic friction experiments and reduces the friction. The contribution of adhesion between the probe (counterface) and the sample to friction was examined by varying the saturation of the counterface. Decreasing the degree of counterface saturation, by reducing the hydrogen termination, increases the friction. Finally, the contribution of long-range interactions to friction was examined by using two potential energy functions that differ only in their long-range forces to examine friction in the same system.

  10. Effects of electron-phonon interaction on thermal and electrical transport through molecular nano-conductors

    Directory of Open Access Journals (Sweden)

    Jing-Tao Lü


    Full Text Available The topic of this review is the effects of electron-phonon interaction (EPI on the transport properties of molecular nano-conductors. A nano-conductor connects to two electron leads and two phonon leads, possibly at different temperatures or chemical potentials. The EPI appears only in the nano-conductor. We focus on its effects on charge and energy transport. We introduce three approaches. For weak EPI, we use the nonequilibrium Green’s function method to treat it perturbatively. We derive the expressions for the charge and heat currents. For weak system-lead couplings, we use the quantum master equation approach. In both cases, we use a simple single level model to study the effects of EPI on the system’s thermoelectric transport properties. It is also interesting to look at the effect of currents on the dynamics of the phonon system. For this, we derive a semi-classical generalized Langevin equation to describe the nano-conductor’s atomic dynamics, taking the nonequilibrium electron system, as well as the rest of the atomic degrees of freedom as effective baths. We show simple applications of this approach to the problem of energy transfer between electrons and phonons.

  11. Effect of interwall interaction on the electronic structure of double-walled carbon nanotubes. (United States)

    Soto, M; Boyer, T A; Biradar, S; Ge, L; Vajtai, R; Elías-Zúñiga, A; Ajayan, P M; Barrera, E V


    Through this study, the results of density functional theory calculations within the local density approximation of the electronic structure of zigzag-zigzag double-walled carbon nanotubes (DWCNTs), with chiral indices (n, 0)@(m, 0) for n = 7-15, and m = 15-26, has been presented and the effects of interwall interaction and orbital hybridization on the electronic structure of these systems has been discussed. It was observed that the electronic band gap of the aforementioned DWCNTs depends on the interwall distance only for metallic-semiconductor configurations and on the intrinsic properties of the constituent tubes in all other combinations. It was also observed that the calculated band gap for most of the metallic-metallic DWCNTs was smaller than semiconductor-metallic, metallic-semiconductor, and semiconductor-semiconductor configurations. Metallic-semiconductor DWCNTs were found to be desirable for band gap tuning applications because of their dependence on interwall distance, opening up the possibility of using such systems in electronic device applications, such as transistors. Other applications include the use of DWCNTs in macroscopic carbon nanotube conducting wires, for which metallic-metallic and semiconducting-metallic zigzag-zigzag DWCNTs were found to be the most desirable configurations due to their small band gaps.


    Directory of Open Access Journals (Sweden)

    Mykola A. Meleshko


    Full Text Available The article discusses the content of the «flash-book» construct, defining its properties and possible components. There are presented some examples of components programming steps of “authoring flash – book”, considered the possibility of using such an electronic document to optimize the learning process at the Technical University in the performance of laboratory training on general physics. The technique of its using to provide individualized approach to learning and the use of various experimental base from classical to digital equipment laboratories is proposed. It was carried out the analysis of ways to improve such interactive electronic document for the development of information technology competence of engineering students.


    Directory of Open Access Journals (Sweden)

    Anto Sulaksono


    Full Text Available The differential cross-section of neutrino interaction with dense and warm electron gasses has been calculated by takinginto account the neutrino electromagnetic form factors. The significant effect of electromagnetic properties of neutrinocan be found if the neutrino dipole moment, μ ν , is ≥ 5.10-9 μB and neutrino charge radius, Rv, is ≥ 5.10-6 MeV-1. Theimportance of the retarded correction, detailed balance and Pauli blocking factors is shown and analyzed. Many-bodyeffects on the target matter which are included via random phase approximation (RPA correlation as well as photoneffective mass are also investigated.

  14. Quantum corrected Langevin dynamics for adsorbates on metal surfaces interacting with hot electrons

    DEFF Research Database (Denmark)

    Olsen, Thomas; Schiøtz, Jakob


    We investigate the importance of including quantized initial conditions in Langevin dynamics for adsorbates interacting with a thermal reservoir of electrons. For quadratic potentials the time evolution is exactly described by a classical Langevin equation and it is shown how to rigorously obtain...... mechanical master equation approach. With CO on Cu(100) as an example, we demonstrate the effect for a system with ab initio frictional tensor and potential energy surfaces and show that quantizing the initial conditions can have a large impact on both the desorption probability and the distribution...

  15. Molecular modeling of interactions in electronic nose sensors for environmental monitoring (United States)

    Shevade, A. V.; Ryan, M. A.; Homer, M. L.; Manfreda, A. M.; Yen, S. -P. S.; Zhou, H.; Manatt, K.


    We report a study aimed at understanding analyte interactions with sensors made from polymer-carbon black composite films. The sensors are used in an Electronic Nose (ENose) which is used for monitoring the breathing air quality in human habitats. The model mimics the experimental conditions of the composite film deposition and formation and was developed using molecular modeling and simulation tools. The Dreiding 2.21 Force Field was used for the polymer and analyte molecules while graphite parameters were assigned to the carbon black atoms. The polymer considered for this work is methyl vinyl ether / maleic acid copolymer. The target analytes include both inorganic (NH3) and organic (methanol) types of compound. Results indicate different composite-analyte interaction behavior.

  16. Theory of substrate, Zeeman, and electron-phonon interaction effects on the quantum capacitance in graphene

    KAUST Repository

    Tahir, M.


    Since the discovery of graphene, a lot of interest has been attracted by the zeroth Landau level, which has no analog in the conventional two dimensional electron gas. Recently, lifting of the spin and valley degeneracies has been confirmed experimentally by capacitance measurements, while in transport experiments, this is difficult due to the scattering in the device. In this context, we model interaction effects on the quantum capacitance of graphene in the presence of a perpendicular magnetic field, finding good agreement with experiments. We demonstrate that the valley degeneracy is lifted by the substrate and by Kekule distortion, whereas the spin degeneracy is lifted by Zeeman interaction. The two cases can be distinguished by capacitance measurements.

  17. Use of scanning electron microscopy to monitor nanofibre/cell interaction in digestive epithelial cells. (United States)

    Millaku, Agron; Drobne, Damjana; Torkar, Matjaz; Novak, Sara; Remškar, Maja; Pipan-Tkalec, Živa


    We provide data obtained by scanning electron microscopy (SEM) and energy dispersive X-ray spectroscopy (EDS) on the interaction of ingested tungsten nanofibers with epithelial cells of the digestive tubes of a test organism Porcellio scaber. Conventional toxicity endpoints including feeding behaviour, weight loss and mortality were also measured in each investigated animal. No toxicity was detected in any of exposed animals after 14 days of feeding on tungsten nanofiber dosed food, but when nanofibers enter the digestive system they can react with epithelial cells of the digestive tubes, becoming physically inserted into the cells. In this way, nanofibers can injure the epithelial cells of digestive gland tubes when they are ingested with food. Our SEM data suggest that peristaltic forces may have an important role, not predicted by in vitro experiments, in the interactions of nanomaterials with digestive intestinal cells. Copyright © 2013 Elsevier B.V. All rights reserved.

  18. Interactions between low energy electrons and DNA: a perspective from first-principles simulations (United States)

    Kohanoff, Jorge; McAllister, Maeve; Tribello, Gareth A.; Gu, Bin


    DNA damage caused by irradiation has been studied for many decades. Such studies allow us to better assess the dangers posed by radiation, and to increase the efficiency of the radiotherapies that are used to combat cancer. A full description of the irradiation process involves multiple size and time scales. It starts with the interaction of radiation—either photons or swift ions—and the biological medium, which causes electronic excitation and ionisation. The two main products of ionising radiation are thus electrons and radicals. Both of these species can cause damage to biological molecules, in particular DNA. In the long run, this molecular level damage can prevent cells from replicating and can hence lead to cell death. For a long time it was assumed that the main actors in the damage process were the radicals. However, experiments in a seminal paper by the group of Leon Sanche in 2000 showed that low-energy electrons (LEE), such as those generated when ionising biological targets, can also cause bond breaks in biomolecules, and strand breaks in plasmid DNA in particular (Boudaiffa et al 2000 Science 287 1658-60). These results prompted a significant amount of experimental and theoretical work aimed at elucidating the role played by LEE in DNA damage. In this Topical Review we provide a general overview of the problem. We discuss experimental findings and theoretical results hand in hand with the aim of describing the physics and chemistry that occurs during the process of radiation damage, from the initial stages of electronic excitation, through the inelastic propagation of electrons in the medium, the interaction of electrons with DNA, and the chemical end-point effects on DNA. A very important aspect of this discussion is the consideration of a realistic, physiological environment. The role played by the aqueous solution and the amino acids from the histones in chromatin must be considered. Moreover, thermal fluctuations must be incorporated when

  19. Short-Range Temporal Interactions in Sleep; Hippocampal Spike Avalanches Support a Large Milieu of Sequential Activity Including Replay.

    Directory of Open Access Journals (Sweden)

    J Matthew Mahoney

    Full Text Available Hippocampal neural systems consolidate multiple complex behaviors into memory. However, the temporal structure of neural firing supporting complex memory consolidation is unknown. Replay of hippocampal place cells during sleep supports the view that a simple repetitive behavior modifies sleep firing dynamics, but does not explain how multiple episodes could be integrated into associative networks for recollection during future cognition. Here we decode sequential firing structure within spike avalanches of all pyramidal cells recorded in sleeping rats after running in a circular track. We find that short sequences that combine into multiple long sequences capture the majority of the sequential structure during sleep, including replay of hippocampal place cells. The ensemble, however, is not optimized for maximally producing the behavior-enriched episode. Thus behavioral programming of sequential correlations occurs at the level of short-range interactions, not whole behavioral sequences and these short sequences are assembled into a large and complex milieu that could support complex memory consolidation.

  20. Applications of IBSOM and ETEM for solving the nonlinear chains of atoms with long-range interactions (United States)

    Foroutan, Mohammadreza; Zamanpour, Isa; Manafian, Jalil


    This paper presents a number of new solutions obtained for solving a complex nonlinear equation describing dynamics of nonlinear chains of atoms via the improved Bernoulli sub-ODE method (IBSOM) and the extended trial equation method (ETEM). The proposed solutions are kink solitons, anti-kink solitons, soliton solutions, hyperbolic solutions, trigonometric solutions, and bellshaped soliton solutions. Then our new results are compared with the well-known results. The methods used here are very simple and succinct and can be also applied to other nonlinear models. The balance number of these methods is not constant contrary to other methods. The proposed methods also allow us to establish many new types of exact solutions. By utilizing the Maple software package, we show that all obtained solutions satisfy the conditions of the studied model. More importantly, the solutions found in this work can have significant applications in Hamilton's equations and generalized momentum where solitons are used for long-range interactions.