Spherical harmonic expansion of short-range screened Coulomb interactions
Energy Technology Data Exchange (ETDEWEB)
Angyan, Janos G [Laboratoire de Cristallographie et de Modelisation des Materiaux Mineraux et Biologiques, UMR 7036, CNRS-Universite Henri Poincare, BP 239, F-54506 Vandoeuvre-les-Nancy (France); Gerber, Iann [Laboratoire de Cristallographie et de Modelisation des Materiaux Mineraux et Biologiques, UMR 7036, CNRS-Universite Henri Poincare, BP 239, F-54506 Vandoeuvre-les-Nancy (France); Marsman, Martijn [Institut fuer Materialphysik and Center for Computational Materials Science, Universitaet Wien, Sensengasse 8, A-1090, Vienna (Austria)
2006-07-07
Spherical harmonic expansions of the screened Coulomb interaction kernel involving the complementary error function are required in various problems in atomic, molecular and solid state physics, like for the evaluation of Ewald-type lattice sums or for range-separated hybrid density functionals. A general analytical expression is derived for the kernel, which is non-separable in the radial variables. With the help of series expansions a separable approximate form is proposed, which is in close analogy with the conventional multipole expansion of the Coulomb kernel in spherical harmonics. The convergence behaviour of these expansions is studied and illustrated by the electrostatic potential of an elementary charge distribution formed by products of Slater-type atomic orbitals.
Evaluation of the Coulomb logarithm using cutoff and screened Coulomb interaction potentials
International Nuclear Information System (INIS)
Ordonez, C.A.; Molina, M.I.
1994-01-01
The Coulomb logarithm is a fundamental plasma parameter which is commonly derived within the framework of the binary collision approximation. The conventional formula for the Coulomb logarithm, λ=ln Λ, takes into account a pure Coulomb interaction potential for binary collisions and is not accurate at small values (λ D in place of λ D (the Debye length) in the conventional formula for the Coulomb logarithm
DEFF Research Database (Denmark)
Ruban, Andrei; Skriver, Hans Lomholt
2002-01-01
We have used the locally self-consistent Green's-function (LSGF) method in supercell calculations to establish the distribution of the net charges assigned to the atomic spheres of the alloy components in metallic alloys with different compositions and degrees of order. This allows us to determine......-site local interaction zone. We demonstrate that the basic mechanism that governs the charge distribution is the screening of the net charges of the alloy components that makes the direct Coulomb interactions short ranged. In the atomic-sphere approximation, this screening appears to be almost independent...
Coulomb interaction from the interplay between confinement and screening
International Nuclear Information System (INIS)
Gaete, P.; Guendelman, E.I.
2004-01-01
It has been noticed that confinement effects can be described by the addition of a √(-F μν a F aμν ) term in the Lagrangian density. We now study the combined effect of such 'confinement term' and that of a mass term. The surprising result is that the interplay between these two terms gives rise to a Coulomb interaction. Our picture has a certain correspondence with the quasiconfinement picture described by Giles, Jaffe and de Rujula for QCD with symmetry breaking
Screening of Coulomb interaction and many-body perturbation theory in atoms
International Nuclear Information System (INIS)
Dzyuba, V.A.; Flambaum, V.V.; Sil'vestrov, P.G.; Sushkov, O.P.
1988-01-01
Taking into account the electron Coulomb interaction screening considerably improves the convergence of perturbation theory in residual interaction. The developed technique allows to take into account screening diagrams in all orders of perturbation theory. Calculation of the correlation corrections to the thallium energy levels is carried out as an example
Non-conventional screening of the Coulomb interaction in low-dimensional and finite-size systems
van den Brink, J.; Sawatzky, G.A.
2000-01-01
We study the screening of the Coulomb interaction in non-polar systems by polarizable atoms. We show that in low dimensions and small finite-size systems this screening deviates strongly from that conventionally assumed. In fact in one dimension the short-range interaction is strongly screened and
DEFF Research Database (Denmark)
Ruban, Andrei; Simak, S.I.; Korzhavyi, P.A.
2002-01-01
-electron potential and energy. In the case of a random alloy such interactions can be accounted for only by lifting the atomic-sphere and single-site approximations, in order to include the polarization due to local environment effects. Nevertheless, a simple parametrization of the screened Coulomb interactions...... for the ordinary single-site methods, including the generalized perturbation method, is still possible. We obtained such a parametrization for bulk and surface NiPt alloys, which allows one to obtain quantitatively accurate effective interactions in this system....
Revision of FMM-Yukawa: An adaptive fast multipole method for screened Coulomb interactions
Zhang, Bo; Huang, Jingfang; Pitsianis, Nikos P.; Sun, Xiaobai
2010-12-01
FMM-YUKAWA is a mathematical software package primarily for rapid evaluation of the screened Coulomb interactions of N particles in three dimensional space. Since its release, we have revised and re-organized the data structure, software architecture, and user interface, for the purpose of enabling more flexible, broader and easier use of the package. The package and its documentation are available at http://www.fastmultipole.org/, along with a few other closely related mathematical software packages. New version program summaryProgram title: FMM-Yukawa Catalogue identifier: AEEQ_v2_0 Program summary URL:http://cpc.cs.qub.ac.uk/summaries/AEEQ_v2_0.html Program obtainable from: CPC Program Library, Queen's University, Belfast, N. Ireland Licensing provisions: GNU GPL 2.0 No. of lines in distributed program, including test data, etc.: 78 704 No. of bytes in distributed program, including test data, etc.: 854 265 Distribution format: tar.gz Programming language: FORTRAN 77, FORTRAN 90, and C. Requires gcc and gfortran version 4.4.3 or later Computer: All Operating system: Any Classification: 4.8, 4.12 Catalogue identifier of previous version: AEEQ_v1_0 Journal reference of previous version: Comput. Phys. Comm. 180 (2009) 2331 Does the new version supersede the previous version?: Yes Nature of problem: To evaluate the screened Coulomb potential and force field of N charged particles, and to evaluate a convolution type integral where the Green's function is the fundamental solution of the modified Helmholtz equation. Solution method: The new version of fast multipole method (FMM) that diagonalizes the multipole-to-local translation operator is applied with the tree structure adaptive to sample particle locations. Reasons for new version: To handle much larger particle ensembles, to enable the iterative use of the subroutines in a solver, and to remove potential contention in assignments for parallelization. Summary of revisions: The software package FMM-Yukawa has been
International Nuclear Information System (INIS)
Kar, S.; Ho, Y.K.
2009-01-01
We have investigated the doubly excited 1 D e resonance states of Ps - interacting with pure Coulomb and screened Coulomb (Yukawa) potentials employing highly correlated wave functions. For pure Coulomb interaction, in the framework of stabilization method and complex coordinate rotation method we have obtained two resonances below the n = 2 threshold of the Ps atom. For screened Coulomb interaction, we employ the stabilization method to extract resonance parameters. Resonance energies and widths for the 1 D e resonance states of Ps - for different screening parameter ranging from infinity (pure Coulomb case) to a small value are also reported. (author)
Coulomb interactions in charged fluids.
Vernizzi, Graziano; Guerrero-García, Guillermo Iván; de la Cruz, Monica Olvera
2011-07-01
The use of Ewald summation schemes for calculating long-range Coulomb interactions, originally applied to ionic crystalline solids, is a very common practice in molecular simulations of charged fluids at present. Such a choice imposes an artificial periodicity which is generally absent in the liquid state. In this paper we propose a simple analytical O(N(2)) method which is based on Gauss's law for computing exactly the Coulomb interaction between charged particles in a simulation box, when it is averaged over all possible orientations of a surrounding infinite lattice. This method mitigates the periodicity typical of crystalline systems and it is suitable for numerical studies of ionic liquids, charged molecular fluids, and colloidal systems with Monte Carlo and molecular dynamics simulations.
International Nuclear Information System (INIS)
Kjellander, Roland
2006-01-01
It is shown that the nature of the non-electrostatic part of the pair interaction potential in classical Coulomb fluids can have a profound influence on the screening behaviour. Two cases are compared: (i) when the non-electrostatic part equals an arbitrary finite-ranged interaction and (ii) when a dispersion r -6 interaction potential is included. A formal analysis is done in exact statistical mechanics, including an investigation of the bridge function. It is found that the Coulombic r -1 and the dispersion r -6 potentials are coupled in a very intricate manner as regards the screening behaviour. The classical one-component plasma (OCP) is a particularly clear example due to its simplicity and is investigated in detail. When the dispersion r -6 potential is turned on, the screened electrostatic potential from a particle goes from a monotonic exponential decay, exp(-κr)/r, to a power-law decay, r -8 , for large r. The pair distribution function acquire, at the same time, an r -10 decay for large r instead of the exponential one. There still remains exponentially decaying contributions to both functions, but these contributions turn oscillatory when the r -6 interaction is switched on. When the Coulomb interaction is turned off but the dispersion r -6 pair potential is kept, the decay of the pair distribution function for large r goes over from the r -10 to an r -6 behaviour, which is the normal one for fluids of electroneutral particles with dispersion interactions. Differences and similarities compared to binary electrolytes are pointed out
Coulomb interaction in multiple scattering theory
International Nuclear Information System (INIS)
Ray, L.; Hoffmann, G.W.; Thaler, R.M.
1980-01-01
The treatment of the Coulomb interaction in the multiple scattering theories of Kerman-McManus-Thaler and Watson is examined in detail. By neglecting virtual Coulomb excitations, the lowest order Coulomb term in the Watson optical potential is shown to be a convolution of the point Coulomb interaction with the distributed nuclear charge, while the equivalent Kerman-McManus-Thaler Coulomb potential is obtained from an averaged, single-particle Coulombic T matrix. The Kerman-McManus-Thaler Coulomb potential is expressed as the Watson Coulomb term plus additional Coulomb-nuclear and Coulomb-Coulomb cross terms, and the omission of the extra terms in usual Kerman-McManus-Thaler applications leads to negative infinite total reaction cross section predictions and incorrect pure Coulomb scattering limits. Approximations are presented which eliminate these anomalies. Using the two-potential formula, the full projectile-nucleus T matrix is separated into two terms, one resulting from the distributed nuclear charge and the other being a Coulomb distorted nuclear T matrix. It is shown that the error resulting from the omission of the Kerman-McManus-Thaler Coulomb terms is effectively removed when the pure Coulomb T matrix in Kerman-McManus-Thaler is replaced by the analogous quantity in the Watson approach. Using the various approximations, theoretical angular distributions are obtained for 800 MeV p+ 208 Pb elastic scattering and compared with experimental data
Coulomb interactions in particle beams
International Nuclear Information System (INIS)
Jansen, G.H.
1988-01-01
This thesis presents a theoretical description of the Coulomb interaction between identical charged particles (electrons or ions) in focussed beam. The charge-density effects as well as the various statistical interaction effects, known as the Boersch effect and the 'trajectory displacement effect', are treated. An introductory literature survey is presented from which the large differences in theoretical approach appear. Subsequently the methods are investigated which are used in studies of comparable problems in plasma physics and stellar dynamics. These turn out to be applicable to particle beams only for certain extreme conditions. The approach finally chosen in this study is twofold. On the one hand use is made of a semi-analytical model in which the statistical and dynamical aspects of the N-particle problem are reduced to two-particle problem. This model results in a number of explicit equations in the experimental parameters, with ties of the beam can be determined directly. On the other hand use has been made of a purely numerical Monte Carlo model in which the kinematical equations of an ensemble interacting particles with 'at random' chosen starting conditions are solved exactly. This model does not lead to general expressions, but yields a specific numerical prediction for each simulated experimental situation. The results of both models appear to agree well mutually. This yields a consistent theory which complements the existing knowledge of particle optics and which allow the description of systems in which the interaction between particles can not be neglected. The predictions of this theory are qualitatively and quantitatively compared with those from some other models, recently reported in literature. (author). 256 refs.; 114 figs.; 1180 schemes; 5 tabs
Intersite Coulomb interaction and Heisenberg exchange
Eder, R; van den Brink, J.; Sawatzky, G.A
1996-01-01
Based on exact diagonalization results for small clusters we discuss the effect of intersite Coulomb repulsion in Mott-Hubbard or charge transfers insulators. Whereas the exchange constant J for direct exchange is enhanced by intersite Coulomb interaction, that for superexchange is suppressed. The
Coulomb interaction in the supermultiplet basis
International Nuclear Information System (INIS)
Ruzha, Ya.Kh.; Guseva, T.V.; Tamberg, Yu.Ya.; Vanagas, V.V.
1989-01-01
An approximate expression for the matrix elements of the Coulomb interaction operator in the supermultiplet basis has been derived with the account for the orbitally-nonsymmetric terms. From the general expression a simplified formula for the Coulomb interaction energy has been proposed. On the basis of the expression obtained the contribution of the Coulomb interaction to the framework of a strongly restricted dynamic model in the light (4≤A≤40) and heavy (158≤A≤196) nuclei region has been studied. 19 refs.; 4 tabs
Critical behavior in graphene with Coulomb interactions.
Wang, Jianhui; Fertig, H A; Murthy, Ganpathy
2010-05-07
We demonstrate that, in the presence of Coulomb interactions, electrons in graphene behave like a critical system, supporting power law correlations with interaction-dependent exponents. An asymptotic analysis shows that the origin of this behavior lies in particle-hole scattering, for which the Coulomb interaction induces anomalously close approaches. With increasing interaction strength the relevant power law changes from real to complex, leading to an unusual instability characterized by a complex-valued susceptibility in the thermodynamic limit. Measurable quantities, as well as the connection to classical two-dimensional systems, are discussed.
International Nuclear Information System (INIS)
Lin, C.Y.; Ho, Y.K.
2010-01-01
The screening effects due to the exponential-cosine-screened Coulomb and screened Coulomb (Yukawa) potentials on photoionization processes are explored within the framework of complex coordinate rotation method. The energy levels of H and He + in both screened potentials shifted with various Debye screening lengths are presented. The photoionization cross sections illustrate the considerable screening effects on photoionization processes in low energy region. The shape resonances can be found near ionization thresholds for certain of Debye screening lengths. The relations between the appearance of resonances and the existence of quasi-bound states under shielding conditions are discussed. (authors)
Absence of Debye screening in the quantum Coulomb system
International Nuclear Information System (INIS)
Brydges, D.C.; Keller, G.
1994-01-01
We present an approximation to the quantum Coulomb plasma at equilibrium which captures the power-law violations of Debye screening which have been reported in recent papers. The objectives are (1) to produce a simpler model which we will study in forthcoming papers, and (2) to develop a strategy by which the absence of screening can be proven for the low-density quantum Coulomb plasma itself
Pairing from dynamically screened Coulomb repulsion in bismuth
Ruhman, Jonathan; Lee, Patrick A.
2017-12-01
Recently, Prakash et al. have discovered bulk superconductivity in single crystals of bismuth, which is a semimetal with extremely low carrier density. At such low density, we argue that conventional electron-phonon coupling is too weak to be responsible for the binding of electrons into Cooper pairs. We study a dynamically screened Coulomb interaction with effective attraction generated on the scale of the collective plasma modes. We model the electronic states in bismuth to include three Dirac pockets with high velocity and one hole pocket with a significantly smaller velocity. We find a weak-coupling instability, which is greatly enhanced by the presence of the hole pocket. Therefore we argue that bismuth is the first material to exhibit superconductivity driven by retardation effects of Coulomb repulsion alone. By using realistic parameters for bismuth we find that the acoustic plasma mode does not play the central role in pairing. We also discuss a matrix element effect, resulting from the Dirac nature of the conduction band, which may affect Tc in the s -wave channel without breaking time-reversal symmetry.
An Algorithm for Computing Screened Coulomb Scattering in Geant4
Mendenhall, Marcus H.; Weller, Robert A.
2004-01-01
An algorithm has been developed for the Geant4 Monte-Carlo package for the efficient computation of screened Coulomb interatomic scattering. It explicitly integrates the classical equations of motion for scattering events, resulting in precise tracking of both the projectile and the recoil target nucleus. The algorithm permits the user to plug in an arbitrary screening function, such as Lens-Jensen screening, which is good for backscattering calculations, or Ziegler-Biersack-Littmark screenin...
Ordering transitions induced by Coulomb interactions
International Nuclear Information System (INIS)
Rovere, M.; Senatore, G.; Tosi, M.P.
1988-11-01
We briefly review recent progress in treating phase transitions to ordered states driven by Coulomb interactions. Wigner crystallization of the one-component plasma, in the degenerate Fermi limit and in the classical limit, is the foremost example and developments in its theory are discussed in some detail. Attention is also given to quasi-twodimensional realizations of the plasma model in the laboratory. The usefulness of these ideas in relation to freezing and ordering transitions is illustrated with reference to alkali metals, elemental and polar semiconductors, and various types of ionic systems (molten salts, colloidal suspensions and astrophysical plasmas). (author). 70 refs, 5 figs
Using the Screened Coulomb Potential to Illustrate the Variational Method
Zuniga, Jose; Bastida, Adolfo; Requena, Alberto
2012-01-01
The screened Coulomb potential, or Yukawa potential, is used to illustrate the application of the single and linear variational methods. The trial variational functions are expressed in terms of Slater-type functions, for which the integrals needed to carry out the variational calculations are easily evaluated in closed form. The variational…
Coulomb-interacting billiards in circular cavities
International Nuclear Information System (INIS)
Solanpää, J; Räsänen, E; Nokelainen, J; Luukko, P J J
2013-01-01
We apply a molecular dynamics scheme to analyze classically chaotic properties of a two-dimensional circular billiard system containing two Coulomb-interacting electrons. As such, the system resembles a prototype model for a semiconductor quantum dot. The interaction strength is varied from the noninteracting limit with zero potential energy up to the strongly interacting regime where the relative kinetic energy approaches zero. At weak interactions the bouncing maps show jumps between quasi-regular orbits. In the strong-interaction limit we find an analytic expression for the bouncing map. Its validity in the general case is assessed by comparison with our numerical data. To obtain a more quantitative view on the dynamics as the interaction strength is varied, we compute and analyze the escape rates of the system. Apart from very weak or strong interactions, the escape rates show consistently exponential behavior, thus suggesting strongly chaotic dynamics and a phase space without significant sticky regions within the considered time scales. (paper)
Effective Coulomb interaction in multiorbital system
International Nuclear Information System (INIS)
Hase, Izumi; Yanagisawa, Takashi
2013-01-01
Transition metal atom generally takes various valences, and sometimes there are some 'missing valences', for example Fe usually takes 2+, 3+ and 5+, but does not take other valences so often. We have calculated the atomic multiplet energies for the high-spin and lowspin configurations within the ligand-field theory and the Hartree-Fock approximation, and found that the Coulomb interaction energy (U eff ) becomes small when the valence is 'missing'. In case U eff B /Fe only when U eff increased in most cases, but in some special cases U eff decreases and falls below the value U − 3J, which is the least value of the undistorted system.
Separable expansions for local potentials with Coulomb interactions
International Nuclear Information System (INIS)
Adhikari, S.K.
1976-01-01
If two particles are interacting via a short range potential and a repulsive Coulomb potential the t matrix can be written as a sum of the Coulomb and the ''nuclear'' t matrices. In order to solve the three-nucleon problem with Coulomb interactions usually we need a separable representation of this ''nuclear'' t matrix. A recently proposed method for finding a separable expansion for local potentials is here extended to find a rapidly convergent separable expansion, with analytic form factors, for the ''nuclear'' part of the t matrix of a local potential, in the presence of Coulomb interactions. The method is illustrated for a two-term Malfliet-Tjon potential. In each rank the ''nuclear'' phase shift is close to the corresponding phase shift when the Coulomb interaction is switched off
Role amplification of the coulomb interaction in nuclear reactions
Energy Technology Data Exchange (ETDEWEB)
Kumar, Ashok; Soni, S K; Pancholi, S K; Gupta, S L [AN SSSR, Moscow. Radiotekhnicheskij Inst.
1976-10-01
The genarally adopted estimate of coulomb interaction in nuclear reactions based on the comparison of relative energies of real particles participating in the reaction with the coulomb barrier has been shown to provide wrong presentation of the role of coulomb interaction in the reaction mechanism. The relative energy of particles participating in virtual processes forming the reaction mechanism and its relation to the coulomb barrier turn out to be tens of per cent less than for the particles in an inlet channel. This is the main reason of increasing the role of coulomb interaction in the reaction mechanism. This increase is particularly significant for nuclei with large charges, in particular, in heavy ion reaction.
An algorithm for computing screened Coulomb scattering in GEANT4
Energy Technology Data Exchange (ETDEWEB)
Mendenhall, Marcus H. [Vanderbilt University Free Electron Laser Center, P.O. Box 351816 Station B, Nashville, TN 37235-1816 (United States)]. E-mail: marcus.h.mendenhall@vanderbilt.edu; Weller, Robert A. [Department of Electrical Engineering and Computer Science, Vanderbilt University, P.O. Box 351821 Station B, Nashville, TN 37235-1821 (United States)]. E-mail: robert.a.weller@vanderbilt.edu
2005-01-01
An algorithm has been developed for the GEANT4 Monte-Carlo package for the efficient computation of screened Coulomb interatomic scattering. It explicitly integrates the classical equations of motion for scattering events, resulting in precise tracking of both the projectile and the recoil target nucleus. The algorithm permits the user to plug in an arbitrary screening function, such as Lens-Jensen screening, which is good for backscattering calculations, or Ziegler-Biersack-Littmark screening, which is good for nuclear straggling and implantation problems. This will allow many of the applications of the TRIM and SRIM codes to be extended into the much more general GEANT4 framework where nuclear and other effects can be included.
An algorithm for computing screened Coulomb scattering in GEANT4
International Nuclear Information System (INIS)
Mendenhall, Marcus H.; Weller, Robert A.
2005-01-01
An algorithm has been developed for the GEANT4 Monte-Carlo package for the efficient computation of screened Coulomb interatomic scattering. It explicitly integrates the classical equations of motion for scattering events, resulting in precise tracking of both the projectile and the recoil target nucleus. The algorithm permits the user to plug in an arbitrary screening function, such as Lens-Jensen screening, which is good for backscattering calculations, or Ziegler-Biersack-Littmark screening, which is good for nuclear straggling and implantation problems. This will allow many of the applications of the TRIM and SRIM codes to be extended into the much more general GEANT4 framework where nuclear and other effects can be included
International Nuclear Information System (INIS)
Hiratsuka, Y.; Oryu, S.; Gojuki, S.
2011-01-01
Reliability of the screened Coulomb renormalization method, which was proposed in an elegant way by Alt-Sandhas-Zankel-Ziegelmann (ASZZ), is discussed on the basis of 'two-potential theory' for the three-body AGS equations with the Coulomb potential. In order to obtain ASZZ's formula, we define the on-shell Moller function, and calculate it by using the Haeringen criterion, i. e. 'the half-shell Coulomb amplitude is zero'. By these two steps, we can finally obtain the ASZZ formula for a small Coulomb phase shift. Furthermore, the reliability of the Haeringen criterion is thoroughly checked by a numerically rigorous calculation for the Coulomb LS-type equation. We find that the Haeringen criterion can be satisfied only in the higher energy region. We conclude that the ASZZ method can be verified in the case that the on-shell approximation to the Moller function is reasonable, and the Haeringen criterion is reliable. (author)
International Nuclear Information System (INIS)
Papp, Z.; Plessas, W.
1996-01-01
We demonstrate the feasibility and efficiency of the Coulomb-Sturmian separable expansion method for generating accurate solutions of the Faddeev equations. Results obtained with this method are reported for several benchmark cases of bosonic and fermionic three-body systems. Correct bound-state results in agreement with the ones established in the literature are achieved for short-range interactions. We outline the formalism for the treatment of three-body Coulomb systems and present a bound-state calculation for a three-boson system interacting via Coulomb plus short-range forces. The corresponding result is in good agreement with the answer from a recent stochastic-variational-method calculation. copyright 1996 The American Physical Society
Ginzburg criterion for ionic fluids: the effect of Coulomb interactions.
Patsahan, O
2013-08-01
The effect of the Coulomb interactions on the crossover between mean-field and Ising critical behavior in ionic fluids is studied using the Ginzburg criterion. We consider the charge-asymmetric primitive model supplemented by short-range attractive interactions in the vicinity of the gas-liquid critical point. The model without Coulomb interactions exhibiting typical Ising critical behavior is used to calibrate the Ginzburg temperature of the systems comprising electrostatic interactions. Using the collective variables method, we derive a microscopic-based effective Hamiltonian for the full model. We obtain explicit expressions for all the relevant Hamiltonian coefficients within the framework of the same approximation, i.e., the one-loop approximation. Then we consistently calculate the reduced Ginzburg temperature t(G) for both the purely Coulombic model (a restricted primitive model) and the purely nonionic model (a hard-sphere square-well model) as well as for the model parameters ranging between these two limiting cases. Contrary to the previous theoretical estimates, we obtain the reduced Ginzburg temperature for the purely Coulombic model to be about 20 times smaller than for the nonionic model. For the full model including both short-range and long-range interactions, we show that t(G) approaches the value found for the purely Coulombic model when the strength of the Coulomb interactions becomes sufficiently large. Our results suggest a key role of Coulomb interactions in the crossover behavior observed experimentally in ionic fluids as well as confirm the Ising-like criticality in the Coulomb-dominated ionic systems.
Unstable system with Coulomb interaction distorted near the origin
International Nuclear Information System (INIS)
Kerbikov, B.O.
1981-01-01
An unstable system with Coulomb interaction distorted at small distances is considered. The results are applicable to hadronic atoms analysis. A detailed investigation of the model which can be solved exactly is presented. This model contains the separable short-range potential with the Yamaguchi form factor. Closed expressions for the modified effective range function and the Coulomb-modified scattering length ase obtained [ru
Influence of Coulomb screening on lateral lasing in VECSELs.
Wang, Chengao; Malloy, Kevin; Sheik-Bahae, Mansoor
2015-12-14
Parasitic lateral lasing in certain optically pumped semiconductor disc lasers drains the gain of the vertical mode and thus causes power scaling degradation and premature rollover in surface emitting operation. We have observed this effect in both multiple quantum wells (MQW) (GaInAs/GaAs) and double heterostructures (DHS) (GaInP/GaAs/GaInP) under pulsed excitation even when the gain chip lateral dimensions are much larger than the diameter of the pump laser. Lateral lasing occurs persistently between cleaved facets at a band-tail wavelength much longer than the peak of the gain. We show that the effect of bandgap renormalization due to Coulomb screening explains this phenomena. Exploiting the simple analytical plasma theory of bulk semiconductors (Banyai & Koch, 1986), we can account for such an effect in double heterostructures.
Coulomb Final State Interactions for Gaussian Wave Packets
Wiedemann, Urs Achim; Heinz, Ulrich W
1999-01-01
Two-particle like-sign and unlike-sign correlations including Coulomb final state interactions are calculated for Gaussian wave packets emitted from a Gaussian source. We show that the width of the wave packets can be fully absorbed into the spatial and momentum space widths of an effective emission function for plane wave states, and that Coulomb final state interaction effects are sensitive only to the latter, but not to the wave packet width itself. Results from analytical and numerical calculations are compared with recently published work by other authors.
Coulomb Interactions in Hanbury Brown-Twiss Experiments with Electrons
Shen, Kan
2009-01-01
This dissertation examines the effect of Coulomb interactions in Hanbury Brown-Twiss (HBT) type experiments with electrons. HBT experiments deal with intensity interference, which is related to the second-order correlation function of the particle field. This is an extension of the usual amplitude interference experiment, such as Young's…
Coulomb plus strong interaction bound states - momentum space numerical solutions
International Nuclear Information System (INIS)
Heddle, D.P.; Tabakin, F.
1985-01-01
The levels and widths of hadronic atoms are calculated in momentum space using an inverse algorithm for the eigenvalue problem. The Coulomb singularity is handled by the Lande substraction method. Relativistic, nonlocal, complex hadron-nucleus interactions are incorporated as well as vacuum polarization and finite size effects. Coordinate space wavefunctions are obtained by employing a Fourier Bessel transformation. (orig.)
Duffin-Kemmer-Petiau equation under a scalar Coulomb interaction
International Nuclear Information System (INIS)
Hassanabadi, H.; Yazarloo, B. H.; Zarrinkamar, S.; Rajabi, A. A.
2011-01-01
Approximate analytical solutions of a Duffin-Kemmer-Petiau (DKP) equation are obtained via an elegant ansatz after successive transformations. Apart from the wide application of the DKP equation in both cosmology and theoretical nuclear physics as well as the physical significance of the Coulomb interaction, this is particularly important as we have provided a solution to the corresponding Heun equation.
Coulomb effects in the deuteron-nucleus interaction
International Nuclear Information System (INIS)
Kuz'michev, V.E.; Peresypkin, V.V.
1990-01-01
The authors develop a consistent theory for calculation of the potential of the deuteron interaction with the Coulomb field of a nucleus. They study the properties of this potential at large distances and give its explicit form at the deuteron-breakup threshold. In the limit of low energies they derive the potential, which includes intermediate off-energy-shell states, and explain the physical nature of its constants. The accuracy of the transition to the polarization interaction is estimated
Local simulation algorithms for Coulombic interactions
Indian Academy of Sciences (India)
We consider a problem in dynamically constrained Monte Carlo dynamics and show that this leads to the generation of long ranged effective interactions. This allows us to construct a local algorithm for the simulation of charged systems without ever having to evaluate pair potentials or solve the Poisson equation.
Effect of coulomb interaction on Anderson localization
International Nuclear Information System (INIS)
Waintal, X.
1999-01-01
We study the quantum mechanics of interacting particles in a disordered system, and in particular, what happens to Anderson localisation when interaction is taken into account. In the first part, one looks at the excited states of two particles in one dimension. For this model, it has been shown (Shepelyansky 1994) that a local repulsive interaction can partially destroy Anderson localisation. Here, we show that this model has similarities with the three-dimensional Anderson model at the metal-insulator transition. In particular, the maximum of rigidity obtained in the spectral statistics correspond to some intermediary statistics that cannot be described by random matrix theory neither by a Poisson statistics. The wave functions show a multifractal behaviour and the spreading of the center of mass of a wave packet is logarithmic in time. The second part deals with the ground state of a finite density of spinless fermions in two dimensions. After the scaling theory of localisation, it was commonly accepted that there was no metal in two dimensions. This idea has been challenged by the observation of a metal-insulator transition in low density electron gas (Kravchenko et al. 1994). We propose a scenario in which a metallic phase occurs between the Anderson insulator and the pinned Wigner crystal. This intermediate phase is characterized by an alignment of the local currents flowing in the system. (author)
International Nuclear Information System (INIS)
Zeng Bei; Zeng Jinyan
2002-01-01
It is shown that for any central potential V(r) there exist a series of conserved aphelion and perihelion vectors R-tilde=pxL-g(r)r, g(r)=rV ' (r). However, if and only if V(r) is a pure or screened Coulomb potential, R-tilde and L constitute an SO 4 algebra in the subspace spanned by the degenerate states with a given energy eigenvalue E ' . While dR/dt=0 always holds, dR ' /dt=0 holds only at the aphelia and perihelia. Moreover, the space spanning the SO 4 algebra for a screened Coulomb potential is smaller than that for a pure Coulomb potential. The relation of closed orbits for a screened Coulomb potential with that for a pure Coulomb potential is clarified. The ratio of the radial frequency ω r and angular frequency ω φ , ω r /ω φ =κ=1 for a pure Coulomb potential irrespective of the angular momentum L and energy E(<0). For a screened Coulomb potential κ is determined by the angular momentum L, and when κ is any rational number (κ<1), the orbit is closed. The situation for a pure or screened isotropic harmonic oscillator is similar
Effect of Coulomb screening on deuterium-deuterium fusion cross-section
International Nuclear Information System (INIS)
Wang Shunjin
1991-01-01
The popular Gamow formula for the deuterium-deuterium fusion cross-section is generalized to take into account the Coulomb screening effect. The generalized formula has been used to discuss the fusion process occurring in the metal medium
Coulomb interaction rules timescales in potassium ion channel tunneling
De March, N.; Prado, S. D.; Brunnet, L. G.
2018-06-01
Assuming the selectivity filter of KcsA potassium ion channel may exhibit quantum coherence, we extend a previous model by Vaziri and Plenio (2010 New J. Phys. 12 085001) to take into account Coulomb repulsion between potassium ions. We show that typical ion transit timescales are determined by this interaction, which imposes optimal input/output parameter ranges. Also, as observed in other examples of quantum tunneling in biological systems, the addition of moderate noise helps coherent ion transport.
Interaction of charged 3D soliton with Coulomb center
International Nuclear Information System (INIS)
Rybakov, Yu.P.
1996-03-01
The Einstein - de Broglie particle-soliton concept is applied to simulate stationary states of an electron in a hydrogen atom. According to this concept, the electron is described by the localized regular solutions to some nonlinear equations. In the framework of Synge model for interacting scalar and electromagnetic fields a system of integral equations has been obtained, which describes the interaction between charged 3D soliton and Coulomb center. The asymptotic expressions for physical fields, describing soliton moving around the fixed Coulomb center, have been obtained with the help of integral equations. It is shown that the electron-soliton center travels along some stationary orbit around the Coulomb center. The electromagnetic radiation is absent as the Poynting vector has non-wave asymptote O(r -3 ) after averaging over angles, i.e. the existence of spherical surface corresponding to null Poynting vector stream, has been proved. Vector lines for Poynting vector are constructed in asymptotical area. (author). 22 refs, 2 figs
Stability of Dirac Liquids with Strong Coulomb Interaction.
Tupitsyn, Igor S; Prokof'ev, Nikolay V
2017-01-13
We develop and apply the diagrammatic Monte Carlo technique to address the problem of the stability of the Dirac liquid state (in a graphene-type system) against the strong long-range part of the Coulomb interaction. So far, all attempts to deal with this problem in the field-theoretical framework were limited either to perturbative or random phase approximation and functional renormalization group treatments, with diametrically opposite conclusions. Our calculations aim at the approximation-free solution with controlled accuracy by computing vertex corrections from higher-order skeleton diagrams and establishing the renormalization group flow of the effective Coulomb coupling constant. We unambiguously show that with increasing the system size L (up to ln(L)∼40), the coupling constant always flows towards zero; i.e., the two-dimensional Dirac liquid is an asymptotically free T=0 state with divergent Fermi velocity.
Simulation of Coulomb interaction effects in electron sources
International Nuclear Information System (INIS)
Rouse, John; Zhu Xieqing; Liu Haoning; Munro, Eric
2011-01-01
Over many years, we have developed electron source simulation software that has been used widely in the electron optics community to aid the development of rotationally symmetric electron and ion guns. The simulation includes the modelling of cathode emission and the effects of volumetric space charge. In the present paper we describe the existing software and explain how we have extended this software to include the effects of discrete Coulomb interactions between the electrons as they travel from the cathode surface to the exit of the gun. In the paper, we will describe the numerical models we have employed, the techniques we have used to maximize the speed of the Coulomb force computation and present several illustrative examples of cases analyzed using the new software, including thermal field emitters, LaB 6 guns and flat dispenser-type cathodes.
International Nuclear Information System (INIS)
Hoffmann, B.
1984-07-01
In three chapters different physical situations are described which have commonly the Coulomb interaction as driving force. The first two chapters study the Coulomb interactions in connection with the excitation of inner electron shells and the Coulomb excitation of nuclei in first order. In the third part on effect ofthe Coulomb interaction between electronic shell and nucleus is treated in second order (nuclear polarization), and its effect on the isotopic and isomeric shift is studied. (orig./HSI) [de
Super-Coulombic atom-atom interactions in hyperbolic media
Cortes, Cristian L.; Jacob, Zubin
2017-01-01
Dipole-dipole interactions, which govern phenomena such as cooperative Lamb shifts, superradiant decay rates, Van der Waals forces and resonance energy transfer rates, are conventionally limited to the Coulombic near-field. Here we reveal a class of real-photon and virtual-photon long-range quantum electrodynamic interactions that have a singularity in media with hyperbolic dispersion. The singularity in the dipole-dipole coupling, referred to as a super-Coulombic interaction, is a result of an effective interaction distance that goes to zero in the ideal limit irrespective of the physical distance. We investigate the entire landscape of atom-atom interactions in hyperbolic media confirming the giant long-range enhancement. We also propose multiple experimental platforms to verify our predicted effect with phonon-polaritonic hexagonal boron nitride, plasmonic super-lattices and hyperbolic meta-surfaces as well. Our work paves the way for the control of cold atoms above hyperbolic meta-surfaces and the study of many-body physics with hyperbolic media.
A unitarized meson model including color Coulomb interaction
International Nuclear Information System (INIS)
Metzger, Kees.
1990-01-01
Ch. 1 gives a general introduction into the problem field of the thesis. It discusses in how far the internal structure of mesons is understood theoretically and which models exist. It discusses from a phenomenological point of view the problem of confinement indicates how quark models of mesons may provide insight in this phenomenon. In ch. 2 the formal theory of scattering in a system with confinement is given. It is shown how a coupled channel (CC) description and the work of other authors fit into this general framework. Explicit examples and arguments are given to support the CC treatment of such a system. In ch. 3 the full coupled-channel model as is employed in this thesis is presented. On the basis of arguments from the former chapters and the observed regularities in the experimental data, the choices underlying the model are supported. In this model confinement is described with a mass-dependent harmonic-oscillator potential and the presence of open (meson-meson) channels plays an essential role. In ch. 4 the unitarized model is applied to light scalar meson resonances. In this regime the contribution of the open channels is considerable. It is demonstrated that the model parameters as used for the description of the pseudo-scalar and vector mesons, unchanged can be used for the description of these mesons. Ch. 5 treats the color-Coulomb interaction. There the effect of the Coulomb interaction is studied in simple models without decay. The results of incorporating the color-Coulomb interaction into the full CC model are given in ch.6. Ch. 7 discusses the results of the previous chapters and the present status of the model. (author). 182 refs.; 16 figs.; 33 tabs
Coulomb interactions via local dynamics: a molecular-dynamics algorithm
International Nuclear Information System (INIS)
Pasichnyk, Igor; Duenweg, Burkhard
2004-01-01
We derive and describe in detail a recently proposed method for obtaining Coulomb interactions as the potential of mean force between charges which are dynamically coupled to a local electromagnetic field. We focus on the molecular dynamics version of the method and show that it is intimately related to the Car-Parrinello approach, while being equivalent to solving Maxwell's equations with a freely adjustable speed of light. Unphysical self-energies arise as a result of the lattice interpolation of charges, and are corrected by a subtraction scheme based on the exact lattice Green function. The method can be straightforwardly parallelized using standard domain decomposition. Some preliminary benchmark results are presented
Coulomb correction to the screening angle of the Moliere multiple scattering theory
International Nuclear Information System (INIS)
Kuraev, E.A.; Voskresenskaya, O.O.; Tarasov, A.V.
2012-01-01
Coulomb correction to the screening angular parameter of the Moliere multiple scattering theory is found. Numerical calculations are presented in the range of nuclear charge 4 ≤ Z ≤ 82. Comparison with the Moliere result for the screening angle reveals up to 30% deviation from it for sufficiently heavy elements of the target material
Stochastic Coulomb interactions in space charge limited electron emission
International Nuclear Information System (INIS)
Nijkerk, M.D.; Kruit, P.
2004-01-01
Emission models that form the basis of self-consistent field computations make use of the approximation that emitted electrons form a smooth space charge jelly. In reality, electrons are discrete particles that are subject to statistical Coulomb interactions. A Monte Carlo simulation tool is used to evaluate the influence of discrete space charge effects on self-consistent calculations of cathode-ray tube optics. We find that interactions in the space charge cloud affect the electron trajectories such that the velocity distribution is Maxwellian, regardless of the current density. Interactions near the emitter effectively conserve the Maxwellian distribution. The surprising result is that the width of the distribution of transversal velocities does not change. The distribution of longitudinal velocities does broaden, as expected from existing theories
Elliptic flow from Coulomb interaction and low density elastic scattering
Sun, Yuliang; Li, Qingfeng; Wang, Fuqiang
2018-04-01
In high energy heavy ion collisions and interacting cold atom systems, large elliptic flow anisotropies have been observed. For the large opacity (ρ σ L ˜103 ) of the latter hydrodynamics is a natural consequence, but for the small opacity (ρ σ L ˜1 ) of the former the hydrodynamic description is questionable. To shed light onto the situation, we simulate the expansion of a low density argon ion (or atom) system, initially trapped in an elliptical region, under the Coulomb interaction (or elastic scattering). Significant elliptic anisotropy is found in both cases, and the anisotropy depends on the initial spatial eccentricity and the density of the system. The results may provide insights into the physics of anisotropic flow in high energy heavy ion collisions and its role in the study of quantum chromodynamics.
Huang, Jian; Pfeiffer, L N; West, K W
2014-01-24
In high quality updoped GaAs field-effect transistors, the two-dimensional charge carrier concentrations can be tuned to very low values similar to the density of electrons on helium surfaces. An important interaction effect, screening of the Coulomb interaction by the gate, rises as a result of the large charge spacing comparable to the distance between the channel and the gate. Based on the results of the temperature (T) dependence of the resistivity from measuring four different samples, a power-law characteristic is found for charge densities ≤2×10(9) cm(-2). Moreover, the exponent exhibits a universal dependence on a single dimensionless parameter, the ratio between the mean carrier separation and the distance to the metallic gate that screens the Coulomb interaction. Thus, the electronic properties are tuned through varying the shape of the interaction potential.
Aghajani, M.; Hadipour, H.; Akhavan, M.
2018-05-01
Pressure dependence of the onsite Coulomb interactions of the BaFe2As2 has been studied by employing the constrained random phase approximation within first-principle calculations. Analyzing total and projected density of states, a pseudogap is found for dxy band at the energy roughly 0.25 eV higher than the Fermi level. Also, by applying pressure the spectral weight of the dxy orbital vanishes while other orbitals remain metallic. The different screening channels, as discussed in four different models, affect significantly on the Hubbard U while the Hund J remains almost unchanged. The average onsite bare and partially and fully screened Coulomb interactions increase with different rates upon compression. These different rates can be explained by competition between the electronic screening and reduction of bond lengths.
Controlling coulomb interactions in infrared stereometamaterials for unity light absorption
Mudachathi, Renilkumar; Moritake, Yuto; Tanaka, Takuo
2018-05-01
We investigate the influence of near field interactions between the constituent 3D split ring resonators on the absorbance and resonance frequency of a stereo metamaterial based perfect light absorber. The experimental and theoretical analyses reveal that the magnetic resonance red shifts and broadens for both the decreasing vertical and lateral separations of the constituents within the metamaterial lattice, analogous to plasmon hybridization. The strong interparticle interactions for higher density reduce the effective cross-section per resonator, which results in weak light absorption observed in both experimental and theoretical analyses. The red shift of the magnetic resonance with increasing lattice density is an indication of the dominating electric dipole interactions and we analyzed the metamaterial system in an electrostatic point of view to explain the observed resonance shift and decreasing absorption peak. From these analyses, we found that the fill factor introduces two competing factors determining the absorption efficiency such as coulomb interactions between the constituent resonators and their number density in a given array structure. We predicted unity light absorption for a fill factor of 0.17 balancing these two opposing factors and demonstrate an experimental absorbance of 99.5% at resonance with our 3D device realized using residual stress induced bending of 2D patterns.
Jiao, Li-Guang; Ho, Yew Kam
2014-05-01
The screened Coulomb potential (SCP) has been extensively used in atomic physics, nuclear physics, quantum chemistry and plasma physics. However, an accurate calculation for atomic resonances under SCP is still a challenging task for various methods. Within the complex-scaling computational scheme, we have developed a method utilizing the modified Bessel functions to calculate doubly-excited resonances in two-electron atomic systems with configuration interaction-type basis. To test the validity of our method, we have calculated S- and P-wave resonance states of the helium atom with various screening strengths, and have found good agreement with earlier calculations using different methods. Our present method can be applied to calculate high-lying resonances associated with high excitation thresholds of the He+ ion, and with high-angular-momentum states. The derivation and calculation details of our present investigation together with new results of high-angular-momentum states will be presented at the meeting. Supported by NSC of Taiwan.
Two-center Coulomb problem with Calogero interaction
Energy Technology Data Exchange (ETDEWEB)
Hakobyan, T., E-mail: tigran.hakobyan@ysu.am; Nersessian, A., E-mail: arnerses@ysu.am [Armenia Tomsk Polytechnic University, Yerevan State University (Russian Federation)
2017-03-15
We show that the Calogero-type perturbation preserves the integrability and partial separation of variables for the Stark–Coulomb and two-center Coulomb problems, and present the explicit expressions of their constants of motion. We reveal that this perturbation preserves the spectra of initial systems, but leads to the change of degree of degeneracy.
Screened Coulomb balls-structural properties and melting behaviour
International Nuclear Information System (INIS)
Golubnychiy, V; Baumgartner, H; Bonitz, M; Filinov, A; Fehske, H
2006-01-01
Classical molecular dynamics and Monte Carlo simulations are used to investigate three-dimensional spherical charged particle clusters which were experimentally observed in dusty plasmas (Arp et al 2004 Phys. Rev. Lett. 93 165005). The shell configuration and geometry of the ground state is found to change with the screening parameter. The melting temperature of small clusters exhibits a non-monotonic dependence on the total number of particles
Energy Technology Data Exchange (ETDEWEB)
Davydov, Arkadiy; Sanna, Antonio; Sharma, Sangeeta; Dewhurst, John Kay; Gross, E.K.U. [Max Planck Institute of Microstructure Physics, Halle (Saale) (Germany)
2016-07-01
In standard Eliashberg methods the Coulomb interaction is usually restricted to the use of a single phenomenological parameter μ{sup *} adjusted to give the right superconducting critical temperature (T{sub c}). In this work we present a parameter-free Eliashberg approach, in which we treat the screened Coulomb interaction within the random phase approximation (RPA) in its static and full dynamic limit. The full energy range of the Coulomb interaction is taken into account, which becomes computationally affordable with the introduction of a suitable isotropic approximation. We have tested the method on a set of conventional superconductors. We will discuss the reliability of the predicted T{sub c} both by using a static and a dynamic Coulomb interaction.
Resonance tuning due to Coulomb interaction in strong near-field coupled metamaterials
International Nuclear Information System (INIS)
Roy Chowdhury, Dibakar; Xu, Ningning; Zhang, Weili; Singh, Ranjan
2015-01-01
Coulomb's law is one of the most fundamental laws of physics that describes the electrostatic interaction between two like or unlike point charges. Here, we experimentally observe a strong effect of Coulomb interaction in tightly coupled terahertz metamaterials where the split-ring resonator dimers in a unit cell are coupled through their near fields across the capacitive split gaps. Using a simple analytical model, we evaluated the Coulomb parameter that switched its sign from negative to positive values indicating the transition in the nature of Coulomb force from being repulsive to attractive depending upon the near field coupling between the split ring resonators. Apart from showing interesting effects in the strong coupling regime between meta-atoms, Coulomb interaction also allows an additional degree of freedom to achieve frequency tunable dynamic metamaterials
Analytic perturbation theory for screened Coulomb potential: full continuum wave function
International Nuclear Information System (INIS)
Bechler, A.; Ennan, Mc J.; Pratt, R.H.
1979-01-01
An analytic perturbation theory developed previously is used to find a continuum screened-Coulomb wave function characterized by definite asymptotic momentum. This wave function satisfies an inhomogeneous partial differential equation which is solved in parabolic coordinates; the solution depends on both parabolic variables. We calculate partial wave projections of this solution and show that we can choose to add a solution of the homogeneous equation such that the partial wave projections become equal to the normalized continuum radial function found previously. However, finding the unique solution with given asymptotic linear momentum will require either using boundary conditions to determine the unique needed solution of the homogeneous equation or equivalently specifying the screened-Coulomb phase-shifts. (author)
International Nuclear Information System (INIS)
Macdonald, J.
1991-01-01
The results of accurate calculations of collision integrals for the attractive static screened Coulomb potential are presented. To obtain high accuracy with minimal computational cost, the integrals are evaluated by a quadrature method based on the Whittaker cardinal function. The collision integrals for the attractive potential are needed for calculation of the electrical conductivity of a dense fully or partially ionized plasma, and the results presented here are appropriate for the conditions in the nondegenerate envelopes of white dwarf stars. 25 refs
Impact of electron-electron Coulomb interaction on the high harmonic generation process in graphene
Avetissian, H. K.; Mkrtchian, G. F.
2018-03-01
Generation of high harmonics in a monolayer graphene initiated by a strong coherent radiation field, taking into account electron-electron Coulomb interaction, is investigated. A microscopic theory describing the nonlinear optical response of graphene is developed. The Coulomb interaction of electrons is treated in the scope of dynamic Hartree-Fock approximation. The closed set of integrodifferential equations for the single-particle density matrix of a graphene quantum structure is solved numerically. The obtained solutions show the significance of many-body Coulomb interaction on the high harmonic generation process in graphene.
Relativity, nuclear polarizability, and screening in sub-Coulomb elastic scattering
International Nuclear Information System (INIS)
Lynch, W.G.; Tsang, M.B.; Bhang, H.C.; Cramer, J.G.; Puigh, R.J.
Elastic scattering of p-shell nuclear projectiles from 208 Pb has been examined for deviations from Rutherford scattering. Four effects can be important: atomic screening, vacuum polarization, nuclear polarizability and a relativistic effect of dynamical origin. The presence of atomic screening, nuclear polarizability and the relativistic effect was observed thus constituting the first measurement of this relativistic effect using complex nuclei and the first measurement of this relativistic effect using complex nuclei and the first measurement of nuclear polarizability in an external Coulomb field
Nonlocal Coulomb interaction in the two-dimensional spin-1/2 ...
Indian Academy of Sciences (India)
Department of Physics, University of Kalyani, Kalyani 741 235, India. ∗. Corresponding author. .... The inclusion of nonlocal Coulomb interaction with t = −1 leads .... The authors are thankful to the University of Kalyani, India, for financial help.
Directory of Open Access Journals (Sweden)
Robert A Gatenby
2010-08-01
Full Text Available Normal cell function requires timely and accurate transmission of information from receptors on the cell membrane (CM to the nucleus. Movement of messenger proteins in the cytoplasm is thought to be dependent on random walk. However, Brownian motion will disperse messenger proteins throughout the cytosol resulting in slow and highly variable transit times. We propose that a critical component of information transfer is an intracellular electric field generated by distribution of charge on the nuclear membrane (NM. While the latter has been demonstrated experimentally for decades, the role of the consequent electric field has been assumed to be minimal due to a Debye length of about 1 nanometer that results from screening by intracellular Cl- and K+. We propose inclusion of these inorganic ions in the Debye-Huckel equation is incorrect because nuclear pores allow transit through the membrane at a rate far faster than the time to thermodynamic equilibrium. In our model, only the charged, mobile messenger proteins contribute to the Debye length.Using this revised model and published data, we estimate the NM possesses a Debye-Huckel length of a few microns and find this is consistent with recent measurement using intracellular nano-voltmeters. We demonstrate the field will accelerate isolated messenger proteins toward the nucleus through Coulomb interactions with negative charges added by phosphorylation. We calculate transit times as short as 0.01 sec. When large numbers of phosphorylated messenger proteins are generated by increasing concentrations of extracellular ligands, we demonstrate they generate a self-screening environment that regionally attenuates the cytoplasmic field, slowing movement but permitting greater cross talk among pathways. Preliminary experimental results with phosphorylated RAF are consistent with model predictions.This work demonstrates that previously unrecognized Coulomb interactions between phosphorylated messenger
International Nuclear Information System (INIS)
Suzuki, Toshio; Sagawa, H.; Giai, N. van.
1992-01-01
Effects of CIB (charge independence breaking) and CSB (charge symmetry breaking) interactions on the Coulomb displacement energies of isobaric analog states are investigated for 48 Ca, 90 Zr and 208 Pb. Mass number dependence of the Coulomb energy anomalies is well explained when CIB and CSB interactions are used which reproduce the differences of the scattering lengths as well as those of the effective ranges of low energy nucleon-nucleon scattering. (author) 17 refs., 3 figs., 3 tabs
International Nuclear Information System (INIS)
Liu Jianye; Guo Wenjun; Li Xiguo; Xing Yongzhong
2004-01-01
The authors investigate the isospin effect of Coulomb interaction on the momentum dissipation or nuclear stopping in the intermediate energy heavy ion collisions by using the isospin-dependent quantum molecular dynamics model. The calculated results show that the Coulomb interaction induces obviously the reductions of the momentum dissipation. The authors also find that the variation amplitude of momentum dissipation induced by the Coulomb interaction depends sensitively on the form and strength of symmetry potential. However, the isospin effect of Coulomb interaction on the momentum dissipation is less than that induced by the in-medium nucleon-nucleon cross section. In this case, Coulomb interaction does not changes obviously the isospin effect of momentum dissipation induced by the in-medium two-body collision. In particular, the Coulomb interaction is preferable for standing up the isospin effect of in-medium nucleon-nucleon cross section on the momentum dissipation and reducing the isospin effect of symmetry potential on it, which is important for obtaining the feature about the sensitive dependence of momentum dissipation on the in-medium nucleon-nucleon cross section and weakly on the symmetry potential. (author)
Long-range Coulomb interactions in low energy (e,2e) data
International Nuclear Information System (INIS)
Waterhouse, D.
2000-01-01
Full text: Proper treatment of long-range Coulomb interactions has confounded atomic collision theory since Schrodinger first presented a quantum-mechanical model for atomic interactions. The long-range Coulomb interactions are difficult to include in models in a way that treats the interaction sufficiently well but at the same time ensures the calculation remains tractable. An innovative application of an existing multi-parameter (e,2e) data acquisition system will be described. To clarify the effects of long-range Coulomb interactions, we will report the correlations and interactions that occur at low energy, observed by studying the energy sharing between outgoing electrons in the electron-impact ionisation of krypton
Siebbeles, L.D.A.; Movaghar, B.
2000-01-01
Using Monte Carlo simulations we calculate the frequency dependence of the diffusive mobility of a group of carriers on a short one-dimensional chain. We allow the carriers to interact with each other through weakly screened long-range Coulomb potentials. We consider both doped systems with discrete
Arbitrary l-wave solutions of the Schroedinger equation for the screen Coulomb potential
International Nuclear Information System (INIS)
Dong, Shishan; Sun, Guohua; Dong, Shihai
2013-01-01
Using improved approximate schemes for centrifugal term and the singular factor 1/r appearing in potential itself, we solve the Schroedinger equation with the screen Coulomb potential for arbitrary angular momentum state l. The bound state energy levels are obtained. A closed form of normalization constant of the wave functions is also found. The numerical results show that our results are in good agreement with those obtained by other methods. The key issue is how to treat two singular points in this quantum system. (author)
Modified Moliere's screening parameter and its impact on multiple coulomb scattering
International Nuclear Information System (INIS)
Striganov, Sergei
2015-01-01
The Moliere approximation of elastic Coulomb scattering cross-sections plays an important role in accurate description of multiple scattering, non-ionisation energy, DPA radiation damage etc. The cross-section depends only on a single parameter that describes the atomic screening. Moliere calculated the screening angle for the Tomas-Fermi distribution of electrons in atoms. In this paper, the screening parameter was recalculated using a more accurate atomic form-factor obtained from the self-consistent Dirac-Hartree-Fock-Slater computations. For relativistic particles, the new screening angle can differ from the Moliere approximation by up to 50%. At the same time, it is rather close to other independent calculations. At low energies, the new screening angle is different for positrons and electrons. The positron screening parameter is much larger than the electron one for heavy nuclei at energies of ∼Z keV. The impact of the screening angle on particle transport and calculated quantities is discussed. (authors)
Interplay between short-range correlated disorder and Coulomb interaction in nodal-line semimetals
Wang, Yuxuan; Nandkishore, Rahul M.
2017-09-01
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.
Influence of the Coulomb interaction on the exchange coupling in granular magnets.
Udalov, O G; Beloborodov, I S
2017-04-20
We develop a theory of the exchange interaction between ferromagnetic (FM) metallic grains embedded into insulating matrix by taking into account the Coulomb blockade effects. For bulk ferromagnets separated by the insulating layer the exchange interaction strongly depends on the height and thickness of the tunneling barrier created by the insulator. We show that for FM grains embedded into insulating matrix the exchange coupling additionally depends on the dielectric properties of this matrix due to the Coulomb blockade effects. In particular, the FM coupling decreases with decreasing the dielectric permittivity of insulating matrix. We find that the change in the exchange interaction due to the Coulomb blockade effects can be a few tens of percent. Also, we study dependence of the intergrain exchange interaction on the grain size and other parameters of the system.
Abdelmonem, M. S.; Abdel-Hady, Afaf; Nasser, I.
2017-07-01
The scaling laws are given for the entropies in the information theory, including the Shannon's entropy, its power, the Fisher's information and the Fisher-Shannon product, using the exponential-cosine screened Coulomb potential. The scaling laws are specified, in the r-space, as a function of |μ - μc, nℓ|, where μ is the screening parameter and μc, nℓ its critical value for the specific quantum numbers n and ℓ. Scaling laws for other physical quantities, such as energy eigenvalues, the moments, static polarisability, transition probabilities, etc. are also given. Some of these are reported for the first time. The outcome is compared with the available literatures' results.
International Nuclear Information System (INIS)
Kravtsov, V.E.; Mal'shukov, A.G.
1978-01-01
The influence of s-d Coulomb interaction on the superconductive critical temperature Tsub(c) of transition element compounds and their dilute alloys was investigated in the frame of Anderson model. Coulomb interaction of electrons with opposite spins on the same atom was considered in a ladder approximation valid when hybridization is sufficiently small while s-d Coulomb interaction has led to the 'parquet' summation. It is shown that s-d Coulomb interaction results in the decrease of Tsub(c) and hence the electron mechanism of superconductivity seems to be non-effective in systems under consideration. (author)
Bond alternation in the infinite polyene: effect of long range Coulomb interactions
International Nuclear Information System (INIS)
Mazumdar, S.; Campbell, D.K.
1985-01-01
We investigate the effects of long-range Coulomb interactions on bond and site dimerizations in a one-dimensional half-filled band. It is shown that the ground state broken symmetry is determined by two sharp inequalities involving the Coulomb parameters. Broken symmetry with periodicity 2k/sub F/ is guaranteed only if the first inequality (downward convexity of the intersite potential) is obeyed, while the second inequality gives the phase boundary between the bond-dimerized and site-dimerized phases. Application of these inequalities to the Pariser-Parr-Pople model for linear polyenes shows that the infinite polyene has enhanced bond alternation for both Ohno and Mataga-Nishimoto parametrizations of the intersite Coulomb terms. The possible role of distant neighbor interactions in photogeneration experiments is discussed. 26 refs., 3 figs
Coulomb Effects in Few-Body Reactions
Directory of Open Access Journals (Sweden)
Deltuva A.
2010-04-01
Full Text Available The method of screening and renormalization is used to include the Coulomb interaction between the charged particles in the momentum-space description of three- and four-body nuclear reactions. The necessity for the renormalization of the scattering amplitudes and the reliability of the method is demonstrated. The Coulomb eﬀect on observables is discussed.
The time-dependent Hartree-Fock equations with Coulomb two-body interaction
International Nuclear Information System (INIS)
Chadam, J.M.; Glassey, R.T.
1975-06-01
The existence and uniqueness of global solutions to the Cauchy problem is proved in the space of ''smooth'' density matrices for the time-dependent Hartree-Fock equations describing the motion of finite Fermi systems interacting via a Coulomb two-body potential [fr
Wang, Jing; Tian, Xue-Dong; Liu, Yi-Mou; Cui, Cui-Li; Wu, Jin-Hui
2018-06-01
We investigate the stationary entanglement properties in a hybrid system consisting of an optical cavity, a mechanical resonator, a charged object, and an atomic ensemble. Numerical results show that this hybrid system exhibits three kinds of controllable bipartite entanglements in an experimentally accessible parameter regime with the help of the charged object. More importantly, it is viable to enhance on demand each bipartite entanglement at the expense of reducing others by modulating the Coulomb coupling strength. Last but not least, these bipartite entanglements seem more robust against on the environmental temperature for the positive Coulomb interaction.
International Nuclear Information System (INIS)
Tyukhtyaev, Yu.N.
1982-01-01
The problem of taking into account the Coulomb interaction of the ladder type in the analysis of bound states in quantum electrodynamics is discussed in the framework of the quasipotential approach. The main qiasipotential equation and the quasipotential are expressed in the terms of the two-time positive frequency Coulomb Green functions. The corresponding perturbation theory is developed which makes it possible to calculate the shifts of the energy levels in hydrogen-like atoms up to α 6 lnα terms
Coulomb-like elastic interaction induced by symmetry breaking in nematic liquid crystal colloids.
Lee, Beom-Kyu; Kim, Sung-Jo; Kim, Jong-Hyun; Lev, Bohdan
2017-11-21
It is generally thought that colloidal particles in a nematic liquid crystal do not generate the first multipole term called deformation elastic charge as it violates the mechanical equilibrium. Here, we demonstrate theoretically and experimentally that this is not the case, and deformation elastic charges, as well as dipoles and quadrupoles, can be induced through anisotropic boundary conditions. We report the first direct observation of Coulomb-like elastic interactions between colloidal particles in a nematic liquid crystal. The behaviour of two spherical colloidal particles with asymmetric anchoring conditions induced by asymmetric alignment is investigated experimentally; the interaction of two particles located at the boundary of twist and parallel aligned regions is observed. We demonstrate that such particles produce deformation elastic charges and interact by Coulomb-like interactions.
Scattering at low energies by potentials containing power-law corrections to the Coulomb interaction
International Nuclear Information System (INIS)
Kuitsinskii, A.A.
1986-01-01
The low-energy asymptotic behavior is found for the phase shifts and scattering amplitudes in the case of central potentials which decrease at infinity as n/r+ar /sup -a/,a 1. In problems of atomic and nuclear physics one is generally interested in collisions of clusters consisting of several charged particles. The effective interaction potential of such clusters contains long-range power law corrections to the Coulomb interaction that is presented
Stochastic Coulomb interactions in space charge limited electron emission
Nijkerk, M.D.; Kruit, P.
2004-01-01
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
Effect of long-range repulsive Coulomb interactions on packing structure of adhesive particles.
Chen, Sheng; Li, Shuiqing; Liu, Wenwei; Makse, Hernán A
2016-02-14
The packing of charged micron-sized particles is investigated using discrete element simulations based on adhesive contact dynamic model. The formation process and the final obtained structures of ballistic packings are studied to show the effect of interparticle Coulomb force. It is found that increasing the charge on particles causes a remarkable decrease of the packing volume fraction ϕ and the average coordination number 〈Z〉, indicating a looser and chainlike structure. Force-scaling analysis shows that the long-range Coulomb interaction changes packing structures through its influence on particle inertia before they are bonded into the force networks. Once contact networks are formed, the expansion effect caused by repulsive Coulomb forces are dominated by short-range adhesion. Based on abundant results from simulations, a dimensionless adhesion parameter Ad*, which combines the effects of the particle inertia, the short-range adhesion and the long-range Coulomb interaction, is proposed and successfully scales the packing results for micron-sized particles within the latest derived adhesive loose packing (ALP) regime. The structural properties of our packings follow well the recent theoretical prediction which is described by an ensemble approach based on a coarse-grained volume function, indicating some kind of universality in the low packing density regime of the phase diagram regardless of adhesion or particle charge. Based on the comprehensive consideration of the complicated inter-particle interactions, our findings provide insight into the roles of short-range adhesion and repulsive Coulomb force during packing formation and should be useful for further design of packings.
Simbuca, using a graphics card to simulate Coulomb interactions in a penning trap
Van Gorp, S; Friedag, P; De Leebeeck, V; Tandecki, M; Weinheimer, C; Breitenfeldt, M; Traykov, E; Severijn, N; Mader, J; Soti, G; Iitaka, T; Herlert, A; Wauters, F; Zakoucky, D; Kozlov, V; Roccia, S
2011-01-01
In almost all cases, N-body simulations are limited by the computation time available. Coulomb interaction calculations scale with O(N(2)) with N the number of particles. Approximation methods exist already to reduce the computation time to O(NlogN) although calculating the interaction still dominates the total simulation time. We present Simbuca, a simulation package for thousands of ions moving in a Penning trap which will be applied for the WITCH experiment. Simbuca uses the output of the Cunbody-1 library, which calculates the gravitational interaction between entities on a graphics card, and adapts it for Coulomb calculations. Furthermore the program incorporates three realistic buffer gas models, the possibility of importing realistic electric and magnetic fieldmaps and different order integrators with adaptive step size and error control. The software is released under the GNU General Public License and free for use. Crown Copyright (C) 2010 Published by Elsevier B.V. All rights reserved.
Model-Mapped RPA for Determining the Effective Coulomb Interaction
Sakakibara, Hirofumi; Jang, Seung Woo; Kino, Hiori; Han, Myung Joon; Kuroki, Kazuhiko; Kotani, Takao
2017-04-01
We present a new method to obtain a model Hamiltonian from first-principles calculations. The effective interaction contained in the model is determined on the basis of random phase approximation (RPA). In contrast to previous methods such as projected RPA and constrained RPA (cRPA), the new method named "model-mapped RPA" takes into account the long-range part of the polarization effect to determine the effective interaction in the model. After discussing the problems of cRPA, we present the formulation of the model-mapped RPA, together with a numerical test for the single-band Hubbard model of HgBa2CuO4.
Energy Technology Data Exchange (ETDEWEB)
Kronfeldner, Klaus; Strunk, Christoph [Institute for Experimental and Applied Physics, University of Regensburg (Germany); Baturina, Tatyana [A.V. Rzhanov Institute of Semiconductor Physics, SB RAS (Russian Federation)
2016-07-01
We have measured the conductance of square shaped TiN films on the superconducting and the insulating side of the superconductor/insulator transition. The conductance shows thermally activated behaviour with an activation energy k{sub B}T{sub 0}(L) ∝ lnL, with L being the lateral size of the squares. Such behavior is consistent with 2D long-ranged Coulomb interactions with a large electrostatic screening length Λ ≅ 200 μm. To independently test whether long ranged Coulomb interactions can be responsible for the observed size dependence we compare R(T,B) of a large TiN film in the critical region with and without a screening Pd layer in a distance t ∼ 60 nm to the TiN film. The screening Pd-layer is expected to reduce the activation energy from ∝ ln [min(L,Λ)] to ∝ ln(t) and the thermally activated resistance in films with L >or similar Λ by the large number Λ/t ≅ 3000. In contrast, our experiment showed no significant reduction of R(T) and T{sub 0}. This suggests that the measured size dependent conductance of our TiN film is not related to long-ranged Coulomb interactions.
Li, Ye; Yip, Wai Tak
2004-12-07
We employed negatively charged fluorescein (FL), positively charged rhodamine 6G (R6G), and neutral Nile Red (NR) as molecular probes to investigate the influence of Coulombic interaction on their deposition into and rotational mobility inside polyelectrolyte multilayer (PEM) films. The entrapment efficiency of the dyes reveals that while Coulombic repulsion has little effect on dye deposition, Coulombic attraction can dramatically enhance the loading efficiency of dyes into a PEM film. By monitoring the emission polarization of single dye molecules in polyethylenimine (PEI) films, the percentages of mobile R6G, NR, and FL were determined to be 87 +/- 4%, 76 +/- 5%, and 68 +/- 3%, respectively. These mobility distributions suggest that cationic R6G enjoys the highest degree of rotational freedom, whereas anionic FL shows the least mobility because of Coulombic attraction toward cationic PEI. Regardless of charges, this high percentage of mobile molecules is in stark contrast to the 5-40% probe mobility reported from spun-cast polymer films, indicating that our PEI films contain more free volume and display richer polymer dynamics. These observations demonstrate the potential of using isolated fluorescent probes to interrogate the internal structure of a PEM film at a microscopic level.
Testing refined shell-model interactions in the sd shell: Coulomb excitation of Na26
Siebeck, B; Blazhev, A; Reiter, P; Altenkirch, R; Bauer, C; Butler, P A; De Witte, H; Elseviers, J; Gaffney, L P; Hess, H; Huyse, M; Kröll, T; Lutter, R; Pakarinen, J; Pietralla, N; Radeck, F; Scheck, M; Schneiders, D; Sotty, C; Van Duppen, P; Vermeulen, M; Voulot, D; Warr, N; Wenander, F
2015-01-01
Background: Shell-model calculations crucially depend on the residual interaction used to approximate the nucleon-nucleon interaction. Recent improvements to the empirical universal sd interaction (USD) describing nuclei within the sd shell yielded two new interactions—USDA and USDB—causing changes in the theoretical description of these nuclei. Purpose: Transition matrix elements between excited states provide an excellent probe to examine the underlying shell structure. These observables provide a stringent test for the newly derived interactions. The nucleus Na26 with 7 valence neutrons and 3 valence protons outside the doubly-magic 16O core is used as a test case. Method: A radioactive beam experiment with Na26 (T1/2=1,07s) was performed at the REX-ISOLDE facility (CERN) using Coulomb excitation at safe energies below the Coulomb barrier. Scattered particles were detected with an annular Si detector in coincidence with γ rays observed by the segmented MINIBALL array. Coulomb excitation cross sections...
Seth, Priyanka; Hansmann, Philipp; van Roekeghem, Ambroise; Vaugier, Loig; Biermann, Silke
2017-08-04
The determination of the effective Coulomb interactions to be used in low-energy Hamiltonians for materials with strong electronic correlations remains one of the bottlenecks for parameter-free electronic structure calculations. We propose and benchmark a scheme for determining the effective local Coulomb interactions for charge-transfer oxides and related compounds. Intershell interactions between electrons in the correlated shell and ligand orbitals are taken into account in an effective manner, leading to a reduction of the effective local interactions on the correlated shell. Our scheme resolves inconsistencies in the determination of effective interactions as obtained by standard methods for a wide range of materials, and allows for a conceptual understanding of the relation of cluster model and dynamical mean field-based electronic structure calculations.
Azimuthal angle dependence of Coulomb and nuclear interactions between two deformed nuclei
International Nuclear Information System (INIS)
Ismail, M.; Ellithi, A. Y.; Botros, M. M.; Mellik, A. E.
2007-01-01
The azimuthal angle (φ) variation of the Coulomb and nuclear heavy ion (HI) potentials is studied in the framework of the double folding model, which is derived from realistic nuclear density distributions and a nucleon-nucleon (NN) interaction. The present calculation shows that the variation of HI potentials with the azimuthal angle depends strongly on the range of the NN forces. For the long-range Coulomb force, the maximum variation with φ is about 0.9%, and for HI potential derived from zero-range NN interaction the φ-variation can reach up to 90.0%. Our calculations are compared with the recent φ-dependence of the HI potential derived from proximity method. The present realistic φ-dependence calculations of the HI potential is completely different from the results of the proximity calculations
Coulomb Interaction between InAs/GaAs Quantum Dots and Adjacent Impurities
International Nuclear Information System (INIS)
Engstroem, O.; Kaniewska, M.; Kaczmarczyk, M.
2011-01-01
Defects positioned close to a plane of quantum dots (QDs) are shown to be influenced by coulomb interaction effect when the quantum dots are charged by electrons. Signals from deep level transient spectroscopy (DLTS) measurement give rise to a mirror effect in the spectrum depending on movement of the defect energy level in relation to the Fermi-level as a result of the electron traffic at the QDs.
Huang, K.-N.
1977-01-01
A computational procedure for calculating correlated wave functions is proposed for three-particle systems interacting through Coulomb forces. Calculations are carried out for the muonic helium atom. Variational wave functions which explicitly contain interparticle coordinates are presented for the ground and excited states. General Hylleraas-type trial functions are used as the basis for the correlated wave functions. Excited-state energies of the muonic helium atom computed from 1- and 35-term wave functions are listed for four states.
Self-Consistent Monte Carlo Study of the Coulomb Interaction under Nano-Scale Device Structures
Sano, Nobuyuki
2011-03-01
It has been pointed that the Coulomb interaction between the electrons is expected to be of crucial importance to predict reliable device characteristics. In particular, the device performance is greatly degraded due to the plasmon excitation represented by dynamical potential fluctuations in high-doped source and drain regions by the channel electrons. We employ the self-consistent 3D Monte Carlo (MC) simulations, which could reproduce both the correct mobility under various electron concentrations and the collective plasma waves, to study the physical impact of dynamical potential fluctuations on device performance under the Double-gate MOSFETs. The average force experienced by an electron due to the Coulomb interaction inside the device is evaluated by performing the self-consistent MC simulations and the fixed-potential MC simulations without the Coulomb interaction. Also, the band-tailing associated with the local potential fluctuations in high-doped source region is quantitatively evaluated and it is found that the band-tailing becomes strongly dependent of position in real space even inside the uniform source region. This work was partially supported by Grants-in-Aid for Scientific Research B (No. 2160160) from the Ministry of Education, Culture, Sports, Science and Technology in Japan.
Han, SangEun; Moon, Eun-Gook
2018-06-01
Topological states may be protected by a lattice symmetry in a class of topological semimetals. In three spatial dimensions, the Berry flux around gapless excitations in momentum space concretely defines a chirality, so a protecting symmetry may be referred to as a chiral symmetry. Prime examples include a Dirac semimetal (DSM) in a distorted spinel, BiZnSiO4, protected by a mirror symmetry, and a DSM in Na3Bi , protected by a rotational symmetry. In these states, topology and chiral symmetry are intrinsically tied. In this Rapid Communication, the characteristic interplay between a chiral symmetry order parameter and an instantaneous long-range Coulomb interaction is investigated with the standard renormalization group method. We show that a topological transition associated with chiral symmetry is stable under the presence of a Coulomb interaction and the electron velocity always becomes faster than the one of a chiral symmetry order parameter. Thus, the transition must not be relativistic, which implies that supersymmetry is intrinsically forbidden by the long-range Coulomb interaction. Asymptotically exact universal ratios of physical quantities such as the energy gap ratio are obtained, and connections with experiments and recent theoretical proposals are also discussed.
Magnetic field effect on the Coulomb interaction of acceptors in semimagnetic quantum dot
Energy Technology Data Exchange (ETDEWEB)
Kalpana, P.; Merwyn, A.; Nithiananthi, P.; Jayakumar, K., E-mail: kjkumar-gri@rediffmail.com [Nanostructure Lab, Department of Physics, Gandhigram Rural University, Gandhigram-624302 (India); Reuben, Jasper D. [Department of Physics, School of Engineering, Saveetha University, Thandalam, Chennai- 600104 (India)
2015-06-24
The Coulomb interaction of holes in a Semimagnetic Cd{sub 1-x}Mn{sub x}Te / CdTe Spherical and Cubical Quantum Dot (SMQD) in a magnetic field is studied using variational approach in the effective mass approximation. Since these holes in QD show a pronounced collective behavior, while distinct single particle phenomena is suppressed, their interaction in confined potential becomes very significant. It has been observed that acceptor-acceptor interaction is more in cubical QD than in spherical QD which can be controlled by the magnetic field. The results are presented and discussed.
Magnetic field effect on the Coulomb interaction of acceptors in semimagnetic quantum dot
Kalpana, P.; Merwyn, A.; Reuben, Jasper D.; Nithiananthi, P.; Jayakumar, K.
2015-06-01
The Coulomb interaction of holes in a Semimagnetic Cd1-xMnxTe / CdTe Spherical and Cubical Quantum Dot (SMQD) in a magnetic field is studied using variational approach in the effective mass approximation. Since these holes in QD show a pronounced collective behavior, while distinct single particle phenomena is suppressed, their interaction in confined potential becomes very significant. It has been observed that acceptor-acceptor interaction is more in cubical QD than in spherical QD which can be controlled by the magnetic field. The results are presented and discussed.
Influence of long-range Coulomb interaction in velocity map imaging.
Barillot, T; Brédy, R; Celep, G; Cohen, S; Compagnon, I; Concina, B; Constant, E; Danakas, S; Kalaitzis, P; Karras, G; Lépine, F; Loriot, V; Marciniak, A; Predelus-Renois, G; Schindler, B; Bordas, C
2017-07-07
The standard velocity-map imaging (VMI) analysis relies on the simple approximation that the residual Coulomb field experienced by the photoelectron ejected from a neutral or ion system may be neglected. Under this almost universal approximation, the photoelectrons follow ballistic (parabolic) trajectories in the externally applied electric field, and the recorded image may be considered as a 2D projection of the initial photoelectron velocity distribution. There are, however, several circumstances where this approximation is not justified and the influence of long-range forces must absolutely be taken into account for the interpretation and analysis of the recorded images. The aim of this paper is to illustrate this influence by discussing two different situations involving isolated atoms or molecules where the analysis of experimental images cannot be performed without considering long-range Coulomb interactions. The first situation occurs when slow (meV) photoelectrons are photoionized from a neutral system and strongly interact with the attractive Coulomb potential of the residual ion. The result of this interaction is the formation of a more complex structure in the image, as well as the appearance of an intense glory at the center of the image. The second situation, observed also at low energy, occurs in the photodetachment from a multiply charged anion and it is characterized by the presence of a long-range repulsive potential. Then, while the standard VMI approximation is still valid, the very specific features exhibited by the recorded images can be explained only by taking into consideration tunnel detachment through the repulsive Coulomb barrier.
Energy Technology Data Exchange (ETDEWEB)
Macdonald, J. (Delaware, University, Newark (USA))
1991-05-01
The results of accurate calculations of collision integrals for the attractive static screened Coulomb potential are presented. To obtain high accuracy with minimal computational cost, the integrals are evaluated by a quadrature method based on the Whittaker cardinal function. The collision integrals for the attractive potential are needed for calculation of the electrical conductivity of a dense fully or partially ionized plasma, and the results presented here are appropriate for the conditions in the nondegenerate envelopes of white dwarf stars. 25 refs.
Directory of Open Access Journals (Sweden)
Fu Ying-Jhe
2010-01-01
Full Text Available Abstract We report on the diamagnetic responses of different exciton complexes in single InAs/GaAs self-assembled quantum dots (QDs and quantum rings (QRs. For QDs, the imbalanced magnetic responses of inter-particle Coulomb interactions play a crucial role in the diamagnetic shifts of excitons (X, biexcitons (XX, and positive trions (X−. For negative trions (X− in QDs, anomalous magnetic responses are observed, which cannot be described by the conventional quadratic energy shift with the magnetic field. The anomalous behavior is attributed to the apparent change in the electron wave function extent after photon emission due to the strong Coulomb attraction by the hole in its initial state. In QRs, the diamagnetic responses of X and XX also show different behaviors. Unlike QDs, the diamagnetic shift of XX in QRs is considerably larger than that of X. The inherent structural asymmetry combined with the inter-particle Coulomb interactions makes the wave function distribution of XX very different from that of X in QRs. Our results suggest that the phase coherence of XX in QRs may survive from the wave function localization due to the structural asymmetry or imperfections.
International Nuclear Information System (INIS)
Satchler, G.R.
1990-01-01
This paper contains comments on the current status and possible future directions of research on heavy-ion interactions near the Coulomb barrier. Fusion reactions, elastic and inelastic scattering and transfer reactions are discussed
Harb, Moussab; Cavallo, Luigi; Basset, Jean-Marie
2014-01-01
theory (DFT, including the perturbation theory DFPT) within the screened coulomb hybrid (HSE06) exchange-correlation formalism. Among the various explored self-defective structures, a strong stabilization is obtained for the configuration displaying a
International Nuclear Information System (INIS)
Lee, Wonjoo; Lee, Seung Yong; Zhang Xin; Rabin, Oded; Briber, R M
2013-01-01
We present a novel and simple method for forming hexagonal gold nanoparticle arrays that uses Coulombic interactions between negatively charged gold nanoparticles on positively charged vertically oriented poly(4-vinylpyridine) cylinders formed in a spin cast polystyrene-b-poly(4-vinylpyridine) block copolymer film. Exposure of the block copolymer film to dibromobutane vapor quaternizes and crosslinks the poly(4-vinylpyridine) domains which allows for the templated deposition of gold nanoparticles into a self-assembled hexagonal array through electrostatic interactions. These systems can form the basis for sensors or next generation nanoparticle based electronics. (paper)
Fermi-edge singularity in one-dimensional electron systems with long-range Coulomb interactions
International Nuclear Information System (INIS)
Otani, H.; Ogawa, T.
1996-01-01
Effects of long-range Coulomb interactions on the Fermi-edge singularity in optical spectra are investigated theoretically for one-dimensional spin-1/2 fermion systems with the use of the Tomonaga-Luttinger bosonization technique. Low-energy excitation spectrum near the Fermi level shows that dispersion of the charge-density fluctuation remains gapless but is nonlinear when the electron-electron (e-e) Coulomb interaction is of the x -1 type (i.e., an infinite force range). Temporal behavior of the current-current correlation function is calculated analytically for arbitrary force ranges, λ e and λ h , of the e-e and the electron-hole (e-h) Coulomb interactions. (i) When both the e-e and the e-h interactions have large but finite force ranges (λ e h max[λ e ,λ h ]/v F . Corresponding optical spectrum near the Fermi edge (within an energy range of ℎv F /max[λ e ,λ h ]) exhibits the power-law divergence or the power-law convergence, which is an ordinary Fermi-edge singularity. (ii) When either the e-e or the e-h interaction is of the x -1 type (i.e., λ e →∞ and/or λ h →∞), an exponent of the correlation function is dependent on time to lead the faster decay than that of any power laws. Then the optical spectra show no power law dependence and always converge (become zero) at the Fermi edge, which is in striking contrast to the ordinary power-law singularity
International Nuclear Information System (INIS)
Correa, J.R.; Chang Yongbin; Ordonez, C.A.
2005-01-01
Collisional scattering is considered within a system of charged particles experiencing binary Coulomb interactions when the scale length for the range of each interaction is not isotropic and is not necessarily equal to the Debye length. For example, one or more dimensions of the system could be smaller than the Debye length. The effect is assessed by evaluating integrals over the impact cross section. Cutoffs on both the impact parameter and the Coulomb interaction potential are employed, and no assumption is made regarding the value of the Coulomb logarithm. Two expressions are found that have a dependence on the cutoff lengths, with one of the expressions being associated with the Coulomb logarithm. Collisional scattering within an electrostatic ion trap is considered by way of example
Martinez, Antonio; Barker, John R; Di Prieto, Riccardo
2018-06-13
A methodology describing Coulomb blockade in the Non-equilibrium Green Function formalism is presented. We carried out ballistic and dissipative simulations through a 1D quantum dot using an Einstein phonon model. Inelastic phonons with different energies have been considered. The methodology incorporates the short-range Coulomb interaction between two electrons through the use of a two-particle Green's function. Unlike previous work, the quantum dot has spatial resolution i.e. it is not just parameterized by the energy level and coupling constants of the dot. Our method intends to describe the effect of electron localization while maintaining an open boundary or extended wave function. The formalism conserves the current through the nanostructure. A simple 1D model is used to explain the increase of mobility in semi-crystalline polymers as a function of the electron concentration. The mechanism suggested is based on the lifting of energy levels into the transmission window as a result of the local electron-electron repulsion inside a crystalline domain. The results are aligned with recent experimental findings. Finally, as a proof of concept, we present a simulation of a low temperature resonant structure showing the stability diagram in the Coulomb blockade regime. . © 2018 IOP Publishing Ltd.
Jafarpour, Farshid; Angheluta, Luiza; Goldenfeld, Nigel
2013-10-01
The dynamics of edge dislocations with parallel Burgers vectors, moving in the same slip plane, is mapped onto Dyson's model of a two-dimensional Coulomb gas confined in one dimension. We show that the tail distribution of the velocity of dislocations is power law in form, as a consequence of the pair interaction of nearest neighbors in one dimension. In two dimensions, we show the presence of a pairing phase transition in a system of interacting dislocations with parallel Burgers vectors. The scaling exponent of the velocity distribution at effective temperatures well below this pairing transition temperature can be derived from the nearest-neighbor interaction, while near the transition temperature, the distribution deviates from the form predicted by the nearest-neighbor interaction, suggesting the presence of collective effects.
DEFF Research Database (Denmark)
Rolle, Massimo; Muniruzzaman, Muhammad
water are cross-coupled due to the effects of Coulombic interactions. Such effects are illustrated in flow-through experiments in saturated porous media. Simple strong electrolytes (i.e., salts and strong acid solutions) were selected as tracers and their transport was studied under different advection......-dominated conditions in homogeneous and heterogeneous porous media [2-3]. The model-based interpretation of the experimental results is challenging since it requires a multicomponent ionic formulation with an accurate description of local hydrodynamic dispersion and explicitly accounting for the cross-coupling...
Coulombic interactions during advection-dominated transport of ions in porous media
DEFF Research Database (Denmark)
Muniruzzaman, Muhammad; Stolze, Lucien; Rolle, Massimo
2017-01-01
bench-scale experiments and numerical simulations. The investigation aims at quantifying the key role of small-scale electrostatic interactions in flow-through systems, especially when advection is the dominant mass-transfer process. Considering dilute solutions of strong electrolytes (e.g., MgCl2......Solute transport of charged species in porous media is significantly affected by the electrochemical migration term resulting from the charge-induced interactions among dissolved ions and with solid surfaces. Therefore, the characterization of such Coulombic interactions and their effect...... on multicomponent ionic transport is of critical importance for assessing the fate of charged solutes in porous media. In this work we present a detailed investigation of the electrochemical effects during conservative multicomponent ionic transport in homogeneous and heterogeneous domains by means of laboratory...
Role of the Coulomb interaction in the low-frequency density of states of DNA double helices
International Nuclear Information System (INIS)
Garcia, A.E.; Krumhansl, J.A.
1988-01-01
The complete vibrational frequency spectrum of several DNA double-helical oligomers is calculated using established pair potentials. Various cutoff values are used for the range of the Coulomb interactions. At very low frequency the integrated density of states shows a noninteger exponent with values ranging from 0.75 to 1.55, depending on the cutoff value for the Coulomb interactions. We conclude that the cumulative densities of states in those molecules depend more on competing interactions than on various proposed universal laws
Interplay of long-range and short-range Coulomb interactions in an Anderson-Mott insulator
Baćani, Mirko; Novak, Mario; Orbanić, Filip; Prša, Krunoslav; Kokanović, Ivan; Babić, Dinko
2017-07-01
In this paper, we tackle the complexity of coexisting disorder and Coulomb electron-electron interactions (CEEIs) in solids by addressing a strongly disordered system with intricate CEEIs and a screening that changes both with charge carrier doping level Q and temperature T . We report on an experimental comparative study of the T dependencies of the electrical conductivity σ and magnetic susceptibility χ of polyaniline pellets doped with dodecylbenzenesulfonic acid over a wide range. This material is special within the class of doped polyaniline by exhibiting in the electronic transport a crossover between a low-T variable range hopping (VRH) and a high-T nearest-neighbor hopping (NNH) well below room temperature. Moreover, there is evidence of a soft Coulomb gap ΔC in the disorder band, which implies the existence of a long-range CEEI. Simultaneously, there is an onsite CEEI manifested as a Hubbard gap U and originating in the electronic structure of doped polyaniline, which consists of localized electron states with dynamically varying occupancy. Therefore, our samples represent an Anderson-Mott insulator in which long-range and short-range CEEIs coexist. The main result of the study is the presence of a crossover between low- and high-T regimes not only in σ (T ) but also in χ (T ) , the crossover temperature T* being essentially the same for both observables over the entire doping range. The relatively large electron localization length along the polymer chains results in U being small, between 12 and 20 meV for the high and low Q , respectively. Therefore, the thermal energy at T* is sufficiently large to lead to an effective closing of the Hubbard gap and the consequent appearance of NNH in the electronic transport within the disorder band. ΔC is considerably larger than U , decreasing from 190 to 30 meV as Q increases, and plays the role of an activation energy in the NNH.
Forsberg, Björn; Ulander, Johan; Kjellander, Roland
2005-02-08
The effects of ionic size asymmetry on long-range electrostatic interactions in electrolyte solutions are investigated within the primitive model. Using the formalism of dressed ion theory we analyze correlation functions from Monte Carlo simulations and the hypernetted chain approximation for size asymmetric 1:1 electrolytes. We obtain decay lengths of the screened Coulomb potential, effective charges of ions, and effective permittivity of the solution. It is found that the variation of these quantities with the degree of size asymmetry depends in a quite intricate manner on the interplay between the electrostatic coupling and excluded volume effects. In most cases the magnitude of the effective charge of the small ion species is larger than that of the large species; the difference increases with increasing size asymmetry. The effective charges of both species are larger (in absolute value) than the bare ionic charge, except for high asymmetry where the effective charge of the large ions can become smaller than the bare charge.
International Nuclear Information System (INIS)
Almeida Ferreira, A.C. de.
1984-01-01
For problems with azimuthal symmetry in velocity space, the distribution function depends only on the speed and on the pitch angle. The angular dependence of the distribution function is expanded in Legendre polynomials, and the expansions of the collision integrals describing two-body Coulomb interactions in a plasma are determined through the use of the Rosenbluth potentials. The electron distribution function is written as a Maxwellian plus a deviation, and the representation in Legendre polynomials of the electron-electron collision term is given for both its linear and nonlinear part. To determine the representation of the electron-ion collision term it is assumed that the ion distribution is much narrower in velocity space than the electron distribution, and shifted from the origin by a flow velocity. The equations are presented in a form that is suitable for their use in a computer. (Author) [pt
Modification of the ''Coulomb'' interaction at small distances in finite quantum electrodynamics
International Nuclear Information System (INIS)
Manoukian, E.B.
1982-01-01
We investigate the ''Coulomb'' interaction in finite QED at small distances. By finite QED it is meant that we sum all photon self-energy subgraphs in renormalized QED and fix α, the renormalized fine-structure constant, as the (infinite order) zero of the Callan-Symanzik function: β(α) = 0/sup infinity/. We show that for mcVertical Barx-x 'Vertical Bar/h 1 and e 2 at x and x ', respectively, is given by V(Vertical Barx-x'Vertical Bar)approx. =(e 1 e 2 / 4πVertical Barx-x'Vertical Bar) [q 1 (α)-q 2 (α)mcVertical Barx-x'Vertical Bar / h+O(m 2 c 2 Vertical Barx-x'Vertical Bar 2 /h 2 )], where 1 1 (α) 2 (α)< infinity
Coulomb interactions in dense two-dimensional electron systems in a magnetic field
International Nuclear Information System (INIS)
Cheng, Szucheng.
1988-01-01
The simplest model of a two-dimensional system ignores the Coulomb interactions between the electrons. In this approximation, the electrons occupy the Landau levels, broadened by impurities and irregularities in the lattice. This independent electron approximation has usually been used to discuss observations for electron densities ρ and magnetic fields B where bar ν > 1 (bar ν triple-bond the number of Landau levels occupied). The most famous example is the theory of the integral Quantum Hall effect. However, when bar ν 1, electron-electron interactions should become important through the mixing of Landau levels. This thesis describes calculations for bar ν > 1 on phenomena which should be sensitive to electron-electron interactions: Wigner crystallization, the stability of the Landau levels under electron-electron interactions, the existence of quasiparticles and quasiholes, and the densities of states. The main results obtained concern: (1) The values of ρ and B where crystallization should occur when bar ν > 1. (2) The effect of electron-electron interactions in broadening the individual Landau levels, and in distributing the amplitudes for the excitation of independent electrons over many Landau levels. (3) The existence of quasiparticles and quasiholes whose lifetime is infinite near the Fermi level
Coulomb drag: a probe of electron interactions in coupled quantum wells
DEFF Research Database (Denmark)
Jauho, Antti-Pekka
1996-01-01
As semiconductor devices shrink in size and in dimensionality, interactions between charge carriers become more and more important. There is a simple physical reason behind this behavior: fewer carriers lead to less effective screening, and hence stronger effective interactions. A point in case...... are one-dimensional systems (quantum wires): there electron-electron interactions may lead to a behavior, which is qualitatively different from the standard Fermi liquid picture (Luttinger liquids). Electron-electron interactions also play a central role in the fractional quantum Hall effect, which...... be the study of quantum wires: there the interactions may lead to even more dramatic effects...
Proton-/sup 90/Zr interaction at sub-Coulomb proton energies
International Nuclear Information System (INIS)
Laird, C.E.; Flynn, D.; Hershberger, R.L.; Gabbard, F.
1987-01-01
The proton-/sup 90/Zr interaction at sub-Coulomb energies has been investigated in the context of the Lane model, with isospin coupling included, and with alternate decay modes represented with the Hauser-Feshbach model. Scattering and reaction cross sections were accurately measured in order to obtain enough information to constrain the real and absorptive parts of the proton potential. Differential elastic scattering excitation functions were measured at back angles of 135 0 and 165 0 from 2 to 7 MeV, with cross section accuracies of 3%. The energy range was sufficient to go from a region where the backscattering was predominantly Coulomb, enabling additional checks on the cross section accuracies, to a region where the gross structure of the cross sections deviated significantly from Rutherford scattering. Radiative capture cross sections were measured from 1.9 to 5.7 MeV proton energies. The capture cross sections were obtained by summing the measured cross sections for the first two primary gamma rays in addition to some 34 other transitions which terminated on the ground and first excited state. The total inelastic scattering cross section to all /sup 90/Zr excited states (except the first excited state which has been previously measured) was measured at several energies between 3.9 and 5.7 MeV by observing the radiative decay of the residual, excited /sup 90/Zr nuclei. The analysis yielded several model parameters suggestive of large nuclear structure effects. The depth of the absorptive potential was found to vary as W/sub D/ = 2.73+0.70 E/sub p/ in the 2 to 7 MeV proton energy range studied. A real diffuseness of 0.54 fm, significantly smaller than that obtained in neighboring nuclei, was obtained
International Nuclear Information System (INIS)
Tornow, W.; Howell, C.R.; Walter, R.L.; Slaus, I.
1992-01-01
Comparison of data for neutron-deuteron and proton-deuteron analyzing power A y for elastic scattering has become crucial for investigating charge-symmetry breaking in the 3 P nucleon-nucleon interactions. We extended this comparison down to 5 MeV and find that the relative difference between n-d and p-d scattering at the A y maximum near 120 degree increases with decreasing energy. By applying a straightforward Coulomb ''correction'' to the p-d data, we account for most of the difference, suggesting that the Coulomb force, rather than charge-symmetry breaking, is responsible for most of the observed difference
International Nuclear Information System (INIS)
Wang Qing; Hou Yu-Long; Jing Jian; Long Zheng-Wen
2014-01-01
In this paper, we study symmetrical properties of two-dimensional (2D) screened Dirac Hydrogen atom and isotropic harmonic oscillator with scalar and vector potentials of equal magnitude (SVPEM). We find that it is possible for both cases to preserve so(3) and su(2) dynamical symmetries provided certain conditions are satisfied. Interestingly, the conditions for preserving these dynamical symmetries are exactly the same as non-relativistic screened Hydrogen atom and screened isotropic oscillator preserving their dynamical symmetries. Some intuitive explanations are proposed. (general)
Fermi Surface of Sr_{2}RuO_{4}: Spin-Orbit and Anisotropic Coulomb Interaction Effects.
Zhang, Guoren; Gorelov, Evgeny; Sarvestani, Esmaeel; Pavarini, Eva
2016-03-11
The topology of the Fermi surface of Sr_{2}RuO_{4} is well described by local-density approximation calculations with spin-orbit interaction, but the relative size of its different sheets is not. By accounting for many-body effects via dynamical mean-field theory, we show that the standard isotropic Coulomb interaction alone worsens or does not correct this discrepancy. In order to reproduce experiments, it is essential to account for the Coulomb anisotropy. The latter is small but has strong effects; it competes with the Coulomb-enhanced spin-orbit coupling and the isotropic Coulomb term in determining the Fermi surface shape. Its effects are likely sizable in other correlated multiorbital systems. In addition, we find that the low-energy self-energy matrix-responsible for the reshaping of the Fermi surface-sizably differs from the static Hartree-Fock limit. Finally, we find a strong spin-orbital entanglement; this supports the view that the conventional description of Cooper pairs via factorized spin and orbital part might not apply to Sr_{2}RuO_{4}.
McClarty, P. A.; O'Brien, A.; Pollmann, F.
2014-05-01
We consider a classical model of charges ±q on a pyrochlore lattice in the presence of long-range Coulomb interactions. This model first appeared in the early literature on charge order in magnetite [P. W. Anderson, Phys. Rev. 102, 1008 (1956), 10.1103/PhysRev.102.1008]. In the limit where the interactions become short ranged, the model has a ground state with an extensive entropy and dipolar charge-charge correlations. When long-range interactions are introduced, the exact degeneracy is broken. We study the thermodynamics of the model and show the presence of a correlated charge liquid within a temperature window in which the physics is well described as a liquid of screened charged defects. The structure factor in this phase, which has smeared pinch points at the reciprocal lattice points, may be used to detect charge ice experimentally. In addition, the model exhibits fractionally charged excitations ±q/2 which are shown to interact via a 1/r potential. At lower temperatures, the model exhibits a transition to a long-range ordered phase. We are able to treat the Coulombic charge ice model and the dipolar spin ice model on an equal footing by mapping both to a constrained charge model on the diamond lattice. We find that states of the two ice models are related by a staggering field which is reflected in the energetics of these two models. From this perspective, we can understand the origin of the spin ice and charge ice ground states as coming from a dipolar model on a diamond lattice. We study the properties of charge ice in an external electric field, finding that the correlated liquid is robust to the presence of a field in contrast to the case of spin ice in a magnetic field. Finally, we comment on the transport properties of Coulombic charge ice in the correlated liquid phase.
Chan, Ho Yin; Lankevich, Vladimir; Vekilov, Peter G.; Lubchenko, Vassiliy
2012-01-01
Toward quantitative description of protein aggregation, we develop a computationally efficient method to evaluate the potential of mean force between two folded protein molecules that allows for complete sampling of their mutual orientation. Our model is valid at moderate ionic strengths and accounts for the actual charge distribution on the surface of the molecules, the dielectric discontinuity at the protein-solvent interface, and the possibility of protonation or deprotonation of surface residues induced by the electric field due to the other protein molecule. We apply the model to the protein lysozyme, whose solutions exhibit both mesoscopic clusters of protein-rich liquid and liquid-liquid separation; the former requires that protein form complexes with typical lifetimes of approximately milliseconds. We find the electrostatic repulsion is typically lower than the prediction of the Derjaguin-Landau-Verwey-Overbeek theory. The Coulomb interaction in the lowest-energy docking configuration is nonrepulsive, despite the high positive charge on the molecules. Typical docking configurations barely involve protonation or deprotonation of surface residues. The obtained potential of mean force between folded lysozyme molecules is consistent with the location of the liquid-liquid coexistence, but produces dimers that are too short-lived for clusters to exist, suggesting lysozyme undergoes conformational changes during cluster formation. PMID:22768950
Calculation of effective Coulomb interaction in PrCoO3
Dutta, Paromita; Lal, Sohan; Pandey, Sudhir K.
2018-04-01
It is very essential to know the suitable value of effective coulomb interaction (Ueff) which will be material specific, if one wants to learn about various physical features of strongly correlated systems in an extensive manner. In present work, the constrained density function theory (DFT) method has been used to evaluate the suitable Ueff value between the localized electrons for 3d and 4f orbitals in strongly correlated system. For the evaluation of suitable Ueff, the d/f-linearization energy (Ed/f) is very important and is found to be >= 44 eV above Fermi level. The Ueff is predicted by local density approximation (LDA) functional for both the impurity atoms separately are found to be Co (3d electrons) ˜ 6.3 eV and Pr (4f electrons) ˜ 7.0 eV for Ed/f ˜ 44 eV above Fermi level. The Ueff value for Pr (4f electrons) is higher than Co (3d electrons). This indicates that Pr 4f electrons is more localized than Co 3d electrons in PrCoO3 compound.
Energy Technology Data Exchange (ETDEWEB)
Ogloblya, O.V., E-mail: olexandr.ogloblya@gmail.com [Taras Shevchenko National University, 64/13 Volodymyrska St., Kyiv 01601 (Ukraine); Kuznietsova, H.M. [Taras Shevchenko National University, 64/13 Volodymyrska St., Kyiv 01601 (Ukraine); Strzhemechny, Y.M. [Dept. of Physics and Astronomy, Texas Christian University, Fort Worth, TX 76129 (United States)
2017-01-01
We performed numerical studies for the conductance of a heterojunction carbon nanotube quantum dot (QD) with an extra spin orbital quantum number and a conventional QD in which the electron state is determined only by the spin quantum number. Our computational approach took into account the spin-orbit interaction and the Coulomb repulsion both between electrons on a QD as well as between the QD electron and the contacts. We utilized an approach based on the Keldysh non-equilibrium Green's function formalism as well as the equation of motion technique. We focused on the case of a finite Coulombic on-site repulsion and considered two possible cases of applied voltage: spin bias and conventional bias. For the system of interest we obtained bias spectroscopy diagrams, i.e. contour charts showing dependence of conductivity on two variables - voltage and the energy level position in a QD - which can be controlled by the plunger gate voltage. The finite Coulombic repulsion splits the density of states into two distinct maxima with the energy separation between them controlled by that parameter. It was also shown that an increase of either the value of the on-site Coulomb repulsion in a QD or the parameter of the Coulomb repulsion between the electrons in the QD and the contacts leads to an overall shift of the density of electronic states dependence toward higher energy values. Presence of the QD-lead interaction yields formation of a new pair of peaks in the differential conductance dependence. We also show that existence of four quantum states in a QD leads to abrupt changes in the density of states. These results could be beneficial for potential applications in nanotube-based amperometric sensors.
Tkachenko, O. A.; Tkachenko, V. A.; Terekhov, I. S.; Sushkov, O. P.
2014-01-01
A residual disorder in the gate system is the main problem on the way to create artificial graphene based on two-dimensional electron gas. The disorder can be significantly screened/reduced due to the many-body effects. To analyse the screening/disorder problem we consider AlGaAs/GaAs/AlGaAs heterostructure with two metallic gates. We demonstrate that the design least susceptible to the disorder corresponds to the weak coupling regime (opposite to tight binding) which is realised via system o...
Pandit, Rishi R.; Becker, Valerie R.; Barrington, Kasey; Thurston, Jeremy; Ramunno, Lora; Ackad, Edward
2018-04-01
An intense, short laser pulse incident on rare-gas clusters can produce nano-plasmas containing energetic electrons. As these electrons undergo scattering, from both phonons and ions, they emit bremsstrahlung radiation. Here, we compare a theory of bremsstrahlung emission appropriate for the interaction of intense lasers with matter using soft-core potentials and Coulombic potentials. A new scaling for the radiation cross-section and the radiated power via bremsstrahlung is derived for a soft-core potential (which depends on the potential depth) and compared with the Coulomb potential. Calculations using the new scaling are performed for electrons in vacuum ultraviolet, infrared and mid-infrared laser pulses. The radiation cross-section and the radiation power via bremsstrahlung are found to increase rapidly with increases in the potential depth of up to around 200 eV and then become mostly saturated for larger depths while remaining constant for the Coulomb potential. In both cases, the radiation cross-section and the radiation power of bremsstrahlung decrease with increases in the laser wavelength. The ratio of the scattering amplitude for the soft-core potential and that for the Coulombic potential decreases exponentially with an increase in momentum transfer. The bremsstrahlung emission by electrons in plasmas may provide a broadband light source for diagnostics.
International Nuclear Information System (INIS)
Wundt, B.J.; Jentschura, U.D.
2012-01-01
We investigate the coupling of the electromagnetic sources (charge and current densities) to the scalar and vector potentials in classical electrodynamics, using Green function techniques. As is well known, the scalar potential shows an action-at-a-distance behavior in Coulomb gauge. The conundrum generated by the instantaneous interaction has intrigued physicists for a long time. Starting from the differential equations that couple the sources to the potentials, we here show in a concise derivation, using the retarded Green function, how the instantaneous interaction cancels in the calculation of the electric field. The time derivative of a specific additional term in the vector potential, present only in Coulomb gauge, yields a supplementary contribution to the electric field which cancels the gradient of the instantaneous Coulomb gauge scalar potential, as required by gauge invariance. This completely eliminates the contribution of the instantaneous interaction from the electric field. It turns out that a careful formulation of the retarded Green function, inspired by field theory, is required in order to correctly treat boundary terms in partial integrations. Finally, compact integral representations are derived for the Liénard–Wiechert potentials (scalar and vector) in Coulomb gauge which manifestly contain two compensating action-at-a-distance terms. - Highlights: ► We investigate action-at-a-distance effects in electrodynamics in detail. ► We calculate the instantaneous interactions for scalar and vector potentials. ► The cancellation mechanism involves the retarded Green function. ► The mechanism is confirmed on the example of moving point charges. ► The Green function has to be treated with care for nontrivial boundary terms.
International Nuclear Information System (INIS)
Bobrov, V.B.; Triger, S.A.
1994-01-01
The effective collision frequency method developed earlier by the authors for Coulomb systems characterized by strong interion interaction is developed further. An explicit expression is obtained for the effective electron collision frequency on the basis of the exact diagram representation obtained in Part I and the use of the model of a one-component plasma as initial approximation. The description of plasma structure in the corresponding approximation is considered. 25 refs
Sensitivity of electrospray molecular dynamics simulations to long-range Coulomb interaction models.
Mehta, Neil A; Levin, Deborah A
2018-03-01
Molecular dynamics (MD) electrospray simulations of 1-ethyl-3-methylimidazolium tetrafluoroborate (EMIM-BF_{4}) ion liquid were performed with the goal of evaluating the influence of long-range Coulomb models on ion emission characteristics. The direct Coulomb (DC), shifted force Coulomb sum (SFCS), and particle-particle particle-mesh (PPPM) long-range Coulomb models were considered in this work. The DC method with a sufficiently large cutoff radius was found to be the most accurate approach for modeling electrosprays, but, it is computationally expensive. The Coulomb potential energy modeled by the DC method in combination with the radial electric fields were found to be necessary to generate the Taylor cone. The differences observed between the SFCS and the DC in terms of predicting the total ion emission suggest that the former should not be used in MD electrospray simulations. Furthermore, the common assumption of domain periodicity was observed to be detrimental to the accuracy of the capillary-based electrospray simulations.
Diffusion in Coulomb crystals.
Hughto, J; Schneider, A S; Horowitz, C J; Berry, D K
2011-07-01
Diffusion in Coulomb crystals can be important for the structure of neutron star crusts. We determine diffusion constants D from molecular dynamics simulations. We find that D for Coulomb crystals with relatively soft-core 1/r interactions may be larger than D for Lennard-Jones or other solids with harder-core interactions. Diffusion, for simulations of nearly perfect body-centered-cubic lattices, involves the exchange of ions in ringlike configurations. Here ions "hop" in unison without the formation of long lived vacancies. Diffusion, for imperfect crystals, involves the motion of defects. Finally, we find that diffusion, for an amorphous system rapidly quenched from Coulomb parameter Γ=175 to Coulomb parameters up to Γ=1750, is fast enough that the system starts to crystalize during long simulation runs. These results strongly suggest that Coulomb solids in cold white dwarf stars, and the crust of neutron stars, will be crystalline and not amorphous.
Wahlberg, Nanna; Madsen, Anders Ø; Mikkelsen, Kurt V
2018-06-09
The nucleation processes of acetaminophen on poly(methyl methacrylate) and poly(vinyl acetate) have been investigated and the mechanisms of the processes are studied. This is achieved by a combination of theoretical models and computational investigations within the framework of a modified QM/MM method; a Coulomb-van der Waals model. We have combined quantum mechanical computations and electrostatic models at the atomistic level for investigating the stability of different orientations of acetaminophen on the polymer surfaces. Based on the Coulomb-van der Waals model, we have determined the most stable orientation to be a flat orientation, and the strongest interaction is seen between poly(vinyl acetate) and the molecule in a flat orientation in vacuum.
Harb, Moussab; Masih, Dilshad; Takanabe, Kazuhiro
2014-01-01
with high accuracy using advanced first-principles quantum methods based on DFT (including the perturbation theory approach DFPT) within the screened coulomb hybrid HSE06 exchange-correlation formalism. The calculated density of states are found
Periodicity and chaos in strongly perturbed classical orbitals for Coulomb interactions
Energy Technology Data Exchange (ETDEWEB)
Klar, H
1986-01-01
Within the framework of classical mechanics two prototypes of strongly perturbed orbitals, the diamagnetism in hydrogen and electronic double excitation, are analyzed near critical phase space points (fixed points). The motion of the hydrogen electron under the joint influence of the Coulomb field and the magnetic field is periodic for any field strengths. For a two-electron atom however the author finds a chaotic time evolution of the electron pair correlation, causing presumably irregular spectral patterns. (Auth.).
International Nuclear Information System (INIS)
McGowan, F.K.; Stelson, P.H.
1974-01-01
The theory of Coulomb excitation and a brief review of pertinent treatments of the Coulomb excitation process that are useful for the analysis of experiments are given. Examples demonstrating the scope of nuclear structure information obtainable from gamma spectroscopy are presented. Direct Elambda excitation of 232 Th is discussed in terms of the one phonon octupole vibrational spectrum. B(MI) reduced transition probabilities resulting from Coulomb excitation of odd-A deformed nuclei with heavy ions are presented as a test of the rotational model. The use of gamma ray coincidence and particle-gamma coincidence as tools for investigating Coulomb excitation is discussed. (U.S.)
The Fermi surface of Sr{sub 2}RuO{sub 4}: spin-orbit and anisotropic Coulomb interaction effects
Energy Technology Data Exchange (ETDEWEB)
Zhang, Guoren; Gorelov, Evgeny; Sarvestani, Esmaeel; Pavarini, Eva [Institute for Advanced Simulation, Forschungszentrum Juelich, D-52425 Juelich (Germany)
2016-07-01
The topology of the Fermi surface of Sr{sub 2}RuO{sub 4} is well described by local density approximation calculations with spin-orbit interaction, but the relative size of its different sheets is not. By accounting for many-body effects via dynamical mean-field theory, we show that the standard isotropic Coulomb interaction worsen or does not correct this discrepancy. In order to reproduce experiments, it is essential to include the Coulomb anisotropy. The latter is small but has strong effects; it competes with the Coulomb-enhanced spin-orbit coupling and with the isotropic Coulomb term. This mechanism is likely to be at work in other multi-orbital systems. Finally, we find a strong spin-orbital entanglement. This supports the view that the conventional description of Cooper pairs via factorized spin and orbital part might not apply to Sr{sub 2}RuO{sub 4}.
Unitary Pole Approximation For 16O S12state And 40ca P32state When Coulomb Interaction Is Included
Directory of Open Access Journals (Sweden)
A. Acharya
2015-08-01
Full Text Available Abstract The form factor of a separable interaction between a pair of particles is an important input in a three body calculation for a transfer reaction. The three body equations of Alt Grassberger and Sandhas have been solved for a system of three particles viz.p n and 16Oand p n and 40Ca when coulomb interaction is included between the particle pairs. The input in this calculation i.e. the two body t-matrices representing the interaction between the pairs of particles is taken to be of a separable form conforming to the bound state of the pair. The form factors of the total interaction between the particle pairs are constructed using the prescription of Ueta and Bund.
Ji, Hyunjin; Joo, Min-Kyu; Yi, Hojoon; Choi, Homin; Gul, Hamza Zad; Ghimire, Mohan Kumar; Lim, Seong Chu
2017-08-30
There is a general consensus that the carrier mobility in a field-effect transistor (FET) made of semiconducting transition-metal dichalcogenides (s-TMDs) is severely degraded by the trapping/detrapping and Coulomb scattering of carriers by ionic charges in the gate oxides. Using a double-gated (DG) MoTe 2 FET, we modulated and enhanced the carrier mobility by adjusting the top- and bottom-gate biases. The relevant mechanism for mobility tuning in this device was explored using static DC and low-frequency (LF) noise characterizations. In the investigations, LF-noise analysis revealed that for a strong back-gate bias the Coulomb scattering of carriers by ionized traps in the gate dielectrics is strongly screened by accumulation charges. This significantly reduces the electrostatic scattering of channel carriers by the interface trap sites, resulting in increased mobility. The reduction of the number of effective trap sites also depends on the gate bias, implying that owing to the gate bias, the carriers are shifted inside the channel. Thus, the number of active trap sites decreases as the carriers are repelled from the interface by the gate bias. The gate-controlled Coulomb-scattering parameter and the trap-site density provide new handles for improving the carrier mobility in TMDs, in a fundamentally different way from dielectric screening observed in previous studies.
Vortex Ring Interaction with a Heated Screen
Smith, Jason; Krueger, Paul S.
2008-11-01
Previous examinations of vortex rings impinging on porous screens has shown the reformation of the vortex ring with a lower velocity after passing through the screen, the creation of secondary vortices, and mixing. A heated screen could, in principle, alter the vortex-screen interaction by changing the local liquid viscosity and density. In the present investigation, a mechanical piston-cylinder vortex ring generator was used to create vortex rings in an aqueous sucrose solution. The rings impinged on a screen of horizontal wires that were heated using electrical current. The flow was visualized with food color and video imaging. Tests with and without heat were conducted at a piston stroke-to-jet diameter ratio of 4 and a jet Reynolds number (Re) of 1000. The vortex rings slowed after passing through the screen, but in tests with heat, they maintained a higher fraction of their before-screen velocity due to reduction in fluid viscosity near the wires. In addition, small ``fingers'' that developed on the front of the vortex rings as they passed through the screen exhibited positive buoyancy effects in the heated case.
International Nuclear Information System (INIS)
Novikov, N.V.; Teplova, Ya.A.
2011-01-01
It is shown that the Coulomb interaction of ions in the final state must be taken into account in the estimation of the cross section of electron capture by fast ions. The cross section of electron capture decreases considerably, and the dependence of the cross section on the collision energy becomes close to the experimental one if the interaction of charged particles after collision is taken into account. -- Highlights: → Coulomb interaction of ions in the final state must be taken into account. → This interaction leads to a considerable decrease in the cross section. → The dependence on energy close to the experimental one.
Zhang, Chao; Yao, Hui; Nie, Yi-Hang; Liang, Jiu-Qing; Niu, Peng-Bin
2018-04-01
In this work, we study the generation of spin-current in a single-molecule magnet (SMM) tunnel junction with Coulomb interaction of transport electrons and external magnetic field. In the absence of field the spin-up and -down currents are symmetric with respect to the initial polarizations of molecule. The existence of magnetic field breaks the time-reversal symmetry, which leads to unsymmetrical spin currents of parallel and antiparallel polarizations. Both the amplitude and polarization direction of spin current can be controlled by the applied magnetic field. Particularly when the magnetic field increases to a certain value the spin-current with antiparallel polarization is reversed along with the magnetization reversal of the SMM. The two-electron occupation indeed enhances the transport current compared with the single-electron process. However the increase of Coulomb interaction results in the suppression of spin-current amplitude at the electron-hole symmetry point. We propose a scheme to compensate the suppression with the magnetic field.
Interactive Screen Experiments with Single Photons
Bronner, Patrick; Strunz, Andreas; Silberhorn, Christine; Meyn, Jan-Peter
2009-01-01
Single photons are used for fundamental quantum physics experiments as well as for applications. Originally being a topic of advance courses, such experiments are increasingly a subject of undergraduate courses. We provide interactive screen experiments (ISE) for supporting the work in a real laboratory, and for students who do not have access to…
Harb, Moussab
2014-09-11
Relevant properties to visible-light overall water splitting reactions of perfect and self-defective bulk Ta3N5 semiconductor photocatalysts are investigated using accurate first-principles quantum calculations on the basis of density functional theory (DFT, including the perturbation theory DFPT) within the screened coulomb hybrid (HSE06) exchange-correlation formalism. Among the various explored self-defective structures, a strong stabilization is obtained for the configuration displaying a direct interaction between the created N- and Ta-vacancies. In the lowest-energy structure, each of the three created Ta-vacancies and the five created N-vacancies is found to be in aggregated disposition, leading to the formation of cages into the lattice. Although the calculated structural, electronic, and optical properties of the two materials are found to be very similar and in good agreement with available experimental works, their photocatalytic features for visible-light overall water splitting reactions show completely different behaviors. On the basis of calculated band edge positions relative to water redox potentials, the perfect Ta3N5 (calculated band gap of 2.2 eV) is predicted by HSE06 to be a good candidate only for H+ reduction while the self-defective Ta3N5 (calculated band gap of 2.0 eV) reveals suitable band positions for both water oxidation and H+ reduction similar to the experimental data reported on Ta3N5 powders. Its ability to reduce H+ is predicted to be lower than the perfect one. However, the strongly localized electronic characters of the valence band (VB) and conduction band (CB) edge states of the self-defective material only on the N 2p and Ta 5d orbitals surrounding the aggregated N- and Ta-vacancies are expected to strongly limit the probability of photogenerated carrier mobility through its crystal structure.
International Nuclear Information System (INIS)
Xiong, Lun; Yi, Lin
2014-01-01
Thermoelectric effects, including Seebeck coefficient (S), thermal conductance (κ), and figure of merit (ZT), in a laterally coupled double-quantum-dot (DQD) chain with two external nonmagnetic contacts are investigated theoretically by the nonequilibrium Green's function formalism. In this system, the DQD chain between two contacts forms a main channel for thermal electrons transporting, and each QD in the main chain couples laterally to a dangling one. The numerical calculations show that the Coulomb interactions not only lead to the splitting of the asymmetrical double-peak structure of the Seebeck coefficient, but also make the thermal spectrum show a strong violation of the Wiedemann–Franz law, leading to a colossal enhancement in ZT. These results indicate that the coupled DQD chain has potential applications in the thermoelectric devices with high thermal efficiency.
Relativistic quantum dynamics of scalar bosons under a full vector Coulomb interaction
Energy Technology Data Exchange (ETDEWEB)
Castro, Luis B. [Universidade Federal do Maranhao (UFMA), Departamento de Fisica, Sao Luis, MA (Brazil); Oliveira, Luiz P. de [Universidade de Sao Paulo (USP), Instituto de Fisica, Sao Paulo, SP (Brazil); Garcia, Marcelo G. [Instituto Tecnologico de Aeronautica (ITA), Departamento de Fisica, Sao Jose dos Campos, SP (Brazil); Universidade Estadual de Campinas (UNICAMP), IMECC, Departamento de Matematica Aplicada, Campinas, SP (Brazil); Castro, Antonio S. de [Universidade Estadual Paulista (UNESP), Departamento de Fisica e Quimica, Guaratingueta, SP (Brazil)
2017-05-15
The relativistic quantum dynamics of scalar bosons in the background of a full vector coupling (minimal plus nonminimal vector couplings) is explored in the context of the Duffin-Kemmer-Petiau formalism. The Coulomb phase shift is determined for a general mixing of couplings and it is shown that the space component of the nonminimal coupling is a sine qua non condition for the exact closed-form scattering amplitude. It follows that the Rutherford cross section vanishes in the absence of the time component of the minimal coupling. Bound-state solutions obtained from the poles of the partial scattering amplitude show that the time component of the minimal coupling plays an essential role. The bound-state solutions depend on the nonminimal coupling and the spectrum consists of particles or antiparticles depending on the sign of the time component of the minimal coupling without chance for pair production even in the presence of strong couplings. It is also shown that an accidental degeneracy appears for a particular mixing of couplings. (orig.)
Eleftheriou, E.; Karatasos, K.
2012-10-01
Models of mixtures of peripherally charged dendrimers with oppositely charged linear polyelectrolytes in the presence of explicit solvent are studied by means of molecular dynamics simulations. Under the influence of varying strength of electrostatic interactions, these systems appear to form dynamically arrested film-like interconnected structures in the polymer-rich phase. Acting like a pseudo-thermodynamic inverse temperature, the increase of the strength of the Coulombic interactions drive the polymeric constituents of the mixture to a gradual dynamic freezing-in. The timescale of the average density fluctuations of the formed complexes initially increases in the weak electrostatic regime reaching a finite limit as the strength of electrostatic interactions grow. Although the models are overall electrically neutral, during this process the dendrimer/linear complexes develop a polar character with an excess charge mainly close to the periphery of the dendrimers. The morphological characteristics of the resulted pattern are found to depend on the size of the polymer chains on account of the distinct conformational features assumed by the complexed linear polyelectrolytes of different length. In addition, the length of the polymer chain appears to affect the dynamics of the counterions, thus affecting the ionic transport properties of the system. It appears, therefore, that the strength of electrostatic interactions together with the length of the linear polyelectrolytes are parameters to which these systems are particularly responsive, offering thus the possibility for a better control of the resulted structure and the electric properties of these soft-colloidal systems.
Scaled effective on-site Coulomb interaction in the DFT+U method for correlated materials
Nawa, Kenji; Akiyama, Toru; Ito, Tomonori; Nakamura, Kohji; Oguchi, Tamio; Weinert, M.
2018-01-01
The first-principles calculation of correlated materials within density functional theory remains challenging, but the inclusion of a Hubbard-type effective on-site Coulomb term (Ueff) often provides a computationally tractable and physically reasonable approach. However, the reported values of Ueff vary widely, even for the same ionic state and the same material. Since the final physical results can depend critically on the choice of parameter and the computational details, there is a need to have a consistent procedure to choose an appropriate one. We revisit this issue from constraint density functional theory, using the full-potential linearized augmented plane wave method. The calculated Ueff parameters for the prototypical transition-metal monoxides—MnO, FeO, CoO, and NiO—are found to depend significantly on the muffin-tin radius RMT, with variations of more than 2-3 eV as RMT changes from 2.0 to 2.7 aB. Despite this large variation in Ueff, the calculated valence bands differ only slightly. Moreover, we find an approximately linear relationship between Ueff(RMT) and the number of occupied localized electrons within the sphere, and give a simple scaling argument for Ueff; these results provide a rationalization for the large variation in reported values. Although our results imply that Ueff values are not directly transferable among different calculation methods (or even the same one with different input parameters such as RMT), use of this scaling relationship should help simplify the choice of Ueff.
Fay, Temple H.
2012-01-01
Viscous damping is commonly discussed in beginning differential equations and physics texts but dry friction or Coulomb friction is not despite dry friction being encountered in many physical applications. One reason for avoiding this topic is that the equations involve a jump discontinuity in the damping term. In this article, we adopt an energy…
Directory of Open Access Journals (Sweden)
Xuan-Ting Ji
2017-10-01
Full Text Available Recent experiments on Weyl semimetals reveal that charged impurities may play an important role. We use a screened Coulomb disorder to model the charged impurities, and study the magneto-transport in a two-node Weyl semimetal. It is found that when the external magnetic field is applied parallel to the electric field, the calculated longitudinal magnetoconductivity shows positive in the magnetic field, which is just the negative longitudinal magnetoresistivity (LMR observed in experiments. When the two fields are perpendicular to each other, the transverse magnetoconductivities are measured. It is found that the longitudinal (transverse magnetoconductivity is suppressed (enhanced sensitively with increasing the screening length. This feature makes it hardly to observe the negative LMR in Weyl semimetals experimentally owing to a small screening length. Our findings gain insight into further understanding on recently actively debated magneto-transport behaviors in Weyl semimetals. Furthermore we studied the relative weight of the inter-valley scattering and the intra-valley scattering. It shows that the former is as important as the latter and even dominates in the case of strong magnetic fields and small screening length. We emphasize that the discussions on inter-valley scattering is out of the realm of one-node model which has been studied.
Zhang, Yachao; Yang, Yang; Jiang, Hong
2013-12-12
The 3d-4f exchange interaction plays an important role in many lanthanide based molecular magnetic materials such as single-molecule magnets and magnetic refrigerants. In this work, we study the 3d-4f magnetic exchange interactions in a series of Cu(II)-Gd(III) (3d(9)-4f(7)) dinuclear complexes based on the numerical atomic basis-norm-conserving pseudopotential method and density functional theory plus the Hubbard U correction approach (DFT+U). We obtain improved description of the 4f electrons by including the semicore 5s5p states in the valence part of the Gd-pseudopotential. The Hubbard U correction is employed to treat the strongly correlated Cu-3d and Gd-4f electrons, which significantly improve the agreement of the predicted exchange constants, J, with experiment, indicating the importance of accurate description of the local Coulomb correlation. The high efficiency of the DFT+U approach enables us to perform calculations with molecular crystals, which in general improve the agreement between theory and experiment, achieving a mean absolute error smaller than 2 cm(-1). In addition, through analyzing the physical effects of U, we identify two magnetic exchange pathways. One is ferromagnetic and involves an interaction between the Cu-3d, O-2p (bridge ligand), and the majority-spin Gd-5d orbitals. The other one is antiferromagnetic and involves Cu-3d, O-2p, and the empty minority-spin Gd-4f orbitals, which is suppressed by the planar Cu-O-O-Gd structure. This study demonstrates the accuracy of the DFT+U method for evaluating the 3d-4f exchange interactions, provides a better understanding of the exchange mechanism in the Cu(II)-Gd(III) complexes, and paves the way for exploiting the magnetic properties of the 3d-4f compounds containing lanthanides other than Gd.
Interaction of a neutral composite particle with a strong Coulomb field
International Nuclear Information System (INIS)
Wong, Cheuk-Yin.
1988-01-01
The author discusses the interaction of the quasi-composite (e/sup /plus//e/sup /minus//) system with an external electromagnetic field. This problem addresses the question of the origin of strong positron lines in quasi-elastic heavy-ion reactions. 3 refs
Lee, Hyun-Jung; Kim, Ki-Seok
2018-04-01
We investigate the role of Coulomb interaction in the multifractality of Anderson metal-insulator transition, where the Coulomb interaction is treated within the Hartree-Fock approximation, but disorder effects are taken into account exactly. An innovative technical aspect in our simulation is to utilize the Ewald-sum technique, which allows us to introduce the long-range nature of the Coulomb interaction into Hartree-Fock self-consistent equations of order parameters more accurately. This numerical simulation reproduces the Altshuler-Aronov correction in a metallic state and the Efros-Shklovskii pseudogap in an insulating phase, where the density of states ρ (ω ) is evaluated in three dimensions. Approaching the quantum critical point of a metal-insulator transition from either the metallic or insulting phase, we find that the density of states is given by ρ (ω ) ˜|ω| 1 /2 , which determines one critical exponent of the McMillan-Shklovskii scaling theory. Our main result is to evaluate the eigenfunction multifractal scaling exponent αq, given by the Legendre transformation of the fractal dimension τq, which characterizes the scaling behavior of the inverse participation ratio with respect to the system size L . Our multifractal analysis leads us to identify two kinds of mobility edges, one of which occurs near the Fermi energy and the other of which appears at a high energy, where the density of states at the Fermi energy shows the Coulomb-gap feature. We observe that the multifractal exponent at the high-energy mobility edge remains to be almost identical to that of the Anderson localization transition in the absence of Coulomb interactions. On the other hand, we find that the multifractal exponent near the Fermi energy is more enhanced than that at the high-energy mobility edge, suspected to result from interaction effects. However, both the multifractal exponents do not change even if the strength of the Coulomb interaction varies. We also show that the
Energy Technology Data Exchange (ETDEWEB)
Xue Haibin, E-mail: xhb98326110@163.co [Institute of Theoretical Physics, Shanxi University, Taiyuan, Shanxi 030006 (China); Nie, Y.-H., E-mail: nieyh@sxu.edu.c [Institute of Theoretical Physics, Shanxi University, Taiyuan, Shanxi 030006 (China); Li, Z.-J.; Liang, J.-Q. [Institute of Theoretical Physics, Shanxi University, Taiyuan, Shanxi 030006 (China)
2011-01-17
We study the full counting statistics (FCS) in a single-molecule magnet (SMM) with finite Coulomb interaction U. For finite U the FCS, differing from U{yields}{infinity}, shows a symmetric gate-voltage-dependence when the coupling strengths with two electrodes are interchanged, which can be observed experimentally just by reversing the bias-voltage. Moreover, we find that the effect of finite U on shot noise depends on the internal level structure of the SMM and the coupling asymmetry of the SMM with two electrodes as well. When the coupling of the SMM with the incident-electrode is stronger than that with the outgoing-electrode, the super-Poissonian shot noise in the sequential tunneling regime appears under relatively small gate-voltage and relatively large finite U, and dose not for U{yields}{infinity}; while it occurs at relatively large gate-voltage for the opposite coupling case. The formation mechanism of super-Poissonian shot noise can be qualitatively attributed to the competition between fast and slow transport channels.
International Nuclear Information System (INIS)
Xue Haibin; Nie, Y.-H.; Li, Z.-J.; Liang, J.-Q.
2011-01-01
We study the full counting statistics (FCS) in a single-molecule magnet (SMM) with finite Coulomb interaction U. For finite U the FCS, differing from U→∞, shows a symmetric gate-voltage-dependence when the coupling strengths with two electrodes are interchanged, which can be observed experimentally just by reversing the bias-voltage. Moreover, we find that the effect of finite U on shot noise depends on the internal level structure of the SMM and the coupling asymmetry of the SMM with two electrodes as well. When the coupling of the SMM with the incident-electrode is stronger than that with the outgoing-electrode, the super-Poissonian shot noise in the sequential tunneling regime appears under relatively small gate-voltage and relatively large finite U, and dose not for U→∞; while it occurs at relatively large gate-voltage for the opposite coupling case. The formation mechanism of super-Poissonian shot noise can be qualitatively attributed to the competition between fast and slow transport channels.
DEFF Research Database (Denmark)
Muniruzzaman, Muhammad; Rolle, Massimo
Electrochemical cross-coupling plays a significant role for transport of charged species in porous media [1, 2]. In this study we performed flow-through experiments in a quasi two-dimensional setup using dilute solutions of strong electrolytes to study the influence of charge interactions on mass...... occurred. To quantitatively interpret the outcomes of our laboratory experiments in the spatially variable flow fields we developed a two dimensional numerical model based on a multicomponent formulation, on charge conservation and on the accurate description of transverse dispersion. The results...... of the multicomponent transport simulations were compared with the high-resolution (5 mm spacing) concentration measurements of the ionic species at the outlet of the flow-through domain. The excellent agreement between the measured concentrations and the results of purely forward numerical simulations demonstrates...
Dirac Hamiltonian and Reissner-Nordström metric: Coulomb interaction in curved space-time
Noble, J. H.; Jentschura, U. D.
2016-03-01
We investigate the spin-1 /2 relativistic quantum dynamics in the curved space-time generated by a central massive charged object (black hole). This necessitates a study of the coupling of a Dirac particle to the Reissner-Nordström space-time geometry and the simultaneous covariant coupling to the central electrostatic field. The relativistic Dirac Hamiltonian for the Reissner-Nordström geometry is derived. A Foldy-Wouthuysen transformation reveals the presence of gravitational and electrogravitational spin-orbit coupling terms which generalize the Fokker precession terms found for the Dirac-Schwarzschild Hamiltonian, and other electrogravitational correction terms to the potential proportional to αnG , where α is the fine-structure constant and G is the gravitational coupling constant. The particle-antiparticle symmetry found for the Dirac-Schwarzschild geometry (and for other geometries which do not include electromagnetic interactions) is shown to be explicitly broken due to the electrostatic coupling. The resulting spectrum of radially symmetric, electrostatically bound systems (with gravitational corrections) is evaluated for example cases.
Coulomb interaction of acceptors in Cd{sub 1−x}Mn{sub x}Te/CdTe quantum dot
Energy Technology Data Exchange (ETDEWEB)
Kalpana, P.; Nithiananthi, P., E-mail: kjkumar-gri@rediffmail.com; Jayakumar, K., E-mail: kjkumar-gri@rediffmail.com [Department of Physics, Gandhigram Rural University, Gandhigram-624302, TamilNadu (India); Reuben, A. Merwyn Jasper D. [Department of Physics, School of Engineering, Saveetha University, Thandalam, Chennai- 600104, TamilNadu (India)
2014-04-24
The investigation on the effect of confining potential like isotropic harmonic oscillator type potential on the binding and the Coulomb interaction energy of the double acceptors in the presence of magnetic field in a Cd{sub 1−x}Mn{sub x}Te/CdTe Spherical Quantum Dot has been made for the Mn ion composition x=0.3 and compared with the results obtained from the square well type potential using variational procedure in the effective mass approximation.
Directory of Open Access Journals (Sweden)
Suguru Murata
2016-05-01
Full Text Available To investigate the π-extension effect on an unusual negative-charged spin crossover (SCO FeIII complex with a weak N2O4 first coordination sphere, we designed and synthesized a series of anionic FeIII complexes from a π-extended naphthalene derivative ligand. Acetonitrile-solvate tetramethylammonium (TMA salt 1 exhibited an SCO conversion, while acetone-solvate TMA salt 2 was in a high-spin state. The crystal structural analysis for 2 revealed that two-leg ladder-like cation-anion arrays derived from π-stacking interactions between π-ligands of the FeIII complex anion and Coulomb interactions were found and the solvated acetone molecules were in one-dimensional channels between the cation-anion arrays. A desolvation-induced single-crystal-to-single-crystal transformation to desolvate compound 2’ may be driven by Coulomb energy gain. Furthermore, the structural comparison between quasi-polymorphic compounds 1 and 2 revealed that the synergy between Coulomb and π-stacking interactions induces a significant distortion of coordination structure of 2.
Wedmore, L. N. J.; Faure Walker, J. P.; Roberts, G. P.; Sammonds, P. R.; McCaffrey, K. J. W.; Cowie, P. A.
2017-07-01
Current studies of fault interaction lack sufficiently long earthquake records and measurements of fault slip rates over multiple seismic cycles to fully investigate the effects of interseismic loading and coseismic stress changes on the surrounding fault network. We model elastic interactions between 97 faults from 30 earthquakes since 1349 A.D. in central Italy to investigate the relative importance of co-seismic stress changes versus interseismic stress accumulation for earthquake occurrence and fault interaction. This region has an exceptionally long, 667 year record of historical earthquakes and detailed constraints on the locations and slip rates of its active normal faults. Of 21 earthquakes since 1654, 20 events occurred on faults where combined coseismic and interseismic loading stresses were positive even though 20% of all faults are in "stress shadows" at any one time. Furthermore, the Coulomb stress on the faults that experience earthquakes is statistically different from a random sequence of earthquakes in the region. We show how coseismic Coulomb stress changes can alter earthquake interevent times by 103 years, and fault length controls the intensity of this effect. Static Coulomb stress changes cause greater interevent perturbations on shorter faults in areas characterized by lower strain (or slip) rates. The exceptional duration and number of earthquakes we model enable us to demonstrate the importance of combining long earthquake records with detailed knowledge of fault geometries, slip rates, and kinematics to understand the impact of stress changes in complex networks of active faults.
Intershell resistance in multiwall carbon nanotubes: A Coulomb drag study
DEFF Research Database (Denmark)
Lunde, Anders Mathias; Flensborg, Karsten; Jauho, Antti-Pekka
2005-01-01
We calculate the intershell resistance R-21 in a multiwall carbon nanotube as a function of temperature T and Fermi level epsilon(F) (e.g., a gate voltage), varying the chirality of the inner and outer tubes. This is done in a so-called Coulomb drag setup, where a current I-1 in one shell induces...... a voltage drop V-2 in another shell by the screened Coulomb interaction between the shells neglecting the intershell tunneling. We provide benchmark results for R-21 = V2/I-1 within the Fermi liquid theory using Boltzmann equations. The band structure gives rise to strongly chirality-dependent suppression...... effects for the Coulomb drag between different tubes due to selection rules combined with mismatching of wave vector and crystal angular momentum conservation near the Fermi level. This gives rise to orders of magnitude changes in R-21 and even the sign of R-21 can change depending on the chirality...
Rollins, John C.; Stein, Ross S.
2010-01-01
The Gorda deformation zone, a 50,000 km2 area of diffuse shear and rotation offshore northernmost California, has been the site of 20 M ≥ 5.9 earthquakes on four different fault orientations since 1976, including four M ≥ 7 shocks. This is the highest rate of large earthquakes in the contiguous United States. We calculate that the source faults of six recent M ≥ 5.9 earthquakes had experienced ≥0.6 bar Coulomb stress increases imparted by earthquakes that struck less than 9 months beforehand. Control tests indicate that ≥0.6 bar Coulomb stress interactions between M ≥ 5.9 earthquakes separated by Mw = 7.3 Trinidad earthquake are consistent with the locations of M ≥ 5.9 earthquakes in the Gorda zone until at least 1995, as well as earthquakes on the Mendocino Fault Zone in 1994 and 2000. Coulomb stress changes imparted by the 1980 earthquake are also consistent with its distinct elbow-shaped aftershock pattern. From these observations, we derive generalized static stress interactions among right-lateral, left-lateral and thrust faults near triple junctions.
International Nuclear Information System (INIS)
Tokmehdashi, Hadi; Rajabi, Ali Akbar; Hamzavi, Majid
2014-01-01
The bound-state solutions of the Dirac equation for the Manning-Rosen potential are presented approximately for arbitrary spin-orbit quantum number κ with the Hulthén and Coulomb-like potentials as a tensor interaction. The generalized parametric Nikiforov-Uvarov (NU) method is used to obtain energy eigenvalues and corresponding two-component spinors of the two Dirac particles and these are obtained in the closed form by using the framework of the spin symmetry and p-spin symmetry concept. We have also shown that tensor interaction removes degeneracies between spin and p-spin doublets. Some numerical results are also given
Terai, Yuma; Sato, Ryuma; Yumiba, Takahiro; Harada, Ryuhei; Shimizu, Kohei; Toga, Tatsuya; Ishikawa-Fujiwara, Tomoko; Todo, Takeshi; Iwai, Shigenori; Shigeta, Yasuteru; Yamamoto, Junpei
2018-05-14
(6-4) Photolyases ((6-4)PLs) are flavoenzymes that repair the carcinogenic UV-induced DNA damage, pyrimidine(6-4)pyrimidone photoproducts ((6-4)PPs), in a light-dependent manner. Although the reaction mechanism of DNA photorepair by (6-4)PLs has been intensively investigated, the molecular mechanism of the lesion recognition remains obscure. We show that a well-conserved arginine residue in Xenopus laevis (6-4)PL (Xl64) participates in DNA binding, through Coulomb and CH-π interactions. Fragment molecular orbital calculations estimated attractive interaction energies of -80-100 kcal mol-1 for the Coulomb interaction and -6 kcal mol-1 for the CH-π interaction, and the loss of either of them significantly reduced the affinity for (6-4)PP-containing oligonucleotides, as well as the quantum yield of DNA photorepair. From experimental and theoretical observations, we formulated a DNA binding model of (6-4)PLs. Based on the binding model, we mutated this Arg in Xl64 to His, which is well conserved among the animal cryptochromes (CRYs), and found that the CRY-type mutant exhibited reduced affinity for the (6-4)PP-containing oligonucleotides, implying the possible molecular origin of the functional diversity of the photolyase/cryptochrome superfamily.
International Nuclear Information System (INIS)
Federighi, T.
1978-01-01
By supposing that virtual photons are ''bound'' photons continuosly emitted and reabsorbed by any electron, the existence of the Coulomb's law between charges is deduced in a quasiclassical way. There are both a lower limit for the law ( approximately 10 -13 cm) originated by the cutting-off of the Bose-Einstein statistics and an upper limit ( approximately 10 17 cm) connected with the existence of a not null rest mass of the photon ( approximately 5.7.10 -56 g)
Ongonwou, F.; Tetchou Nganso, H. M.; Ekogo, T. B.; Kwato Njock, M. G.
2016-12-01
In this study we present a model that we have formulated in the momentum space to describe atoms interacting with intense laser fields. As a further step, it follows our recent theoretical approach in which the kernel of the reciprocal-space time-dependent Schrödinger equation (TDSE) is replaced by a finite sum of separable potentials, each of them supporting one bound state of atomic hydrogen (Tetchou Nganso et al. 2013). The key point of the model is that the nonlocal interacting Coulomb potential is expanded in a Coulomb Sturmian basis set derived itself from a Sturmian representation of Bessel functions of the first kind in the position space. As a result, this decomposition allows a simple spectral treatment of the TDSE in the momentum space. In order to illustrate the credibility of the model, we have considered the test case of atomic hydrogen driven by a linearly polarized laser pulse, and have evaluated analytically matrix elements of the atomic Hamiltonian and dipole coupling interaction. For various regimes of the laser parameters used in computations our results are in very good agreement with data obtained from other time-dependent calculations.
Energy Technology Data Exchange (ETDEWEB)
Ongonwou, F., E-mail: fred.ongonwou@gmail.com [Département de Physique, Faculté des Sciences, Université des Sciences et Techniques de Masuku, B.P. 943 Franceville (Gabon); Tetchou Nganso, H.M., E-mail: htetchou@yahoo.com [Atoms and Molecules Laboratory, Centre for Atomic Molecular Physics and Quantum Optics (CEPAMOQ), Faculty of Science, University of Douala, P.O. Box 8580, Douala (Cameroon); Ekogo, T.B., E-mail: tekogo@yahoo.fr [Département de Physique, Faculté des Sciences, Université des Sciences et Techniques de Masuku, B.P. 943 Franceville (Gabon); Kwato Njock, M.G., E-mail: mkwato@yahoo.com [Atoms and Molecules Laboratory, Centre for Atomic Molecular Physics and Quantum Optics (CEPAMOQ), Faculty of Science, University of Douala, P.O. Box 8580, Douala (Cameroon)
2016-12-15
In this study we present a model that we have formulated in the momentum space to describe atoms interacting with intense laser fields. As a further step, it follows our recent theoretical approach in which the kernel of the reciprocal-space time-dependent Schrödinger equation (TDSE) is replaced by a finite sum of separable potentials, each of them supporting one bound state of atomic hydrogen (Tetchou Nganso et al. 2013). The key point of the model is that the nonlocal interacting Coulomb potential is expanded in a Coulomb Sturmian basis set derived itself from a Sturmian representation of Bessel functions of the first kind in the position space. As a result, this decomposition allows a simple spectral treatment of the TDSE in the momentum space. In order to illustrate the credibility of the model, we have considered the test case of atomic hydrogen driven by a linearly polarized laser pulse, and have evaluated analytically matrix elements of the atomic Hamiltonian and dipole coupling interaction. For various regimes of the laser parameters used in computations our results are in very good agreement with data obtained from other time-dependent calculations.
Understanding and Creating Accessible Touch Screen Interactions for Blind People
Kane, Shaun K.
2011-01-01
Using touch screens presents a number of usability and accessibility challenges for blind people. Most touch screen-based user interfaces are optimized for visual interaction, and are therefore difficult or impossible to use without vision. This dissertation presents an approach to redesigning gesture-based user interfaces to enable blind people…
International Nuclear Information System (INIS)
Brown, Helen; Ross, D. Keith; Paradies, Henrich H.
2004-01-01
Light-, small-angle X-ray and neutron scattering measurements of the dynamic structure factor S(Q,t) of strong interacting dispersions of lipid A-diphosphate were recorded and analysed applying existing models of liquid state theory. Lipid A-diphosphate ordering was observed at low volume fractions (phi=2.2x10 -4 ) and at very low ionic strength (I=10 -5 M). Upon increasing the particle number density of lipid A-diphosphate a transformation of the lattices of the colloidal crystals from a BCC lattice (a=36.20 nm) to a FCC lattice (a=57.30 nm) occurred. This strongly suggests a similarity in the preformed liquid structure and the cubic colloidal phase. The fit of both S eff (Q) and the principle peak I p (Q) with the effective particle charge supports of the main conclusions drawn from the SANS experiments and the liquid state theory indicating the presence of long-range order for the dispersions of lipid A-diphosphate
Harb, Moussab
2013-12-05
We report a systematic study on the optoelectronic properties of Se-modified anatase TiO2 investigated by DFT (including the perturbation theory approach DFPT) within the screened coulomb hybrid HSE06 formalism to guarantee accurate band gap and electronic excitation predictions. Various selenium species at substitutional sites for O or Ti, at interstitial sites, as well as at mixed substitutional/interstitial sites are studied. Among the explored structures, Ti(1-2x)O2Se2x (containing Se4+ species), TiO(2-x)Sex (containing Se2- species), and TiO(2-x)Se2x (containing Se2 2- species) reveal significant enhanced visible-light optical absorption spectra with new absorption features appearing at 500, 600, and 690 nm, respectively. Our calculated spectra are found to be in good agreement with those obtained in available experimental works. The band gap narrowing in these materials originates from incorporation of newly occupied electronic levels within 0.5-1.5 eV above the original valence band of TiO 2, leading to new narrowed band gaps of 2.5, 2.0, and 1.8 eV respectively. Our calculations also reveal suitable band positions of Ti (1-2x)O2Se2x and TiO(2-x)Se x for overall water splitting, whereas TiO(2-x)Se 2x shows an unsuitable valence band position for the oxygen evolution reaction. In contrast, the localized electronic character of the new occupied states on the Se 4p orbitals and only on the O 2p orbitals linked to the Se species makes the holes mobility limited in this material and the recombination rate of charge carriers greatly increased in the bulk. © 2013 American Chemical Society.
CRISPR genetic screens to discover host-virus interactions.
McDougall, William M; Perreira, Jill M; Reynolds, Erin C; Brass, Abraham L
2018-04-01
Viruses impose an immense burden on human health. With the goal of treating and preventing viral infections, researchers have carried out genetic screens to improve our understanding of viral dependencies and identify potential anti-viral strategies. The emergence of CRISPR genetic screening tools has facilitated this effort by enabling host-virus screens to be undertaken in a more versatile and fidelitous manner than previously possible. Here we review the growing number of CRISPR screens which continue to increase our understanding of host-virus interactions. Copyright © 2018 Elsevier B.V. All rights reserved.
Coulomb potentials between spherical heavy ions
International Nuclear Information System (INIS)
Iwe, H.
1982-01-01
The Coulomb interaction between spherical nuclei having arbitrary radial nuclear charge distributions is calculated. All these realistic Coulomb potentials are given in terms of analytical expressions and are available for immediate application. So in no case a numerical computation of the Coulomb integral is required. The parameters of the charge distributions are taken from electron scattering analysis. The Coulomb self-energies of the charge distributions used are also calculated analytically in a closed form. For a number of nucleus-nucleus pairs, the Coulomb potentials derived from realistic charge distributions are compared with those normally used in various nucleus-nucleus optical model calculations. In this connection a detailed discussion of the problem how to choose consistently Coulomb parameters for different approximations is given. (orig.)
International Nuclear Information System (INIS)
Ikhdair, Sameer M.; Hamzavi, Majid
2013-01-01
Approximate analytical solutions of the Dirac equation for Tietz—Hua (TH) potential including Coulomb-like tensor (CLT) potential with arbitrary spin—orbit quantum number κ are obtained within the Pekeris approximation scheme to deal with the spin—orbit coupling terms κ(κ ± 1)r −2 . Under the exact spin and pseudospin symmetric limitation, bound state energy eigenvalues and associated unnormalized two-component wave functions of the Dirac particle in the field of both attractive and repulsive TH potential with tensor potential are found using the parametric Nikiforov—Uvarov (NU) method. The cases of the Morse oscillator with tensor potential, the generalized Morse oscillator with tensor potential, and the non-relativistic limits have been investigated. (general)
Seino, Junji; Nakai, Hiromi
2012-10-14
The local unitary transformation (LUT) scheme at the spin-free infinite-order Douglas-Kroll-Hess (IODKH) level [J. Seino and H. Nakai, J. Chem. Phys. 136, 244102 (2012)], which is based on the locality of relativistic effects, has been extended to a four-component Dirac-Coulomb Hamiltonian. In the previous study, the LUT scheme was applied only to a one-particle IODKH Hamiltonian with non-relativistic two-electron Coulomb interaction, termed IODKH/C. The current study extends the LUT scheme to a two-particle IODKH Hamiltonian as well as one-particle one, termed IODKH/IODKH, which has been a real bottleneck in numerical calculation. The LUT scheme with the IODKH/IODKH Hamiltonian was numerically assessed in the diatomic molecules HX and X(2) and hydrogen halide molecules, (HX)(n) (X = F, Cl, Br, and I). The total Hartree-Fock energies calculated by the LUT method agree well with conventional IODKH/IODKH results. The computational cost of the LUT method is reduced drastically compared with that of the conventional method. In addition, the LUT method achieves linear-scaling with respect to the system size and a small prefactor.
International Nuclear Information System (INIS)
Biagini, M.; Calandra, C.; Ossicini, S.
1995-01-01
Electronic structure calculations based on the local-spin-density approximation (LSDA) fail to reproduce the antiferromagnetic ground state of PrBa 2 Cu 3 O 7 (PBCO). We have performed linear muffin-tin orbital--atomic sphere approximation calculations, based on the local-spin-density approximation with on-site Coulomb correlation applied to Cu(1) and Cu(2) 3d states. We have found that inclusion of the on-site Coulomb interaction modifies qualitatively the electronic structure of PBCO with respect to the LSDA results, and gives Cu spin moments in good agreement with the experimental values. The Cu(2) upper Hubbard band lies about 1 eV above the Fermi energy, indicating a Cu II oxidation state. On the other hand, the Cu(1) upper Hubbard band is located across the Fermi level, which implies an intermediate oxidation state for the Cu(1) ion, between Cu I and Cu II . The metallic character of the CuO chains is preserved, in agreement with optical reflectivity [K. Takenaka et al., Phys. Rev. B 46, 5833 (1992)] and positron annihilation experiments [L. Hoffmann et al., Phys. Rev. Lett. 71, 4047 (1993)]. These results support the view of an extrinsic origin of the insulating character of PrBa 2 Cu 3 O 7
Mandal, Ipsita; Nandkishore, Rahul M.
2018-03-01
Coulomb interactions famously drive three-dimensional quadratic band crossing semimetals into a non-Fermi liquid phase of matter. In a previous work [Nandkishore and Parameswaran, Phys. Rev. B 95, 205106 (2017), 10.1103/PhysRevB.95.205106], the effect of disorder on this non-Fermi liquid phase was investigated, assuming that the band structure was isotropic, assuming that the conduction and valence bands had the same band mass, and assuming that the disorder preserved exact time-reversal symmetry and statistical isotropy. It was shown that the non-Fermi liquid fixed point is unstable to disorder and that a runaway flow to strong disorder occurs. In this paper, we extend that analysis by relaxing the assumption of time-reversal symmetry and allowing the electron and hole masses to differ (but continuing to assume isotropy of the low energy band structure). We first incorporate time-reversal symmetry breaking disorder and demonstrate that there do not appear any new fixed points. Moreover, while the system continues to flow to strong disorder, time-reversal-symmetry-breaking disorder grows asymptotically more slowly than time-reversal-symmetry-preserving disorder, which we therefore expect should dominate the strong-coupling phase. We then allow for unequal electron and hole masses. We show that whereas asymmetry in the two masses is irrelevant in the clean system, it is relevant in the presence of disorder, such that the `effective masses' of the conduction and valence bands should become sharply distinct in the low-energy limit. We calculate the RG flow equations for the disordered interacting system with unequal band masses and demonstrate that the problem exhibits a runaway flow to strong disorder. Along the runaway flow, time-reversal-symmetry-preserving disorder grows asymptotically more rapidly than both time-reversal-symmetry-breaking disorder and the Coulomb interaction.
Coulomb correction calculations of pp Bremsstrahlung
International Nuclear Information System (INIS)
Katsogiannis, A.; Amos, K.; Jetter, M.; von Geramb, H.V.
1994-01-01
The effects of the Coulomb interaction upon the photon cross section and analyzing power from pp Bremsstrahlung have been studied in detail. Off-shell properties of the Coulomb T matrices have been considered but the associated, Coulomb modified, hadronic T matrices are important elements in any analyses of low energy, forward proton scattering data. At the lowest energy considered (5 MeV), the full calculations gave cross sections that were half the size of those found without Coulomb effects or with a simple model approximation to them. With increasing energy, the cross sections varied to those characteristic of magnetic interaction dominance and the specific differences due to Coulomb effects diminished. 47 refs., 7 figs
Boschini, M.J.; Gervasi, M.; Giani, S.; Grandi, D.; Ivantchenko, V.; Pensotti, S.; Rancoita, P.G.; Tacconi, M.
2011-01-01
In the space environment, instruments onboard of spacecrafts can be affected by displacement damage due to radiation. The differential scattering cross section for screened nucleus--nucleus interactions - i.e., including the effects due to screened Coulomb nuclear fields -, nuclear stopping powers and non-ionization energy losses are treated from about 50\\,keV/nucleon up to relativistic energies.
Interactive screen experiments-innovative virtual laboratories for distance learners
International Nuclear Information System (INIS)
Hatherly, P A; Jordan, S E; Cayless, A
2009-01-01
The desirability and value of laboratory work for physics students is a well-established principle and issues arise where students are inherently remote from their host institution, as is the case for the UK's Open University. In this paper, we present developments from the Physics Innovations Centre for Excellence in Teaching and Learning (piCETL) in the production and technology of the virtual laboratory resources, interactive screen experiments, and the benefits and drawbacks of such resources. We also explore the motivations behind current implementation of interactive screen experiments and examine evaluation strategies and outcomes through a series of case studies
Rapacioli, Mathias; Spiegelman, Fernand; Talbi, Dahbia; Mineva, Tzonka; Goursot, Annick; Heine, Thomas; Seifert, Gotthard
2009-06-01
The density functional based tight binding (DFTB) is a semiempirical method derived from the density functional theory (DFT). It inherits therefore its problems in treating van der Waals clusters. A major error comes from dispersion forces, which are poorly described by commonly used DFT functionals, but which can be accounted for by an a posteriori treatment DFT-D. This correction is used for DFTB. The self-consistent charge (SCC) DFTB is built on Mulliken charges which are known to give a poor representation of Coulombic intermolecular potential. We propose to calculate this potential using the class IV/charge model 3 definition of atomic charges. The self-consistent calculation of these charges is introduced in the SCC procedure and corresponding nuclear forces are derived. Benzene dimer is then studied as a benchmark system with this corrected DFTB (c-DFTB-D) method, but also, for comparison, with the DFT-D. Both methods give similar results and are in agreement with references calculations (CCSD(T) and symmetry adapted perturbation theory) calculations. As a first application, pyrene dimer is studied with the c-DFTB-D and DFT-D methods. For coronene clusters, only the c-DFTB-D approach is used, which finds the sandwich configurations to be more stable than the T-shaped ones.
Screening for interaction effects in gene expression data.
Directory of Open Access Journals (Sweden)
Peter J Castaldi
Full Text Available Expression quantitative trait (eQTL studies are a powerful tool for identifying genetic variants that affect levels of messenger RNA. Since gene expression is controlled by a complex network of gene-regulating factors, one way to identify these factors is to search for interaction effects between genetic variants and mRNA levels of transcription factors (TFs and their respective target genes. However, identification of interaction effects in gene expression data pose a variety of methodological challenges, and it has become clear that such analyses should be conducted and interpreted with caution. Investigating the validity and interpretability of several interaction tests when screening for eQTL SNPs whose effect on the target gene expression is modified by the expression level of a transcription factor, we characterized two important methodological issues. First, we stress the scale-dependency of interaction effects and highlight that commonly applied transformation of gene expression data can induce or remove interactions, making interpretation of results more challenging. We then demonstrate that, in the setting of moderate to strong interaction effects on the order of what may be reasonably expected for eQTL studies, standard interaction screening can be biased due to heteroscedasticity induced by true interactions. Using simulation and real data analysis, we outline a set of reasonable minimum conditions and sample size requirements for reliable detection of variant-by-environment and variant-by-TF interactions using the heteroscedasticity consistent covariance-based approach.
Screening of cellular proteins that interact with the classical swine ...
Indian Academy of Sciences (India)
In the current study, aiming to find more clues in understanding the molecular mechanisms of CSFV NS5A's function, the yeast two-hybrid (Y2H) system was adopted to screen for CSFV NS5A interactive proteins in the cDNA library of the swine umbilical vein endothelial cell (SUVEC). Alignment with the NCBI database ...
Screening of cellular proteins that interact with the classical swine ...
Indian Academy of Sciences (India)
2014-01-27
Jan 27, 2014 ... to screen for CSFV NS5A interactive proteins in the cDNA library of the swine umbilical vein endothelial cell. (SUVEC). Alignment ... development. The finding of ..... were unknown, the results of the BLAST against the human.
Coulomb repulsion in short polypeptides.
Norouzy, Amir; Assaf, Khaleel I; Zhang, Shuai; Jacob, Maik H; Nau, Werner M
2015-01-08
Coulomb repulsion between like-charged side chains is presently viewed as a major force that impacts the biological activity of intrinsically disordered polypeptides (IDPs) by determining their spatial dimensions. We investigated short synthetic models of IDPs, purely composed of ionizable amino acid residues and therefore expected to display an extreme structural and dynamic response to pH variation. Two synergistic, custom-made, time-resolved fluorescence methods were applied in tandem to study the structure and dynamics of the acidic and basic hexapeptides Asp6, Glu6, Arg6, Lys6, and His6 between pH 1 and 12. (i) End-to-end distances were obtained from the short-distance Förster resonance energy transfer (sdFRET) from N-terminal 5-fluoro-l-tryptophan (FTrp) to C-terminal Dbo. (ii) End-to-end collision rates were obtained for the same peptides from the collision-induced fluorescence quenching (CIFQ) of Dbo by FTrp. Unexpectedly, the very high increase of charge density at elevated pH had no dynamical or conformational consequence in the anionic chains, neither in the absence nor in the presence of salt, in conflict with the common view and in partial conflict with accompanying molecular dynamics simulations. In contrast, the cationic peptides responded to ionization but with surprising patterns that mirrored the rich individual characteristics of each side chain type. The contrasting results had to be interpreted, by considering salt screening experiments, N-terminal acetylation, and simulations, in terms of an interplay of local dielectric constant and peptide-length dependent side chain charge-charge repulsion, side chain functional group solvation, N-terminal and side chain charge-charge repulsion, and side chain-side chain as well as side chain-backbone interactions. The common picture that emerged is that Coulomb repulsion between water-solvated side chains is efficiently quenched in short peptides as long as side chains are not in direct contact with each
Classical- and quantum mechanical Coulomb scattering
International Nuclear Information System (INIS)
Gratzl, W.
1987-01-01
Because in textbooks the quantum mechanical Coulomb scattering is either ignored or treated unsatisfactory, the present work attempts to present a physically plausible, mathematically correct but elementary treatment in a way that it can be used in textbooks and lectures on quantum mechanics. Coulomb scattering is derived as a limiting case of a screened Coulomb potential (finite range) within a time dependent quantum scattering theory. The difference in the asymptotic conditions for potentials of finite versus infinite range leads back to the classical Coulomb scattering. In the classical framework many concepts of the quantum theory can be introduced and are useful in an intuitive understanding of the quantum theory. The differences between classical and quantum scattering theory are likewise useful for didactic purposes. (qui)
Selfconsistent theory of Coulomb mixing in nuclei
International Nuclear Information System (INIS)
Pyatov, N.I.
1978-01-01
The theory of isobaric states is considered according to the Coulomb mixing in nuclei. For a given form of the isovestor potential the separable residual interactions are constructed by means of the isotopic invariance principle. The strength parameter of the force is found from a selfconsistency condition. The charge dependent force is represented by the Coulomb effective potential. The theory of the isobaric states is developed using the random phase approximation. The Coulomb mixing effects in the ground and isobaric 0 + states of even-mass nuclei are investigated
Fermi-edge transmission resonance in graphene driven by a single Coulomb impurity.
Karnatak, Paritosh; Goswami, Srijit; Kochat, Vidya; Pal, Atindra Nath; Ghosh, Arindam
2014-07-11
The interaction between the Fermi sea of conduction electrons and a nonadiabatic attractive impurity potential can lead to a power-law divergence in the tunneling probability of charge through the impurity. The resulting effect, known as the Fermi edge singularity (FES), constitutes one of the most fundamental many-body phenomena in quantum solid state physics. Here we report the first observation of FES for Dirac fermions in graphene driven by isolated Coulomb impurities in the conduction channel. In high-mobility graphene devices on hexagonal boron nitride substrates, the FES manifests in abrupt changes in conductance with a large magnitude ≈e(2)/h at resonance, indicating total many-body screening of a local Coulomb impurity with fluctuating charge occupancy. Furthermore, we exploit the extreme sensitivity of graphene to individual Coulomb impurities and demonstrate a new defect-spectroscopy tool to investigate strongly correlated phases in graphene in the quantum Hall regime.
A Coulomb-Like Off-Shell T-Matrix with the Correct Coulomb Phase Shift
International Nuclear Information System (INIS)
Oryu, Shinsho; Watanabe, Takashi; Hiratsuka, Yasuhisa; Togawa, Yoshio
2017-01-01
We confirm the reliability of the well-known Coulomb renormalization method (CRM). It is found that the CRM is only available for a very-long-range screened Coulomb potential (SCP). However, such an SCP calculation in momentum space is considerably difficult because of the cancellation of significant digits. In contrast to the CRM, we propose a new method by using an on-shell equivalent SCP and the rest term. The two-potential theory with r-space is introduced, which defines fully the off-shell Coulomb amplitude. (author)
Coulomb gap triptych in a periodic array of metal nanocrystals.
Chen, Tianran; Skinner, Brian; Shklovskii, B I
2012-09-21
The Coulomb gap in the single-particle density of states (DOS) is a universal consequence of electron-electron interaction in disordered systems with localized electron states. Here we show that in arrays of monodisperse metallic nanocrystals, there is not one but three identical adjacent Coulomb gaps, which together form a structure that we call a "Coulomb gap triptych." We calculate the DOS and the conductivity in two- and three-dimensional arrays using a computer simulation. Unlike in the conventional Coulomb glass models, in nanocrystal arrays the DOS has a fixed width in the limit of large disorder. The Coulomb gap triptych can be studied via tunneling experiments.
Pooled-matrix protein interaction screens using Barcode Fusion Genetics.
Yachie, Nozomu; Petsalaki, Evangelia; Mellor, Joseph C; Weile, Jochen; Jacob, Yves; Verby, Marta; Ozturk, Sedide B; Li, Siyang; Cote, Atina G; Mosca, Roberto; Knapp, Jennifer J; Ko, Minjeong; Yu, Analyn; Gebbia, Marinella; Sahni, Nidhi; Yi, Song; Tyagi, Tanya; Sheykhkarimli, Dayag; Roth, Jonathan F; Wong, Cassandra; Musa, Louai; Snider, Jamie; Liu, Yi-Chun; Yu, Haiyuan; Braun, Pascal; Stagljar, Igor; Hao, Tong; Calderwood, Michael A; Pelletier, Laurence; Aloy, Patrick; Hill, David E; Vidal, Marc; Roth, Frederick P
2016-04-22
High-throughput binary protein interaction mapping is continuing to extend our understanding of cellular function and disease mechanisms. However, we remain one or two orders of magnitude away from a complete interaction map for humans and other major model organisms. Completion will require screening at substantially larger scales with many complementary assays, requiring further efficiency gains in proteome-scale interaction mapping. Here, we report Barcode Fusion Genetics-Yeast Two-Hybrid (BFG-Y2H), by which a full matrix of protein pairs can be screened in a single multiplexed strain pool. BFG-Y2H uses Cre recombination to fuse DNA barcodes from distinct plasmids, generating chimeric protein-pair barcodes that can be quantified via next-generation sequencing. We applied BFG-Y2H to four different matrices ranging in scale from ~25 K to 2.5 M protein pairs. The results show that BFG-Y2H increases the efficiency of protein matrix screening, with quality that is on par with state-of-the-art Y2H methods. © 2016 The Authors. Published under the terms of the CC BY 4.0 license.
Noll, Ellis; Koehlinger, Mervin; Kowalski, Ludwik; Swackhamer, Gregg
1998-01-01
Describes the use of a computer-linked camera to demonstrate Coulomb's law. Suggests a way of reducing the difficulties in presenting Coulomb's law by teaching the inverse square law of gravity and the inverse square law of electricity in the same unit. (AIM)
Coulomb-Driven Relativistic Electron Beam Compression
Lu, Chao; Jiang, Tao; Liu, Shengguang; Wang, Rui; Zhao, Lingrong; Zhu, Pengfei; Xiang, Dao; Zhang, Jie
2018-01-01
Coulomb interaction between charged particles is a well-known phenomenon in many areas of research. In general, the Coulomb repulsion force broadens the pulse width of an electron bunch and limits the temporal resolution of many scientific facilities such as ultrafast electron diffraction and x-ray free-electron lasers. Here we demonstrate a scheme that actually makes use of the Coulomb force to compress a relativistic electron beam. Furthermore, we show that the Coulomb-driven bunch compression process does not introduce additional timing jitter, which is in sharp contrast to the conventional radio-frequency buncher technique. Our work not only leads to enhanced temporal resolution in electron-beam-based ultrafast instruments that may provide new opportunities in probing material systems far from equilibrium, but also opens a promising direction for advanced beam manipulation through self-field interactions.
Coulomb effects in particle distributions inclusive
International Nuclear Information System (INIS)
Erazmus, B.; Martin, L.; Pluta, J.; Stavinky, A.
1997-01-01
Single pion distributions from central 158 A.GeV/c Pb + Pb collisions measured by the NA44 experiment show the effect of Coulomb interaction with the net charge produced during the reaction. Coulomb effects are analyzed with the help of the microscopic model RQMD and a model including the Coulomb interaction. Different sets of kinematical characteristics of the net charge have been used to reproduce the experimental data and a strong sensitivity to the charge value has been found. This study has evidenced the non-negligible influence of a Coulomb charge, present in the region of the central rapidity in heavy ion collisions on the inclusive distributions of the produced particles. A more thorough analysis of the data obtained from the experiment NA44 is now under way to take into account the hyperon decay that can modify the fraction of different particles, particularly at low transverse momenta
Coulomb-Driven Relativistic Electron Beam Compression.
Lu, Chao; Jiang, Tao; Liu, Shengguang; Wang, Rui; Zhao, Lingrong; Zhu, Pengfei; Xiang, Dao; Zhang, Jie
2018-01-26
Coulomb interaction between charged particles is a well-known phenomenon in many areas of research. In general, the Coulomb repulsion force broadens the pulse width of an electron bunch and limits the temporal resolution of many scientific facilities such as ultrafast electron diffraction and x-ray free-electron lasers. Here we demonstrate a scheme that actually makes use of the Coulomb force to compress a relativistic electron beam. Furthermore, we show that the Coulomb-driven bunch compression process does not introduce additional timing jitter, which is in sharp contrast to the conventional radio-frequency buncher technique. Our work not only leads to enhanced temporal resolution in electron-beam-based ultrafast instruments that may provide new opportunities in probing material systems far from equilibrium, but also opens a promising direction for advanced beam manipulation through self-field interactions.
Diffraction scattering of 7Be and 8B on 12C taking into account the coulomb interaction
International Nuclear Information System (INIS)
Davydovskyy, V.V.; Evlanov, M.V.; Tartakovsky, V.K.
2004-01-01
The differential cross sections for scattering of 7 Be and 8 B nuclei on 12 C nuclei are calculated in the framework of general theory of diffraction interactions of nuclei consisting of two charged weakly-bound clusters. Available experimental data are analyzed. (author)
Energy Technology Data Exchange (ETDEWEB)
Lantri, T. [Laboratory of Technology and Solid’s Properties, Faculty of Sciences and Technology, Abdelhamid Ibn Badis University, BP 227, Mostaganem 27000 (Algeria); Bentata, S., E-mail: sam_bentata@yahoo.com [Laboratory of Technology and Solid’s Properties, Faculty of Sciences and Technology, Abdelhamid Ibn Badis University, BP 227, Mostaganem 27000 (Algeria); Bouadjemi, B.; Benstaali, W. [Laboratory of Technology and Solid’s Properties, Faculty of Sciences and Technology, Abdelhamid Ibn Badis University, BP 227, Mostaganem 27000 (Algeria); Bouhafs, B. [Modelling and Simulation in Materials Science Laboratory, Djillali Liabès University of Sidi Bel-Abbès, 22000 Sidi Bel-Abbes (Algeria); Abbad, A. [Laboratory of Technology and Solid’s Properties, Faculty of Sciences and Technology, Abdelhamid Ibn Badis University, BP 227, Mostaganem 27000 (Algeria); Modelling and Simulation in Materials Science Laboratory, Djillali Liabès University of Sidi Bel-Abbès, 22000 Sidi Bel-Abbes (Algeria); Zitouni, A. [Laboratory of Technology and Solid’s Properties, Faculty of Sciences and Technology, Abdelhamid Ibn Badis University, BP 227, Mostaganem 27000 (Algeria)
2016-12-01
Using the first-principle calculations, we have investigated the structural, elastic, optoelectronic and magnetic properties of Co{sub 2}MnSi Heusler alloy. Based on the density functional theory (DFT) and hiring the full-potential linearized augmented plane wave (FP-LAPW) method, we have used five approaches: the Hybrid on-site exact exchange, the Local Spin Density Approximation (LSDA), the LSDA+U, the Generalized Gradient Approximation GGA and GGA+U; where the Hubbard on-site Coulomb interaction correction U is calculated by constraint local density approximation for Co and Mn atoms. Our results show that the highly-ordered Co{sub 2}MnSi alloy is a ductile, stiff and anisotropic material. It has a half-metallic ferromagnetic character with an integer magnetic moment of 5 µB which is in good agreement with the Slater-Pauling rule. - Highlights: • Each approach gives a half magnetic compound. • EECE gives the largest gap. • Elastic properties show a stiff, ductile and anisotropic material. • Electronic properties are similar for the five approaches. • Total magnetic moment is the same for the five approaches (5 µB).
Yao, Yuan; Capecelatro, Jesse
2018-03-01
We present a numerical study on inertial electrically charged particles suspended in a turbulent carrier phase. Fluid-particle interactions are accounted for in an Eulerian-Lagrangian (EL) framework and coupled to a Fourier-based Ewald summation method, referred to as the particle-particle-particle-mesh (P3M ) method, to accurately capture short- and long-range electrostatic forces in a tractable manner. The EL P3M method is used to assess the competition between drag and Coulomb forces for a range of Stokes numbers and charge densities. Simulations of like- and oppositely charged particles suspended in a two-dimensional Taylor-Green vortex and three-dimensional homogeneous isotropic turbulence are reported. It is found that even in dilute suspensions, the short-range electric potential plays an important role in flows that admit preferential concentration. Suspensions of oppositely charged particles are observed to agglomerate in the form of chains and rings. Comparisons between the particle-mesh method typically employed in fluid-particle calculations and P3M are reported, in addition to one-point and two-point statistics to quantify the level of clustering as a function of Reynolds number, Stokes number, and nondimensional electric settling velocity.
The role of three-body coulomb fields versus final state interactions in the decay of 12C-α-12C
International Nuclear Information System (INIS)
Quebert, J.L.; Bertault, D.; Scheurer, J.N.; Fouan, J.P.
1980-01-01
The alpha emission in 16 O + 12 C→ 12 C + α + 12 C has been thoroughly studied in the region of the rapidity plot: Ysub(α)=Ysub(c.m.). The three-body coulomb fields, as well as configurations close to alignment, account for the alpha yield which is observed. The apparent competition between direct and sequential decays is well explained by the coulomb break-up
International Nuclear Information System (INIS)
Gonis, Antonios; Daene, Markus W.; Nicholson, Don M.; Stocks, George Malcolm
2012-01-01
We have developed and tested in terms of atomic calculations an exact, analytic and computationally simple procedure for determining the functional derivative of the exchange energy with respect to the density in the implementation of the Kohn Sham formulation of density functional theory (KS-DFT), providing an analytic, closed-form solution of the self-interaction problem in KS-DFT. We demonstrate the efficacy of our method through ground-state calculations of the exchange potential and energy for atomic He and Be atoms, and comparisons with experiment and the results obtained within the optimized effective potential (OEP) method.
Marked Object Recognition Multitouch Screen Printed Touchpad for Interactive Applications.
Nunes, Jivago Serrado; Castro, Nelson; Gonçalves, Sergio; Pereira, Nélson; Correia, Vitor; Lanceros-Mendez, Senentxu
2017-12-01
The market for interactive platforms is rapidly growing, and touchscreens have been incorporated in an increasing number of devices. Thus, the area of smart objects and devices is strongly increasing by adding interactive touch and multimedia content, leading to new uses and capabilities. In this work, a flexible screen printed sensor matrix is fabricated based on silver ink in a polyethylene terephthalate (PET) substrate. Diamond shaped capacitive electrodes coupled with conventional capacitive reading electronics enables fabrication of a highly functional capacitive touchpad, and also allows for the identification of marked objects. For the latter, the capacitive signatures are identified by intersecting points and distances between them. Thus, this work demonstrates the applicability of a low cost method using royalty-free geometries and technologies for the development of flexible multitouch touchpads for the implementation of interactive and object recognition applications.
Marked Object Recognition Multitouch Screen Printed Touchpad for Interactive Applications
Directory of Open Access Journals (Sweden)
Jivago Serrado Nunes
2017-12-01
Full Text Available The market for interactive platforms is rapidly growing, and touchscreens have been incorporated in an increasing number of devices. Thus, the area of smart objects and devices is strongly increasing by adding interactive touch and multimedia content, leading to new uses and capabilities. In this work, a flexible screen printed sensor matrix is fabricated based on silver ink in a polyethylene terephthalate (PET substrate. Diamond shaped capacitive electrodes coupled with conventional capacitive reading electronics enables fabrication of a highly functional capacitive touchpad, and also allows for the identification of marked objects. For the latter, the capacitive signatures are identified by intersecting points and distances between them. Thus, this work demonstrates the applicability of a low cost method using royalty-free geometries and technologies for the development of flexible multitouch touchpads for the implementation of interactive and object recognition applications.
Stabilization of cucurbituril/guest assemblies via long-range Coulombic and CH···O interactions.
Joseph, Roymon; Nkrumah, Anna; Clark, Ronald J; Masson, Eric
2014-05-07
Cucurbit[n]urils (CB[n], n = 6-8) interact strongly with metal-bound 4'-substituted terpyridine ligands (M = Fe(II) and Ir(III)) via CH···O hydrogen bonding, despite significant separation between the positive metallic cation and the carbonylated rim of CB[n], and the location of the latter in the second coordination sphere of the metal ion. While water has been shown to mediate interactions between cations and CB[n]s in some assemblies, mediation by organic ligands is unprecedented. The recognition process is driven by the contrasted combination of extremely favorable binding enthalpies (up to 20.2 kcal/mol) and very unfavorable entropic components (as low as -10.2 kcal/mol). Dynamic oligomers were prepared in the presence of CB[8], which acts as a "soft", noncovalent linker between metal/terpyridine complexes, and interconnects two 4'-substituents inside its cavity. Social self-sorting between CB[8] and metal/terpyridine complexes bearing 4'-(2-naphthyl) and 4'-(2,3,5,6-tetrafluorophenyl) substituents was also observed, and could afford well-organized oligomers with alternating Fe(II) and Ir(III) cations.
Coulombic Fluids Bulk and Interfaces
Freyland, Werner
2011-01-01
Ionic liquids have attracted considerable interest in recent years. In this book the bulk and interfacial physico-chemical characteristics of various fluid systems dominated by Coulomb interactions are treated which includes molten salts, ionic liquids as well as metal-molten salt mixtures and expanded fluid metals. Of particular interest is the comparison of the different systems. Topics in the bulk phase concern the microscopic structure, the phase behaviour and critical phenomena, and the metal-nonmetal transition. Interfacial phenomena include wetting transitions, electrowetting, surface freezing, and the electrified ionic liquid/ electrode interface. With regard to the latter 2D and 3D electrochemical phase formation of metals and semi-conductors on the nanometer scale is described for a number of selected examples. The basic concepts and various experimental methods are introduced making the book suitable for both graduate students and researchers interested in Coulombic fluids.
DEFF Research Database (Denmark)
Rolle, Massimo; Sprocati, Riccardo; Masi, Matteo
2018-01-01
‐ but also under advection‐dominated flow regimes. To accurately describe charge effects in flow‐through systems, we propose a multidimensional modeling approach based on the Nernst‐Planck formulation of diffusive/dispersive fluxes. The approach is implemented with a COMSOL‐PhreeqcRM coupling allowing us......, and high‐resolution experimental datasets. The latter include flow‐through experiments that have been carried out in this study to explore the effects of electrostatic interactions in fully three‐dimensional setups. The results of the simulations show excellent agreement for all the benchmarks problems...... the quantification and visualization of the specific contributions to the diffusive/dispersive Nernst‐Planck fluxes, including the Fickian component, the term arising from the activity coefficient gradients, and the contribution due to electromigration....
Protein-Ligand Empirical Interaction Components for Virtual Screening.
Yan, Yuna; Wang, Weijun; Sun, Zhaoxi; Zhang, John Z H; Ji, Changge
2017-08-28
A major shortcoming of empirical scoring functions is that they often fail to predict binding affinity properly. Removing false positives of docking results is one of the most challenging works in structure-based virtual screening. Postdocking filters, making use of all kinds of experimental structure and activity information, may help in solving the issue. We describe a new method based on detailed protein-ligand interaction decomposition and machine learning. Protein-ligand empirical interaction components (PLEIC) are used as descriptors for support vector machine learning to develop a classification model (PLEIC-SVM) to discriminate false positives from true positives. Experimentally derived activity information is used for model training. An extensive benchmark study on 36 diverse data sets from the DUD-E database has been performed to evaluate the performance of the new method. The results show that the new method performs much better than standard empirical scoring functions in structure-based virtual screening. The trained PLEIC-SVM model is able to capture important interaction patterns between ligand and protein residues for one specific target, which is helpful in discarding false positives in postdocking filtering.
Experiments on Coulomb ionization by charged particles
International Nuclear Information System (INIS)
Andersen, J.U.; Laegsgaard, E.; Lund, M.
1978-01-01
Inner-shell ionization by light projectiles, i.e., in very asymmetric collisions, is often denoted 'Coulomb ionization' because it is caused by the Coulomb interaction between the electron and the projectile. Although with little justification, the term is also used to distinquish such processes, in which the projectile Coulomb field is a small perturbation, from ionization in more violent, nearly symmetric ion-atom collisions. A discussion of Coulomb ionization of atomic K shells is given, with emphasis on experimental methods and results. The discussion is not intended as a review of the field but rather as a progress report on the anthor's work on the subject. A more detailed account was recently presented at the ICPEAC meeting in Paris. (Auth.)
Trinucleon asymptotic normalization constants including Coulomb effects
International Nuclear Information System (INIS)
Friar, J.L.; Gibson, B.F.; Lehman, D.R.; Payne, G.L.
1982-01-01
Exact theoretical expressions for calculating the trinucleon S- and D-wave asymptotic normalization constants, with and without Coulomb effects, are presented. Coordinate-space Faddeev-type equations are used to generate the trinucleon wave functions, and integral relations for the asymptotic norms are derived within this framework. The definition of the asymptotic norms in the presence of the Coulomb interaction is emphasized. Numerical calculations are carried out for the s-wave NN interaction models of Malfliet and Tjon and the tensor force model of Reid. Comparison with previously published results is made. The first estimate of Coulomb effects for the D-wave asymptotic norm is given. All theoretical values are carefully compared with experiment and suggestions are made for improving the experimental situation. We find that Coulomb effects increase the 3 He S-wave asymptotic norm by less than 1% relative to that of 3 H, that Coulomb effects decrease the 3 He D-wave asymptotic norm by approximately 8% relative to that of 3 H, and that the distorted-wave Born approximation D-state parameter, D 2 , is only 1% smaller in magnitude for 3 He than for 3 H due to compensating Coulomb effects
International Nuclear Information System (INIS)
Greensite, J.; Olejnik, S.
2003-01-01
We study the phase structure of SU(2) gauge theories at zero and high temperature, with and without scalar matter fields, in terms of the symmetric/broken realization of the remnant gauge symmetry which exists after fixing to Coulomb gauge. The symmetric realization is associated with a linearly rising color Coulomb potential (which we compute numerically), and is a necessary but not sufficient condition for confinement.
Empirical Coulomb matrix elements and the mass of 22Al
International Nuclear Information System (INIS)
Whitehead, R.R.; Watt, A.; Kelvin, D.; Rutherford, H.J.
1976-01-01
An attempt has been made to obtain a set of Coulomb matrix elements which fit the known Coulomb energy shifts in the nuclei of mass 18 to 22. The interaction obtained fits the data well with only a few exceptions, one of these being the Coulomb shift of the notorious third 0 + state in 18 Ne. These Coulomb matrix elements are used together with the Chung-Wildenthal interaction to obtain a new prediction for the mass excess of 22 Al. The results indicate that 22 Al should be bound against proton emission. (Auth.)
Ionic fluids with r-6 pair interactions have power-law electrostatic screening
International Nuclear Information System (INIS)
Kjellander, Roland; Forsberg, Bjoern
2005-01-01
The decay behaviour of radial distribution functions for large distances r is investigated for classical Coulomb fluids where the ions interact with an r -6 potential (e.g. a dispersion interaction) in addition to the Coulombic and the short-range repulsive potentials (e.g. a hard core). The pair distributions and the density-density (NN), charge-density (QN) and charge-charge (QQ) correlation functions are investigated analytically and by Monte Carlo simulations. It is found that the NN correlation function ultimately decays like r -6 for large r, just as it does for fluids of electroneutral particles interacting with an r -6 potential. The prefactor is proportional to the squared compressibility in both cases. The QN correlations decay in general like r -8 and the QQ correlations like r -10 in the ionic fluid. The average charge density around an ion decays generally like r -8 and the average electrostatic potential like r -6 . This behaviour is in stark contrast to the decay behaviour for classical Coulomb fluids in the absence of the r -6 potential, where all these functions decay exponentially for large r. The power-law decays are, however, the same as for quantum Coulomb fluids. This indicates that the inclusion of the dispersion interaction as an effective r -6 interaction potential in classical systems yields the same decay behaviour for the pair correlations as in quantum ionic systems. An exceptional case is the completely symmetric binary electrolyte for which only the NN correlation has a power-law decay but not the QQ correlations. These features are shown by an analysis of the bridge function
Interaction between plate make and protein in protein crystallisation screening.
Directory of Open Access Journals (Sweden)
Gordon J King
Full Text Available BACKGROUND: Protein crystallisation screening involves the parallel testing of large numbers of candidate conditions with the aim of identifying conditions suitable as a starting point for the production of diffraction quality crystals. Generally, condition screening is performed in 96-well plates. While previous studies have examined the effects of protein construct, protein purity, or crystallisation condition ingredients on protein crystallisation, few have examined the effect of the crystallisation plate. METHODOLOGY/PRINCIPAL FINDINGS: We performed a statistically rigorous examination of protein crystallisation, and evaluated interactions between crystallisation success and plate row/column, different plates of same make, different plate makes and different proteins. From our analysis of protein crystallisation, we found a significant interaction between plate make and the specific protein being crystallised. CONCLUSIONS/SIGNIFICANCE: Protein crystal structure determination is the principal method for determining protein structure but is limited by the need to produce crystals of the protein under study. Many important proteins are difficult to crystallize, so that identification of factors that assist crystallisation could open up the structure determination of these more challenging targets. Our findings suggest that protein crystallisation success may be improved by matching a protein with its optimal plate make.
Critical opalescence in the pure Coulomb system
Energy Technology Data Exchange (ETDEWEB)
Bobrov, V.B., E-mail: vic5907@mail.r [Joint Institute for High Temperatures, Russian Academy of Sciences, Izhorskaia St., 13, Bd. 2. Moscow 125412 (Russian Federation); Trigger, S.A., E-mail: satron@mail.r [Joint Institute for High Temperatures, Russian Academy of Sciences, Izhorskaia St., 13, Bd. 2. Moscow 125412 (Russian Federation); Institut fuer Physik, Humboldt-Universitaet zu Berlin, Newtonstrasse 15, D-12489 Berlin (Germany)
2011-04-18
Highlights: The review of the critical opalescence problem is presented. Light scattering in a two-component electron-nuclear system is studied. The exact relations between the structure factors and compressibility are found. The obtained relations are valid for strong interaction for the Coulomb systems. The experimental verification of these relations is possible for various elements. - Abstract: Based on the dielectric formalism and quantum field theory methods, the phenomenon of critical opalescence is explained for light scattering in pure matter as a two-component electron-nuclear system with Coulomb interaction. A similar phenomenon is shown to occur in the case of neutron scattering in pure substances as well. The obtained results are valid for quantum case and arbitrary strong Coulomb interaction. Thus, the relations between structure factors derived for the electron-nuclear system are the exact result of the quantum statistical mechanics.
Critical opalescence in the pure Coulomb system
International Nuclear Information System (INIS)
Bobrov, V.B.; Trigger, S.A.
2011-01-01
Highlights: → The review of the critical opalescence problem is presented. → Light scattering in a two-component electron-nuclear system is studied. → The exact relations between the structure factors and compressibility are found. → The obtained relations are valid for strong interaction for the Coulomb systems. → The experimental verification of these relations is possible for various elements. - Abstract: Based on the dielectric formalism and quantum field theory methods, the phenomenon of critical opalescence is explained for light scattering in pure matter as a two-component electron-nuclear system with Coulomb interaction. A similar phenomenon is shown to occur in the case of neutron scattering in pure substances as well. The obtained results are valid for quantum case and arbitrary strong Coulomb interaction. Thus, the relations between structure factors derived for the electron-nuclear system are the exact result of the quantum statistical mechanics.
Critical opalescence in the pure Coulomb system
Bobrov, V. B.; Trigger, S. A.
2011-04-01
Based on the dielectric formalism and quantum field theory methods, the phenomenon of critical opalescence is explained for light scattering in pure matter as a two-component electron-nuclear system with Coulomb interaction. A similar phenomenon is shown to occur in the case of neutron scattering in pure substances as well. The obtained results are valid for quantum case and arbitrary strong Coulomb interaction. Thus, the relations between structure factors derived for the electron-nuclear system are the exact result of the quantum statistical mechanics.
Screening important inputs in models with strong interaction properties
International Nuclear Information System (INIS)
Saltelli, Andrea; Campolongo, Francesca; Cariboni, Jessica
2009-01-01
We introduce a new method for screening inputs in mathematical or computational models with large numbers of inputs. The method proposed here represents an improvement over the best available practice for this setting when dealing with models having strong interaction effects. When the sample size is sufficiently high the same design can also be used to obtain accurate quantitative estimates of the variance-based sensitivity measures: the same simulations can be used to obtain estimates of the variance-based measures according to the Sobol' and the Jansen formulas. Results demonstrate that Sobol' is more efficient for the computation of the first-order indices, while Jansen performs better for the computation of the total indices.
Screening important inputs in models with strong interaction properties
Energy Technology Data Exchange (ETDEWEB)
Saltelli, Andrea [European Commission, Joint Research Centre, 21020 Ispra, Varese (Italy); Campolongo, Francesca [European Commission, Joint Research Centre, 21020 Ispra, Varese (Italy)], E-mail: francesca.campolongo@jrc.it; Cariboni, Jessica [European Commission, Joint Research Centre, 21020 Ispra, Varese (Italy)
2009-07-15
We introduce a new method for screening inputs in mathematical or computational models with large numbers of inputs. The method proposed here represents an improvement over the best available practice for this setting when dealing with models having strong interaction effects. When the sample size is sufficiently high the same design can also be used to obtain accurate quantitative estimates of the variance-based sensitivity measures: the same simulations can be used to obtain estimates of the variance-based measures according to the Sobol' and the Jansen formulas. Results demonstrate that Sobol' is more efficient for the computation of the first-order indices, while Jansen performs better for the computation of the total indices.
Coulomb Blockade Plasmonic Switch.
Xiang, Dao; Wu, Jian; Gordon, Reuven
2017-04-12
Tunnel resistance can be modulated with bias via the Coulomb blockade effect, which gives a highly nonlinear response current. Here we investigate the optical response of a metal-insulator-nanoparticle-insulator-metal structure and show switching of a plasmonic gap from insulator to conductor via Coulomb blockade. By introducing a sufficiently large charging energy in the tunnelling gap, the Coulomb blockade allows for a conductor (tunneling) to insulator (capacitor) transition. The tunnelling electrons can be delocalized over the nanocapacitor again when a high energy penalty is added with bias. We demonstrate that this has a huge impact on the plasmonic resonance of a 0.51 nm tunneling gap with ∼70% change in normalized optical loss. Because this structure has a tiny capacitance, there is potential to harness the effect for high-speed switching.
New type of cross section singularity in backward scattering: the Coulomb glory
International Nuclear Information System (INIS)
Demkov, Y.N.; Ostrovskii, V.N.; Tel'nov, D.A.
1984-01-01
For classical scattering by a central potential that exhibits Coulomb behavior (i.e., that is attractive) at small distances, the scattering angle theta tends to π as the orbital angular momentum L decreases. The differential cross section for scattering through angles close to π can be characterized by the power series expansion of the difference theta(L)--π in small L, only odd powers of L being present in this expansion. Expressions are found for the coefficients in the linear (c 1 ) and cubic (c 3 ): in L: terms. It is shown that, for a broad class of screened Coulomb potentials, the coefficient c 1 vanishes at some value of the collision energy E 0 . At the energy E = E 0 the classical cross section diverges in the case of backward scattering (the Coulomb glory); in wave mechanics the cross section possesses a maximum. The behavior of the cross section for energies close to E 0 is computed. The application of the theory to electron scattering by atoms, in which the Coulomb interaction at small distances is determined by the interaction with the nucleus (charge Z) and E 0 = 0.0103Z 4 /sup // 3 keV, is discussed
The Role of Interactional Quality in Learning from Touch Screens during Infancy: Context Matters
Zack, Elizabeth; Barr, Rachel
2016-01-01
Interactional quality has been shown to enhance learning during book reading and play, but has not been examined during touch screen use. Learning to apply knowledge from a touch screen is complex for infants because it involves transfer of learning between a 2-dimensional (2D) screen and 3-dimensional (3D) object in the physical world. This study uses a touch screen procedure to examine interactional quality measured via maternal structuring, diversity of maternal language, and dyadic emot...
The electrostatic interaction between interfacial colloidal particles
Hurd, A. J.
1985-11-01
The electrostatic interaction between charged, colloidal particles trapped at an air-water interface is considered using linearised Poisson-Boltzmann results for point particles. In addition to the expected screened-Coulomb contribution, which decays exponentially, an algebraic dipole-dipole interaction occurs that may account for long-range interactions in interfacial colloidal systems.
The Coulomb potential in quantum mechanics and related topics
International Nuclear Information System (INIS)
Haeringen, H. van.
1978-01-01
This dissertation consists of an analytic study of the Coulomb interaction in nonrelativistic quantum mechanics and some related topics. The author investigates in a number of self-contained articles various interesting and important properties of the Coulomb potential. Some of these properties are shared by other potentials which also play a role in quantum mechanics. For such related interactions a comparative study is made. The principal difficulties in the description of proton-deuteron scattering and break-up reactions, due to the Coulomb interaction, are studied by working out a simple model. The bound states are studied for the Coulomb plus Yamaguchi potential, for the symmetric shifted Coulomb potential, and for local potentials with an inverse-distance-squared asymptotic behaviour. (Auth.)
Appleberry, W. T.
1983-01-01
Standard hydraulic shock absorber modified to form coulomb (linear friction) damper. Device damps very small velocities and is well suited for use with large masses mounted on soft springs. Damping force is easily adjusted for different loads. Dampers are more reliable than fluid dampers and also more economical to build and to maintain.
Relativistic Coulomb excitation
International Nuclear Information System (INIS)
Winther, A.; Alder, K.
1979-01-01
Coulomb excitation of both target and projectile in relativistic heavy ion collisions is evaluated including the lowest order correction for the deviation from a straight line trajectory. Explicit results for differential and total cross sections are given in the form of tables and figures. (Auth.)
Energy Technology Data Exchange (ETDEWEB)
Waintal, X
1999-09-10
We study the quantum mechanics of interacting particles in a disordered system, and in particular, what happens to Anderson localisation when interaction is taken into account. In the first part,one looks at the excited states of two particles in one dimension. For this model, it has been shown (Shepelyansky 1994) that a local repulsive interaction can partially destroy Anderson localisation. Here, we show that this model has similarities with the three-dimensional Anderson model at the metal-insulator transition. In particular, the maximum of rigidity obtained in the spectral statistics correspond to some intermediary statistics that cannot be described by random matrix theory neither by a Poisson statistics. The wave functions show a multifractal behaviour and the spreading of the center of mass of a wave packet is logarithmic in time. The second part deals with the ground state of a finite density of spinless fermions in two dimensions. After the scaling theory of localisation, it was commonly accepted that there was no metal in two dimensions. This idea has been challenged by the observation of a metal-insulator transition in low density electron gas (Kravchenko et al. 1994). We propose a scenario in which a metallic phase occurs between the Anderson insulator and the pinned Wigner crystal. This intermediate phase is characterized by an alignment of the local currents flowing in the system. (author)
Yang, Yang; Yu, Haibo; York, Darrin; Cui, Qiang; Elstner, Marcus
2007-10-25
The standard self-consistent-charge density-functional-tight-binding (SCC-DFTB) method (Phys. Rev. B 1998, 58, 7260) is derived by a second-order expansion of the density functional theory total energy expression, followed by an approximation of the charge density fluctuations by charge monopoles and an effective damped Coulomb interaction between the atomic net charges. The central assumptions behind this effective charge-charge interaction are the inverse relation of atomic size and chemical hardness and the use of a fixed chemical hardness parameter independent of the atomic charge state. While these approximations seem to be unproblematic for many covalently bound systems, they are quantitatively insufficient for hydrogen-bonding interactions and (anionic) molecules with localized net charges. Here, we present an extension of the SCC-DFTB method to incorporate third-order terms in the charge density fluctuations, leading to chemical hardness parameters that are dependent on the atomic charge state and a modification of the Coulomb scaling to improve the electrostatic treatment within the second-order terms. These modifications lead to a significant improvement in the description of hydrogen-bonding interactions and proton affinities of biologically relevant molecules.
Coulomb states in atoms and solids
International Nuclear Information System (INIS)
Ortalano, D.M.
1988-05-01
In this dissertation, an empirical quantum defect approach to describe the valence excitons of the rare gas solids is developed. These Coulomb states are of s-symmetry and form a hydrogen-like series which converges to the bottom of the lowest conduction band. A non-zero quantum defect is found for all of the excitons of neon, argon and xenon. For these systems, then, there exists, in addition to the screened Coulombic component, a non-Coulombic component to the total exciton binding energy. The Wannier formalism is, therefore, inappropriate for the excitons of Ne, Ar and Xe. From the sign of the quantum defect, the non-Coulombic potential is repulsive for Ne and Ar, attractive for Xe, and nearly zero for Kr. This is opposite to that for the Rydberg states of the corresponding rare gas atoms, where the non-Coulombic potential between the electron and the cation is attractive for all of the atoms. The excitons then, are not simply perturbed Rydberg states of the corresponding rare gas atoms (i.e., the excitons do not possess atomic parentage). Interatomic term value/band gap energy correlations and reduced term value/reduced band gap correlations were performed. These correlations were exploited to provide further evidence against both the Wannier formalism and the atomic parentage view point. From these correlations, it was also discovered that the non-Coulombic potential varies smoothly across the valence isoelectronic series of solids, and that it becomes more attractive (or less repulsive) in going from neon to xenon. In order to address the atomic parentage controversy, it was necessary to compare the excitons to the low-n Rydberg states of the rare gas atoms. A review of the quantum defect description of the atomic Rydberg states is, therefore, presented. Also, Rydberg term value/ionization energy correlations are discussed and compared with the analogous exciton correlations. 7 refs., 10 figs., 5 tabs
Coulomb drag in multiwall armchair carbon nanotubes
DEFF Research Database (Denmark)
Lunde, A.M.; Jauho, Antti-Pekka
2004-01-01
surface. The cylindrical geometry of the nanotubes and the different parities of the Bloch states are accounted for in the evaluation of the effective Coulomb interaction between charges in the concentric nanotubes. We find a broad peak in rho(21) as a function of temperature at roughly T similar to 0.4T...
Lee-Nauenberg theorem and Coulomb scattering
Energy Technology Data Exchange (ETDEWEB)
Fleming, H; Frenkel, J [Sao Paulo Univ. (Brazil). Instituto de Fisica
1975-08-01
Lee-Nauenberg analysis is extended to the case of Coulomb scattering, where the diagonal elements of the Hamiltonian interaction are singular functions. It is shown, using a simple argument, that the leading infrared singularities in the cross-section are mutually canceled out.
Expansions for Coulomb wave functions
Boersma, J.
1969-01-01
In this paper we derive a number of expansions for Whittaker functions, regular and irregular Coulomb wave functions. The main result consists of a new expansion for the irregular Coulomb wave functions of orders zero and one in terms of regular Coulomb wave functions. The latter expansions are
Representation of the Coulomb Matrix Elements by Means of Appell Hypergeometric Function F 2
Bentalha, Zine el abidine
2018-06-01
Exact analytical representation for the Coulomb matrix elements by means of Appell's double series F 2 is derived. The finite sum obtained for the Appell function F 2 allows us to evaluate explicitly the matrix elements of the two-body Coulomb interaction in the lowest Landau level. An application requiring the matrix elements of Coulomb potential in quantum Hall effect regime is presented.
Interactive TV: Interaction and Control in Second-screen TV Consumption
DEFF Research Database (Denmark)
Fleury, Alexandre; Pedersen, Jakob Schou; Baunstrup, Mai
2012-01-01
The integration of television and mobile technologies are becoming a reality in today’s home media environments. In order to facilitate the development of future cross-platform broadcast TV services, this study investigated prompting and control strategies for a secondary device in front of the TV...... they preferred with which content. Overall, we found a clear preference for keeping interactive contents and prompting on the secondary device and broadcast TV content on the primary screen. The workshops generated numerous ideas concerning possible personalization of such service....
Coulomb Correlations Intertwined with Spin and Orbital Excitations in LaCoO_{3}.
Tomiyasu, K; Okamoto, J; Huang, H Y; Chen, Z Y; Sinaga, E P; Wu, W B; Chu, Y Y; Singh, A; Wang, R-P; de Groot, F M F; Chainani, A; Ishihara, S; Chen, C T; Huang, D J
2017-11-10
We carried out temperature-dependent (20-550 K) measurements of resonant inelastic x-ray scattering on LaCoO_{3} to investigate the evolution of its electronic structure across the spin-state crossover. In combination with charge-transfer multiplet calculations, we accurately quantified the renomalized crystal-field excitation energies and spin-state populations. We show that the screening of the effective on-site Coulomb interaction of 3d electrons is orbital selective and coupled to the spin-state crossover in LaCoO_{3}. The results establish that the gradual spin-state crossover is associated with a relative change of Coulomb energy versus bandwidth, leading to a Mott-type insulator-to-metal transition.
Phase diagram, correlation gap, and critical properties of the Coulomb glass
Palassini, Matteo; Goethe, Martin
2009-03-01
We investigate the lattice Coulomb glass model in three dimensions via extensive Monte Carlo simulations. 1. No evidence for an equilibrium glass phase is found down to very low temperatures, contrary to mean-field predictions, although the correlation length increases rapidly near T=0. 2. The single-particle density of states near the Coulomb gap satisfies the scaling law g(e,T)=T^λf(e/T) with λ 2.2. 3. A charge-ordered phase exists at low disorder. The phase transition from the fluid to the charge ordered phase is consistent with the Random Field Ising universality class, which shows that the interaction is effectively screened at moderate temperature. Results from nonequilibrium simulations will also be briefly discussed. Reference: M.Goethe and M.Palassini, arXiv:0810.1047
Abram, M; Zegrodnik, M; Spałek, J
2017-09-13
In the first part of the paper, we study the stability of antiferromagnetic (AF), charge density wave (CDW), and superconducting (SC) states within the t-J-U-V model of strongly correlated electrons by using the statistically consistent Gutzwiller approximation (SGA). We concentrate on the role of the intersite Coulomb interaction term V in stabilizing the CDW phase. In particular, we show that the charge ordering appears only above a critical value of V in a limited hole-doping range δ. The effect of the V term on SC and AF phases is that a strong interaction suppresses SC, whereas the AF order is not significantly influenced by its presence. In the second part, separate calculations for the case of a pure SC phase have been carried out within an extended approach (the diagrammatic expansion for the Gutzwiller wave function, DE-GWF) in order to analyze the influence of the intersite Coulomb repulsion on the SC phase with the higher-order corrections included beyond the SGA method. The upper concentration for the SC disappearance decreases with increasing V, bringing the results closer to experiment. In appendices A and B we discuss the ambiguity connected with the choice of the Gutzwiller renormalization factors within the renormalized mean filed theory when either AF or CDW orders are considered. At the end, we overview briefly the possible extensions of the current models to put descriptions of the SC, AF, and CDW states on equal footing.
Applicability of the molecular dynamics method for the Coulomb plasma
International Nuclear Information System (INIS)
Zhidkov, A.G.; Galeev, R.Kh.
1993-01-01
Calculations of the local Lyapunov parameter determining the character of movement, n paticle systems, interacting according to the Coulomb law are conducted. The calculations are presented for the most probable states of fully ionized plasma
Impact of density-dependent symmetry energy and Coulomb ...
Indian Academy of Sciences (India)
2014-03-07
Mar 7, 2014 ... The IMF production increases with the stiffness of symmetry energy. .... to clusterization using minimum spanning tree MST(M) method .... To understand the direct role of Coulomb interactions, we display in figure 4 the mean.
Theory of Coulomb drag for massless Dirac fermions
International Nuclear Information System (INIS)
Carrega, M; Principi, A; Polini, M; Tudorovskiy, T; Katsnelson, M I
2012-01-01
Coulomb drag between two unhybridized graphene sheets separated by a dielectric spacer has recently attracted considerable theoretical interest. We first review, for the sake of completeness, the main analytical results which have been obtained by other authors. We then illustrate pedagogically the minimal theory of Coulomb drag between two spatially separated two-dimensional systems of massless Dirac fermions which are both away from the charge-neutrality point. This relies on second-order perturbation theory in the screened interlayer interaction and on Boltzmann-transport theory. In this theoretical framework and in the low-temperature limit, we demonstrate that, to leading (i.e. quadratic) order in temperature, the drag transresistivity is completely insensitive to the precise intralayer momentum-relaxation mechanism (i.e. to the functional dependence of the transport scattering time on energy). We also provide analytical results for the low-temperature drag transresistivity for both cases of ‘thick’ and ‘thin’ spacers and for arbitrary values of the dielectric constants of the media surrounding the two Dirac-fermion layers. Finally, we present numerical results for the low-temperature drag transresistivity for the case when one of the media surrounding the Dirac-fermion layers has a frequency-dependent dielectric constant. We conclude by suggesting an experiment that can potentially allow for the observation of departures from the canonical quadratic-in-temperature behavior of the transresistivity. (paper)
Coulomb Logarithm in Nonideal and Degenerate Plasmas
Filippov, A. V.; Starostin, A. N.; Gryaznov, V. K.
2018-03-01
Various methods for determining the Coulomb logarithm in the kinetic theory of transport and various variants of the choice of the plasma screening constant, taking into account and disregarding the contribution of the ion component and the boundary value of the electron wavevector are considered. The correlation of ions is taken into account using the Ornstein-Zernike integral equation in the hypernetted-chain approximation. It is found that the effect of ion correlation in a nondegenerate plasma is weak, while in a degenerate plasma, this effect must be taken into account when screening is determined by the electron component alone. The calculated values of the electrical conductivity of a hydrogen plasma are compared with the values determined experimentally in the megabar pressure range. It is shown that the values of the Coulomb logarithm can indeed be smaller than unity. Special experiments are proposed for a more exact determination of the Coulomb logarithm in a magnetic field for extremely high pressures, for which electron scattering by ions prevails.
Harb, Moussab
2014-01-01
We present a joint theoretical and experimental investigation of the optoelectronic properties of CuVO3, CuNbO3 and Cu 5Ta11O30 materials for potential photocatalytic and solar cell applications. In addition to the experimental results obtained by powder X-ray diffraction and UV-Vis spectroscopy of the materials synthesized under flowing N2 gas at atmospheric pressure via solid-state reactions, the electronic structure and the UV-Vis optical absorption coefficient of these compounds are predicted with high accuracy using advanced first-principles quantum methods based on DFT (including the perturbation theory approach DFPT) within the screened coulomb hybrid HSE06 exchange-correlation formalism. The calculated density of states are found to be in agreement with the UV-Vis diffuse reflectance spectra, predicting a small indirect band gap of 1.4 eV for CuVO3, a direct band gap of 2.6 eV for CuNbO3, and an indirect (direct) band gap of 2.1 (2.6) eV for Cu5Ta 11O30. It is confirmed that the Cu(i)-based multi-metal oxides possess a strong contribution of filled Cu(i) states in the valence band and of empty d0 metal states in the conduction band. Interestingly, CuVO3 with its predicted small indirect band gap of 1.4 eV shows the highest absorption coefficient in the visible range with a broad absorption edge extending to 886 nm. This novel result offers a great opportunity for this material to be an excellent candidate for solar cell applications. © the Partner Organisations 2014.
Some studies in scatering by Coulomb modified nuclear potentials
International Nuclear Information System (INIS)
Laha, U.
1988-01-01
Recently, there has been a surge of interest in theoretical questions concerning the Coulomb nuclear problems with the main emphasis on their off-shell behaviour. Earlier approaches to the problem made use of a version of the two-potential formula as used by Bajzer. A slightly different point of view is presented here. An expression for the interacting Green's function for motion in the Coulomb plus Graz potential is constructed and used to obtain the half-off-shell T matrix in the ''maximal reduced form''. Similar results were also derived for the off-shell Jost functions. It is explicitly demonstrated that Coulomb and Coulomb-like potentials the half-off-shell T matrix can be expressed in terms of on-and off-shell Jost functions in the same way as one does for a purely short range interaction. In presenting the results for T matrix and other related quantities, the Coulomb effect is included rigorously. Results clearly delineate the branch point singularities originating from the long range nature of the Coulomb interaction and thus provide a better understanding of the off-shell two-body Coulomb-like T matrices. It is hoped that these results will form an adequate starting point for rigorous calculations on few-body systems with charges. (author). 16 refs
International Nuclear Information System (INIS)
Hrasko, P.; Foeldy, L.; Toth, A.
1986-07-01
Electron-positron pair production in strong Coulomb fields is outlined. It is shown that the singular behaviour of the adiabatic basis can be removed if solutions of the time dependent external field Dirac equation are used as a basis to expand the fermion field operator. This latter 'asymptotic basis' makes it possible to introduce Feynman-propagator. Applying the reduction technique, the computation of all of the basic quantities can be reduced to the solution of an integral equation. The positron spectrum for separable potential model with Lorentzian time dependence and for potential jump is analyzed in the pole approximation. (author)
Coulomb energy, vortices, and confinement
International Nuclear Information System (INIS)
Greensite, Jeff; Olejnik, Stefan
2003-01-01
We estimate the Coulomb energy of static quarks from a Monte Carlo calculation of the correlator of timelike link variables in the Coulomb gauge. We find, in agreement with Cucchieri and Zwanziger, that this energy grows linearly with distance at large quark separations. The corresponding string tension, however, is several times greater than the accepted asymptotic string tension, indicating that a state containing only static sources, with no constituent gluons, is not the lowest energy flux tube state. The Coulomb energy is also measured on thermalized lattices with center vortices removed by the de Forcrand-D'Elia procedure. We find that when vortices are removed, the Coulomb string tension vanishes
International Nuclear Information System (INIS)
Vincent, R.; Juaristi, J.I.; Nagy, I.
2005-01-01
Standard classical and quantum-mechanical methods are used to characterize the momentum-transfer cross section needed in energy-loss calculations and simulations for heavy, swift charges moving in an electron gas. By applying a well-known, finite-range screened Coulombic potential energy to model the two-body collision, the quantitative applicability range of the classical cross section is investigated as a function of charge (Z), screening length (R), and scattering relative velocity (v). The a posteriori condition (Z/R)/v 2 <1, as an upper bound for heavy charges, is deduced for this applicability range from the comparative study performed
Computational assignment of redox states to Coulomb blockade diamonds.
Olsen, Stine T; Arcisauskaite, Vaida; Hansen, Thorsten; Kongsted, Jacob; Mikkelsen, Kurt V
2014-09-07
With the advent of molecular transistors, electrochemistry can now be studied at the single-molecule level. Experimentally, the redox chemistry of the molecule manifests itself as features in the observed Coulomb blockade diamonds. We present a simple theoretical method for explicit construction of the Coulomb blockade diamonds of a molecule. A combined quantum mechanical/molecular mechanical method is invoked to calculate redox energies and polarizabilities of the molecules, including the screening effect of the metal leads. This direct approach circumvents the need for explicit modelling of the gate electrode. From the calculated parameters the Coulomb blockade diamonds are constructed using simple theory. We offer a theoretical tool for assignment of Coulomb blockade diamonds to specific redox states in particular, and a study of chemical details in the diamonds in general. With the ongoing experimental developments in molecular transistor experiments, our tool could find use in molecular electronics, electrochemistry, and electrocatalysis.
An Interaction of Screen Colour and Lesson Task in CAL
Clariana, Roy B.
2004-01-01
Colour is a common feature in computer-aided learning (CAL), though the instructional effects of screen colour are not well understood. This investigation considers the effects of different CAL study tasks with feedback on posttest performance and on posttest memory of the lesson colour scheme. Graduate students (n=68) completed a computer-based…
On the Emergence of the Coulomb Forces in Quantum Electrodynamics
Directory of Open Access Journals (Sweden)
Jan Naudts
2017-01-01
Full Text Available A simple transformation of field variables eliminates Coulomb forces from the theory of quantum electrodynamics. This suggests that Coulomb forces may be an emergent phenomenon rather than being fundamental. This possibility is investigated in the context of reducible quantum electrodynamics. It is shown that states exist which bind free photon and free electron fields. The binding energy peaks in the long-wavelength limit. This makes it plausible that Coulomb forces result from the interaction of the electron/positron field with long-wavelength transversely polarized photons.
Coulomb displacement energies in nuclei: a new approach
International Nuclear Information System (INIS)
Auerbach, N.; Tel Aviv Univ.; Bernard, V.; Nguyen, V.G.
1978-04-01
The neutron core polarization gives rise to an important correction to the direct Coulomb contribution when one calculates the Coulomb displacement energies. In the Hartree-Fock model it is shown that this correction is about 2% to 4.5% in medium and heavy nuclei. The core polarization as well as other higher order effects can be included by using a selfconsistent description of the analog state in a complete proton particle-neutron hole space. The Coulomb displacement energies in 48 Ca, 88 Sr and 208 Pb have been calculated using Skyrme interactions SIII and SIV. A good agreement with experiment is obtained
INTERACTION OF LIQUID FLAT SCREENS WITH GAS FLOW RESTRICTED BY CHANNEL WALLS
Directory of Open Access Journals (Sweden)
S. T. Aksentiev
2005-01-01
Full Text Available The paper gives description of physical pattern of liquid screen interaction that are injected from the internal walls of a rectangular channel with gas flow. Criterion dependences for determination of intersection coordinates of external boundaries with longitudinal channel axis and factor of liquid screen head resistance.
Reaching Graduate Students at Risk for Suicidal Behavior through the Interactive Screening Program
Moffitt, Lauren B.; Garcia-Williams, Amanda; Berg, John P.; Calderon, Michelle E.; Haas, Ann P.; Kaslow, Nadine J.
2014-01-01
Suicidal behavior is a significant concern among graduate students. Because many suicidal graduate students do not access mental health services, programs to connect them to resources are essential. This article describes the Interactive Screening Program (ISP), an anonymous, Web-based tool for screening and engaging at-risk graduate school…
Dynamic screening in solar and stellar nuclear reactions
Energy Technology Data Exchange (ETDEWEB)
Daeppen, W. [Department of Physics and Astronomy, University of Southern California, Los Angeles, CA (United States); Mussack, K. [Los Alamos National Laboratory, XTD-2, Los Alamos, NM (United States)
2012-02-15
In the hot, dense plasma of solar and stellar interiors, Coulomb potentials are screened, resulting in increased nuclear reaction rates. Although Salpeter's approximation for static screening is widely accepted and used in stellar modeling, the question of screening in nuclear reactions was revisited in the 1990s. In particular the issue of dynamic effects was raised by Shaviv and Shaviv, who applied the techniques of molecular dynamics to the conditions in the Sun's core in order to numerically determine the effect of screening. By directly calculating the motion of ions and electrons due to Coulomb interactions, the simulations are used to compute the effect of screening without the mean-field assumption inherent in Salpeter's approximation. In the last few years, the USC group has first reproduced Shaviv and Shaviv's numerical analysis of the screening energy, showing an effect of dynamic screening. When the consequence for the reaction-rate was computed, a rather surprising resulted, which is contrary to that from static screening theory. Our calculations showed that dynamic screening does not significantly change the reaction rate from that of the bare Coulomb potential. If this can be independently confirmed, then the effects of dynamic screening are highly relevant and should be included in stellar nuclear reaction rates (copyright 2011 WILEY-VCH Verlag GmbH and Co. KGaA, Weinheim) (orig.)
Integral equation for Coulomb problem
International Nuclear Information System (INIS)
Sasakawa, T.
1986-01-01
For short range potentials an inhomogeneous (homogeneous) Lippmann-Schwinger integral equation of the Fredholm type yields the wave function of scattering (bound) state. For the Coulomb potential, this statement is no more valid. It has been felt difficult to express the Coulomb wave function in a form of an integral equation with the Coulomb potential as the perturbation. In the present paper, the author shows that an inhomogeneous integral equation of a Volterra type with the Coulomb potential as the perturbation can be constructed both for the scattering and the bound states. The equation yielding the binding energy is given in an integral form. The present treatment is easily extended to the coupled Coulomb problems
Coulomb double helical structure
Kamimura, Tetsuo; Ishihara, Osamu
2012-01-01
Structures of Coulomb clusters formed by dust particles in a plasma are studied by numerical simulation. Our study reveals the presence of various types of self-organized structures of a cluster confined in a prolate spheroidal electrostatic potential. The stable configurations depend on a prolateness parameter for the confining potential as well as on the number of dust particles in a cluster. One-dimensional string, two-dimensional zigzag structure and three-dimensional double helical structure are found as a result of the transition controlled by the prolateness parameter. The formation of stable double helical structures resulted from the transition associated with the instability of angular perturbations on double strings. Analytical perturbation study supports the findings of numerical simulations.
Energy Technology Data Exchange (ETDEWEB)
Carnegie, R K; Cashmore, R J; Davier, M; Leith, D W.G.S.; Richard, F; Schacht, P; Walden, P; Williams, S H [Stanford Linear Accelerator Center, Calif. (USA)
1975-11-10
The differential cross section for K/sup + -/p elastic scattering has been measured in the very low t region (0.003
The Role of Interactional Quality in Learning from Touch Screens during Infancy: Context Matters
Directory of Open Access Journals (Sweden)
Elizabeth Zack
2016-08-01
Full Text Available Interactional quality has been shown to enhance learning during book reading and play, but has not been examined during touch screen use. Learning to apply knowledge from a touch screen is complex for infants because it involves transfer of learning between a 2-dimensional (2D screen and 3-dimensional (3D object in the physical world. This study uses a touch screen procedure to examine interactional quality measured via maternal structuring, diversity of maternal language, and dyadic emotional responsiveness and infant outcomes during a transfer of learning task. Fifty 15-month-old infants and their mothers participated in this semi-naturalistic teaching task. Mothers were given a 3D object, and a static image of the object presented on a touch screen. Mothers had 5 minutes to teach their infant that a button on the real toy works in the same way as a virtual button on the touch screen (or vice versa. Overall, 64% of infants learned how to make the button work, transferring learning from the touch screen to the 3D object or vice versa. Infants were just as successful in the 3D to 2D transfer direction as they were in the 2D to 3D transfer direction. A cluster analysis based on emotional responsiveness, the proportion of diverse maternal verbal input, and amount of maternal structuring resulted in two levels of interactional quality: high quality and moderate quality. A logistic regression revealed the level of interactional quality predicted infant transfer. Infants were 19 times more likely to succeed and transfer learning between the touch screen and real object if they were in a high interactional quality dyad, even after controlling for infant activity levels. The present findings suggest that interactional quality between mother and infant plays an important role in making touch screens effective teaching tools for infants’ learning.
The Role of Interactional Quality in Learning from Touch Screens during Infancy: Context Matters.
Zack, Elizabeth; Barr, Rachel
2016-01-01
Interactional quality has been shown to enhance learning during book reading and play, but has not been examined during touch screen use. Learning to apply knowledge from a touch screen is complex for infants because it involves transfer of learning between a two-dimensional (2D) screen and three-dimensional (3D) object in the physical world. This study uses a touch screen procedure to examine interactional quality measured via maternal structuring, diversity of maternal language, and dyadic emotional responsiveness and infant outcomes during a transfer of learning task. Fifty 15-month-old infants and their mothers participated in this semi-naturalistic teaching task. Mothers were given a 3D object, and a static image of the object presented on a touch screen. Mothers had 5 min to teach their infant that a button on the real toy works in the same way as a virtual button on the touch screen (or vice versa). Overall, 64% of infants learned how to make the button work, transferring learning from the touch screen to the 3D object or vice versa. Infants were just as successful in the 3D to 2D transfer direction as they were in the 2D to 3D transfer direction. A cluster analysis based on emotional responsiveness, the proportion of diverse maternal verbal input, and amount of maternal structuring resulted in two levels of interactional quality: high quality and moderate quality. A logistic regression revealed the level of interactional quality predicted infant transfer. Infants were 19 times more likely to succeed and transfer learning between the touch screen and real object if they were in a high interactional quality dyad, even after controlling for infant activity levels. The present findings suggest that interactional quality between mother and infant plays an important role in making touch screens effective teaching tools for infants' learning.
Statistically designed experiments to screen chemical mixtures for possible interactions
Groten, J.P.; Tajima, O.; Feron, V.J.; Schoen, E.D.
1998-01-01
For the accurate analysis of possible interactive effects of chemicals in a defined mixture, statistical designs are necessary to develop clear and manageable experiments. For instance, factorial designs have been successfully used to detect two-factor interactions. Particularly useful for this
Coulomb interference and bending slope in hadron-hadron scattering
International Nuclear Information System (INIS)
Pereira, Flavio I.; Ferreira, Erasmo
1994-01-01
With the purpose of testing the results of QCD calculations on the structure of the forward elastic scattering cross-section, we analyse the coulombic-nuclear interference occurring at small values of the momentum transfer. We emphasize the influence of the hadronic structures on the determination of the Coulomb phase and consequently on the t-dependence of the strong interaction slope parameter. (author)
Mahoney, Emery B; Breitborde, Nicholas J K; Leone, Sarah L; Ghuman, Jaswinder Kaur
2014-10-01
Deficits in the capacity to engage in social interactions are a core deficit associated with Autistic Disorder (AD) and Pervasive Developmental Disorder-Not Otherwise Specified (PDD-NOS). These deficits emerge at a young age, making screening for social interaction deficits and interventions targeted at improving capacity in this area important for early identification and intervention. Screening and early intervention efforts are particularly important given the poor short and long term outcomes for children with Autism Spectrum Disorders (ASDs) who experience social interaction deficits. The Screen for Social Interaction (SSI) is a well-validated screening measure that examines a child's capacity for social interaction using a developmental approach. The present study identified four underlying factors measured by the SSI, namely, Connection with Caregiver, Interaction/Imagination, Social Approach/Interest, and Agreeable Nature. The resulting factors were utilized to compare social interaction profiles across groups of children with AD, PDD-NOS, children with non-ASD developmental and/or psychiatric conditions and typically developing children. The results indicate that children with AD and those with PDD-NOS had similar social interaction profiles, but were able to be distinguished from typically developing children on every factor and were able to be distinguished from children with non-ASD psychiatric conditions on every factor except the Connection with Caregiver factor. In addition, children with non-ASD developmental and/or psychiatric conditions could be distinguished from typically developing children on the Connection with Caregiver factor and the Social Approach/Interest factor. These findings have implications for screening and intervention for children with ASDs and non-ASD psychiatric conditions. Copyright © 2014 Elsevier Ltd. All rights reserved.
On the role of coulomb forces in atomic radiative emission
International Nuclear Information System (INIS)
Yngstroem, S.
1988-10-01
It is shown how the generalized Coulomb interaction (electric and magnetic fields of force) competes with the radiative interaction causing overall inhibition of the radiative capability of atoms and ions in a gaseous sample of matter. Basic quantum mechanical aspects of the electromagnetic interaction are discussed in a heuristic introduction followed by a more precise treatment in the formalism of relativistic quantum electrodynamics. (author)
Ultrafast dynamics of Coulomb correlated excitons in GaAs quantum wells
Energy Technology Data Exchange (ETDEWEB)
Mycek, M.A. [Univ. of California, Berkeley, CA (United States). Dept. of Physics]|[Lawrence Berkeley National Lab., CA (United States). Materials Sciences Div.
1995-12-01
The author measures the transient nonlinear optical response of room temperature excitons in gallium arsenide quantum wells via multi-wave mixing experiments. The dynamics of the resonantly excited excitons is directly reflected by the ultrafast decay of the induced nonlinear polarization, which radiates the detected multi-wave mixing signal. She characterizes this ultrafast coherent emission in both amplitude and phase, using time- and frequency-domain measurement techniques, to better understand the role of Coulomb correlation in these systems. To interpret the experimental results, the nonlinear optical response of a dense medium is calculated using a model including Coulomb interaction. She contributes three new elements to previous theoretical and experimental studies of these systems. First, surpassing traditional time-integrated measurements, she temporally resolves the amplitude of the ultrafast coherent emission. Second, in addition to measuring the third-order four-wave mixing signal, she also investigates the fifth-order six-wave mixing response. Third, she characterizes the ultrafast phase dynamics of the nonlinear emission using interferometric techniques with an unprecedented resolution of approximately 140 attoseconds. The author finds that effects arising from Coulomb correlation dominate the nonlinear optical response when the density of excitons falls below 3 {times} 10{sup 11} cm{sup {minus}2}, the saturation density. These signatures of Coulomb correlation are investigated for increasing excitation density to gradually screen the interactions and test the validity of the model for dense media. The results are found to be qualitatively consistent with both the predictions of the model and with numerical solutions to the semiconductor Bloch equations. Importantly, the results also indicate current experimental and theoretical limitations, which should be addressed in future research.
2016-01-01
This Sixth volume in the series The Key Debates. Mutations and Appropriations in European Film Studies investigates the question of screens in the context both of the dematerialization due to digitalization and the multiplication of media screens. Scholars offer various infomations and theories of topics such as the archeology of screen, film and media theories, contemporary art, pragmatics of new ways of screening (from home video to street screening).
Unified approach to probing Coulomb effects in tunnel ionization for any ellipticity of laser light.
Landsman, A S; Hofmann, C; Pfeiffer, A N; Cirelli, C; Keller, U
2013-12-27
We present experimental data that show significant deviations from theoretical predictions for the location of the center of the electron momenta distribution at low values of ellipticity ε of laser light. We show that these deviations are caused by significant Coulomb focusing along the minor axis of polarization, something that is normally neglected in the analysis of electron dynamics, even in cases where the Coulomb correction is otherwise taken into account. By investigating ellipticity-resolved electron momenta distributions in the plane of polarization, we show that Coulomb focusing predominates at lower values of ellipticity of laser light, while Coulomb asymmetry becomes important at higher values, showing that these two complementary phenomena can be used to probe long-range Coulomb interaction at all polarizations of laser light. Our results suggest that both the breakdown of Coulomb focusing and the onset of Coulomb asymmetry are linked to the disappearance of Rydberg states with increasing ellipticity.
The Coulomb law and atomic levels in a superstrong B
Directory of Open Access Journals (Sweden)
Vysotsky M.I.
2014-04-01
Full Text Available The spectrum of atomic levels of hydrogen-like ions originating from the lowest Landau level in an external homogeneous superstrong magnetic field is obtained. The influence of the screening of the Coulomb potential on the values of critical nuclear charges is studied.
Analytical developments for screening of lanthanides/ligands interactions
International Nuclear Information System (INIS)
Varenne, F.
2012-01-01
This work investigates the potential of hyphenated capillary electrophoresis and inductively coupled mass spectrometry to classify different ligands according to their europium binding affinity in a hydro-organic medium. On the one hand, this method enables to evaluate the affinity of phosphorus-containing ligands in less than two hours and using less than 15 ng of ligand. On the other hand, complexation constants could be determined. The results are in excellent agreement with the values obtained by spectrophotometric titrations.Moreover, a library of copolymers for solid/liquid extraction of europium is investigated. The extraction protocol enables to classify copolymers according to their europium affinity in a hydro-organic medium. This screening requires 60 mg of copolymers. For the most promising recognition properties and selectivity La 3+ /Eu 3+ /Lu 3+ are evaluated. (author)
The Coulomb gap and low energy statistics for Coulomb glasses
International Nuclear Information System (INIS)
Glatz, Andreas; Vinokur, Valerii M; Bergli, Joakim; Kirkengen, Martin; Galperin, Yuri M
2008-01-01
We study the statistics of local energy minima in the configuration space of two-dimensional lattice Coulomb glasses with site disorder and the behavior of the Coulomb gap depending on the strength of random site energies. At intermediate disorder, i.e., when the typical strength of the disorder is of the same order as the nearest-neighbor Coulomb energy, the high energy tail of the distribution of the local minima is exponential. We furthermore analyze the structure of the local minima and show that most sites of the system have the same occupation numbers in all of these states. The density of states (DOS) shows a transition from the crystalline state at zero disorder (with a hard gap) to an intermediate, probably glassy state with a Coulomb gap. We analyze this Coulomb gap in some detail and show that the DOS deviates slightly from the traditional linear behavior in 2D. For finite systems these intermediate Coulomb gap states disappear for large disorder strengths and only a random localized state in which all electrons are in the minima of the random potential exists. Dedication: This paper is dedicated to Thomas Nattermann, our dearest friend, brilliant colleague, and outstanding teacher
Coulomb Mediated Hybridization of Excitons in Coupled Quantum Dots.
Ardelt, P-L; Gawarecki, K; Müller, K; Waeber, A M; Bechtold, A; Oberhofer, K; Daniels, J M; Klotz, F; Bichler, M; Kuhn, T; Krenner, H J; Machnikowski, P; Finley, J J
2016-02-19
We report Coulomb mediated hybridization of excitonic states in optically active InGaAs quantum dot molecules. By probing the optical response of an individual quantum dot molecule as a function of the static electric field applied along the molecular axis, we observe unexpected avoided level crossings that do not arise from the dominant single-particle tunnel coupling. We identify a new few-particle coupling mechanism stemming from Coulomb interactions between different neutral exciton states. Such Coulomb resonances hybridize the exciton wave function over four different electron and hole single-particle orbitals. Comparisons of experimental observations with microscopic eight-band k·p calculations taking into account a realistic quantum dot geometry show good agreement and reveal that the Coulomb resonances arise from broken symmetry in the artificial semiconductor molecule.
Interatomic Coulombic electron capture
International Nuclear Information System (INIS)
Gokhberg, K.; Cederbaum, L. S.
2010-01-01
In a previous publication [K. Gokhberg and L. S. Cederbaum, J. Phys. B 42, 231001 (2009)] we presented the interatomic Coulombic electron capture process--an efficient electron capture mechanism by atoms and ions in the presence of an environment. In the present work we derive and discuss the mechanism in detail. We demonstrate thereby that this mechanism belongs to a family of interatomic electron capture processes driven by electron correlation. In these processes the excess energy released in the capture event is transferred to the environment and used to ionize (or to excite) it. This family includes the processes where the capture is into the lowest or into an excited unoccupied orbital of an atom or ion and proceeds in step with the ionization (or excitation) of the environment, as well as the process where an intermediate autoionizing excited resonance state is formed in the capturing center which subsequently deexcites to a stable state transferring its excess energy to the environment. Detailed derivation of the asymptotic cross sections of these processes is presented. The derived expressions make clear that the environment assisted capture processes can be important for many systems. Illustrative examples are presented for a number of model systems for which the data needed to construct the various capture cross sections are available in the literature.
On the Coulomb displacement energy
International Nuclear Information System (INIS)
Sato, H.
1976-01-01
The Coulomb displacement energies of the T=1/2 mirror nuclei (A=15,17,27,29,31,33,39 and 41) are re-examined with the best available HF wave functions (the DME and the Skyrme II interaction), with the inclusion of all electromagnetic corrections. The results are compared with the experimental s.p. charge dependent energies extracted from the experimental data taking into account admixtures of core-excitation corrections with the help of present shell-model and co-existence model calculations. Although the so-called Nolen-Schiffer anomaly is not removed by these improvements, it is found that the remaining observed anomalies in the ground states of s.p. and s.h. systems can be resolved with the introduction of a simple, phenomenological charge symmetry breaking nucleon-nucleon force. This force can also account for the observed anomalies in the higher excited s.p. states, while those of the deeper s.h. states need further explanation. (Auth.)
Quality control methodology for high-throughput protein-protein interaction screening.
Vazquez, Alexei; Rual, Jean-François; Venkatesan, Kavitha
2011-01-01
Protein-protein interactions are key to many aspects of the cell, including its cytoskeletal structure, the signaling processes in which it is involved, or its metabolism. Failure to form protein complexes or signaling cascades may sometimes translate into pathologic conditions such as cancer or neurodegenerative diseases. The set of all protein interactions between the proteins encoded by an organism constitutes its protein interaction network, representing a scaffold for biological function. Knowing the protein interaction network of an organism, combined with other sources of biological information, can unravel fundamental biological circuits and may help better understand the molecular basics of human diseases. The protein interaction network of an organism can be mapped by combining data obtained from both low-throughput screens, i.e., "one gene at a time" experiments and high-throughput screens, i.e., screens designed to interrogate large sets of proteins at once. In either case, quality controls are required to deal with the inherent imperfect nature of experimental assays. In this chapter, we discuss experimental and statistical methodologies to quantify error rates in high-throughput protein-protein interactions screens.
Existence and consequences of Coulomb pairing of electrons in a solid
International Nuclear Information System (INIS)
Mahajan, S.M.; Thyagaraja, A.
1996-11-01
It is shown from first principles that, in the periodic potential of a crystalline solid, short-range (i.e., screened) binary Coulomb interactions can lead to a two-electron bound state. It is further suggested that these composite bosonic states (charge -2e, and typically spin zero) could mediate an effectively attractive interaction between pairs of conduction electrons close to the Fermi level. This necessarily short range attractive interaction, which is crucially dependent on the band structure of the solid, and is complementary to the phonon-mediated one, may provide a source for the existence and properties of short correlation-length electron pairs (analogous to but distinct from Cooper pairs) needed to understand high temperature superconductivity. Several distinctive and observable characteristics of the proposed pairing scheme are discussed
Kjellander, Roland
2016-09-01
Screened electrostatic interactions in ionic liquids are investigated by means of exact statistical mechanical analysis combined with physical arguments that enhance the transparency and conceptual accessibility of the analysis and results. The constituent ions and immersed particles in the liquid can have arbitrary shapes and any internal charge distributions. The decay of the screened electrostatic potential and the free energy of interaction in ionic liquids can be exponentially damped oscillatory (like in molten simple salts) as well as plain exponential and long-ranged (like in dilute electrolyte solutions). Both behaviors are in agreement with the exact statistical mechanical analysis and reasons for their appearances are investigated. Exact but surprisingly simple expressions for the decay parameter κ of the screened electrostatics are obtained, which replace the classical expression for the Debye-Hückel parameter κDH (the reciprocal Debye length). The expressions are applicable both for cases with plain exponential and oscillatory behaviors. The key importance of nonlocal electrostatics is thereby demonstrated explicitly. Dielectric properties of ionic liquids and other electrolytes are investigated, in particular the static dielectric function ɛ ˜ ( k ) and some effective relative permittivities ( Er eff and Er ∗ ), which take roles that the dielectric constant ɛr has for polar liquids consisting of electroneutral molecules. The dielectric constant in the latter case, which is the limit of ɛ ˜ ( k ) when the wave number k → 0, can be expressed solely in terms of dipolar features of the molecules. In contrast to this, the effective dielectric permittivities of ionic liquids have contributions also from quadrupolar, octupolar, and higher multipolar features of the constituent ions. The "dielectric constant" of electrolytes does not exist since ɛ ˜ ( k ) → ∞ when k → 0, a well-known effect of perfect screening. The effective relative
Dynamical screening of the van der Waals interaction between graphene layers
International Nuclear Information System (INIS)
Dappe, Y J; Bolcatto, P G; Ortega, J; Flores, F
2012-01-01
The interaction between graphene layers is analyzed combining local orbital DFT and second order perturbation theory. For this purpose we use the linear combination of atomic orbitals-orbital occupancy (LCAO-OO) formalism, that allows us to separate the interaction energy as the sum of a weak chemical interaction between graphene layers plus the van der Waals interaction (Dappe et al 2006 Phys. Rev. B 74 205434). In this work, the weak chemical interaction is calculated by means of corrected-LDA calculations using an atomic-like sp 3 d 5 basis set. The van der Waals interaction is calculated by means of second order perturbation theory using an atom-atom interaction approximation and the atomic-like-orbital occupancies. We also analyze the effect of dynamical screening in the van der Waals interaction using a simple model. We find that this dynamical screening reduces by 40% the van der Waals interaction. Taking this effect into account, we obtain a graphene-graphene interaction energy of 70 ± 5 meV/atom in reasonable agreement with the experimental evidence.
Dynamical screening of the van der Waals interaction between graphene layers.
Dappe, Y J; Bolcatto, P G; Ortega, J; Flores, F
2012-10-24
The interaction between graphene layers is analyzed combining local orbital DFT and second order perturbation theory. For this purpose we use the linear combination of atomic orbitals-orbital occupancy (LCAO-OO) formalism, that allows us to separate the interaction energy as the sum of a weak chemical interaction between graphene layers plus the van der Waals interaction (Dappe et al 2006 Phys. Rev. B 74 205434). In this work, the weak chemical interaction is calculated by means of corrected-LDA calculations using an atomic-like sp(3)d(5) basis set. The van der Waals interaction is calculated by means of second order perturbation theory using an atom-atom interaction approximation and the atomic-like-orbital occupancies. We also analyze the effect of dynamical screening in the van der Waals interaction using a simple model. We find that this dynamical screening reduces by 40% the van der Waals interaction. Taking this effect into account, we obtain a graphene-graphene interaction energy of 70 ± 5 meV/atom in reasonable agreement with the experimental evidence.
Moon, Byoung Hee; Bae, Jung Jun; Joo, Min-Kyu; Choi, Homin; Han, Gang Hee; Lim, Hanjo; Lee, Young Hee
2018-05-24
Quantum localization-delocalization of carriers are well described by either carrier-carrier interaction or disorder. When both effects come into play, however, a comprehensive understanding is not well established mainly due to complexity and sparse experimental data. Recently developed two-dimensional layered materials are ideal in describing such mesoscopic critical phenomena as they have both strong interactions and disorder. The transport in the insulating phase is well described by the soft Coulomb gap picture, which demonstrates the contribution of both interactions and disorder. Using this picture, we demonstrate the critical power law behavior of the localization length, supporting quantum criticality. We observe asymmetric critical exponents around the metal-insulator transition through temperature scaling analysis, which originates from poor screening in insulating regime and conversely strong screening in metallic regime due to free carriers. The effect of asymmetric scaling behavior is weakened in monolayer MoS 2 due to a dominating disorder.
Hyperon excitation in nuclear coulomb field
International Nuclear Information System (INIS)
Vanyashin, A.V.; Nikitin, Yu.P.; Shan'gin, A.A.
1981-01-01
A possibility is studied to measure radiative decay partial widths from the 3/2 + decuplet hyperon resonances by means of the Coulomb excitation method of the octet hyperons. The expected contributions from the strong and electromagnetic interactions in the coherence range to the hyperon excitation cross sections on heavy nuclei and on the 4 He nucleus are estimated. The particle angular distributions in the reactions Σ-+A→Σ-(1385)+A and Λ+A→Σ 0 (1385)+A are analysed in order to determine the energy range where the background conditions are the most favorable to extract the electromagnetic mechanism of the hyperon excitation [ru
NMR characterization of weak interactions between RhoGDI2 and fragment screening hits.
Liu, Jiuyang; Gao, Jia; Li, Fudong; Ma, Rongsheng; Wei, Qingtao; Wang, Aidong; Wu, Jihui; Ruan, Ke
2017-01-01
The delineation of intrinsically weak interactions between novel targets and fragment screening hits has long limited the pace of hit-to-lead evolution. Rho guanine-nucleotide dissociation inhibitor 2 (RhoGDI2) is a novel target that lacks any chemical probes for the treatment of tumor metastasis. Protein-observed and ligand-observed NMR spectroscopy was used to characterize the weak interactions between RhoGDI2 and fragment screening hits. We identified three hits of RhoGDI2 using streamlined NMR fragment-based screening. The binding site residues were assigned using non-uniformly sampled C α - and H α -based three dimensional NMR spectra. The molecular docking to the proposed geranylgeranyl binding pocket of RhoGDI2 was guided by NMR restraints of chemical shift perturbations and ligand-observed transferred paramagnetic relaxation enhancement. We further validated the weak RhoGDI2-hit interactions using mutagenesis and structure-affinity analysis. Weak interactions between RhoGDI2 and fragment screening hits were delineated using an integrated NMR approach. Binders to RhoGDI2 as a potential anti-cancer target have been first reported, and their weak interactions were depicted using NMR spectroscopy. Our work highlights the powerfulness and the versatility of the integrative NMR techniques to provide valuable structural insight into the intrinsically weak interactions between RhoGDI2 and the fragment screening hits, which could hardly be conceived using other biochemical techniques. Copyright Â© 2016 Elsevier B.V. All rights reserved.
Lee, Sung Heum; Boling, Elizabeth
1999-01-01
Identifies guidelines from the literature relating to screen design and design of interactive instructional materials. Describes two types of guidelines--those aimed at enhancing motivation and those aimed at preventing loss of motivation--for typography, graphics, color, and animation and audio. Proposes a framework for considering motivation in…
Coulomb branches with complex singularities
Argyres, Philip C.; Martone, Mario
2018-06-01
We construct 4d superconformal field theories (SCFTs) whose Coulomb branches have singular complex structures. This implies, in particular, that their Coulomb branch coordinate rings are not freely generated. Our construction also gives examples of distinct SCFTs which have identical moduli space (Coulomb, Higgs, and mixed branch) geometries. These SCFTs thus provide an interesting arena in which to test the relationship between moduli space geometries and conformal field theory data. We construct these SCFTs by gauging certain discrete global symmetries of N = 4 superYang-Mills (sYM) theories. In the simplest cases, these discrete symmetries are outer automorphisms of the sYM gauge group, and so these theories have lagrangian descriptions as N = 4 sYM theories with disconnected gauge groups.
Radiative capture versus Coulomb dissociation
International Nuclear Information System (INIS)
Esbensen, H.; Physics
2006-01-01
Measurements of the Coulomb dissociation of 8 B have been used to infer the rate of the inverse radiative proton capture on 7 Be. The analysis is usually based on the assumptions that the two processes are related by detailed balance and described by E1 transitions. However, there are corrections to this relation. The Coulomb form factors for the two processes, for example, are not identical. There are also E2 transitions and higher-order effects in the Coulomb dissociation, and the nuclear induced breakup cannot always be ignored. While adding first-order E2 transitions enhances the decay energy spectrum, the other mechanisms cause a suppression at low relative energies. The net result may accidentally be close to the conventional first-order E1 calculation, but there are differences which cannot be ignored if accuracies of 10% or better are needed
Radiative Capture versus Coulomb Dissociation
International Nuclear Information System (INIS)
Esbensen, Henning
2006-01-01
Measurements of the Coulomb dissociation of 8B have been used to infer the rate of the inverse radiative proton capture on 7Be. The analysis is usually based on the assumptions that the two processes are related by detailed balance and described by E1 transitions. However, there are corrections to this relation. The Coulomb form factors for the two processes, for example, are not identical. There are also E2 transitions and higher-order effects in the Coulomb dissociation, and the nuclear induced breakup cannot always be ignored. While adding first-order E2 transitions enhances the decay energy spectrum, the other mechanisms cause a suppression at low relative energies. The net result may accidentally be close to the conventional first-order E1 calculation, but there are differences which cannot be ignored if accuracies of 10% or better are needed
Dynamic plasma screening effects on atomic collisions in dense plasmas
International Nuclear Information System (INIS)
Young-Dae Jung
1999-01-01
Dynamic plasma screening effects are investigated on electron-ion collisional excitation and Coulomb Bremsstrahlung processes in dense plasmas. The electron-ion interaction potential is considered by introduction of the plasma dielectric function. The straight-ling trajectory method is applied to the path of the projectile electron. The transition probability including the dynamic plasma screening effect is found to be always greater than that including the static plasma screening effects. It is found that the differential Bremsstrahlung radiation cross section including the dynamic plasma screening effect is also greater than that including the static plasma screening effect. When the projectile velocity is smaller than the electron thermal velocity, the dynamic polarization screening effect becomes the static plasma screening effect. However, when the projectile velocity is greater than the electron thermal velocity, the interaction potential is almost unshielded
Gauge orbits and the Coulomb potential
International Nuclear Information System (INIS)
Greensite, J.
2009-01-01
If the color Coulomb potential is confining, then the Coulomb field energy of an isolated color charge is infinite on an infinite lattice, even if the usual UV divergence is lattice regulated. A simple criterion for Coulomb confinement is that the expectation value of timelike link variables vanishes in the Coulomb gauge, but it is unclear how this criterion is related to the spectrum of the corresponding Faddeev-Popov operator, which can be used to formulate a quite different criterion for Coulomb confinement. The purpose of this article is to connect the two seemingly different Coulomb confinement criteria, and explain the geometrical basis of the connection.
Pseudo-Coulomb potential in singlet superconductivity
International Nuclear Information System (INIS)
Daemen, L.L.; Overhauser, A.W.
1988-01-01
Reduction of the screened Coulomb potential parameter μ to μ/sup */ = μ/[1+μ ln(E/sub F//(h/2π)ω/sub D/)] is related to the pair correlation function at r = 0. This correlation function is calculated for both the simple Cooper-pair problem and standard Bardeen-Cooper-Schrieffer (BCS) theory by use of a two-square-well model (with λ and μ describing the attraction and repulsion). Results are compared with values obtained for a one-square-well model (having the suitable net attraction, e.g., λ-μ/sup */ in the BCS case). For the BCS case, the ''true'' pair correlation at r = 0 is reduced by a factor (μ/sup *//μ) 2 relative to the fictitious (one-square-well) value (even though Δ is the same for both models). The reduction factor is typically ≅(1/25. It follows that any short-range attractive contribution to superconducting pairing will suffer a reduction similar to that for the Coulomb repulsion
International Nuclear Information System (INIS)
Brandao, S.B.
1987-01-01
The level structure of 189 Os has been studied by Coulomb excitation using 35 Cl, 28 Si, 16 O beams. GOSIA, a code written to analyze multiple Coulomb excitation, was used to obtain the reduced probabilities of transition B(E2). The results for interband and intraband turned out possible the classification of the states following Nilsson levels. Gamma-rays originating from deexcitation of 216.7 and 219.4 keV have been separated and the reduced probability of transition has been measured. (A.C.A.S.) [pt
Surblys, Donatas; Leroy, Frédéric; Yamaguchi, Yasutaka; Müller-Plathe, Florian
2018-04-01
We investigated the solid-liquid work of adhesion of water on a model silica surface by molecular dynamics simulations, where a methodology previously developed to determine the work of adhesion through thermodynamic integration was extended to a system with long-range electrostatic interactions between solid and liquid. In agreement with previous studies, the work of adhesion increased when the magnitude of the surface polarity was increased. On the other hand, we found that when comparing two systems with and without solid-liquid electrostatic interactions, which were set to have approximately the same total solid-liquid interfacial energy, former had a significantly smaller work of adhesion and a broader distribution in the interfacial energies, which has not been previously reported in detail. This was explained by the entropy contribution to the adhesion free energy; i.e., the former with a broader energy distribution had a larger interfacial entropy than the latter. While the entropy contribution to the work of adhesion has already been known, as a work of adhesion itself is free energy, these results indicate that, contrary to common belief, wetting behavior such as the contact angle is not only governed by the interfacial energy but also significantly affected by the interfacial entropy. Finally, a new interpretation of interfacial entropy in the context of solid-liquid energy variance was offered, from which a fast way to qualitatively estimate the work of adhesion was also presented.
Gowthaman, Ragul; Miller, Sven A; Rogers, Steven; Khowsathit, Jittasak; Lan, Lan; Bai, Nan; Johnson, David K; Liu, Chunjing; Xu, Liang; Anbanandam, Asokan; Aubé, Jeffrey; Roy, Anuradha; Karanicolas, John
2016-05-12
Protein-protein interactions represent an exciting and challenging target class for therapeutic intervention using small molecules. Protein interaction sites are often devoid of the deep surface pockets presented by "traditional" drug targets, and crystal structures reveal that inhibitors typically engage these sites using very shallow binding modes. As a consequence, modern virtual screening tools developed to identify inhibitors of traditional drug targets do not perform as well when they are instead deployed at protein interaction sites. To address the need for novel inhibitors of important protein interactions, here we introduce an alternate docking strategy specifically designed for this regime. Our method, termed DARC (Docking Approach using Ray-Casting), matches the topography of a surface pocket "observed" from within the protein to the topography "observed" when viewing a potential ligand from the same vantage point. We applied DARC to carry out a virtual screen against the protein interaction site of human antiapoptotic protein Mcl-1 and found that four of the top-scoring 21 compounds showed clear inhibition in a biochemical assay. The Ki values for these compounds ranged from 1.2 to 21 μM, and each had ligand efficiency comparable to promising small-molecule inhibitors of other protein-protein interactions. These hit compounds do not resemble the natural (protein) binding partner of Mcl-1, nor do they resemble any known inhibitors of Mcl-1. Our results thus demonstrate the utility of DARC for identifying novel inhibitors of protein-protein interactions.
Plasmon-mediated Coulomb drag between graphene waveguides
DEFF Research Database (Denmark)
Shylau, Artsem A.; Jauho, Antti-Pekka
2014-01-01
We analyze theoretically charge transport in Coulomb coupled graphene waveguides (GWGs). The GWGs are defined using antidot lattices, and the lateral geometry bypasses many technological challenges of earlier designs. The drag resistivity ρD, which is a measure of the many-particle interactions...
Role of Coulomb repulsion in multilayer cuprate superconductor
International Nuclear Information System (INIS)
Singh Chauhan, Ekta; Singh, Vipul; Masih, Piyush
2012-01-01
Although BCS theory completely neglects coulomb repulsion; Anderson and Morel showed very early that it plays a central role in superconductivity. Since all high T c superconductors are based on the structure of closely spaced square planner CuO 2 layers and role of interlayer interaction plays important role in enhancement of T c . Therefore the work has been dealt with 'Role of Coulomb repulsion in Multilayer Cuprate Superconductors'. An expression for transition temperature T c is obtained by using simple integration technique and is numerically solved. It has found that T c decreases with electronic repulsion. (author)
Coulomb effects in relativistic laser-assisted Mott scattering
International Nuclear Information System (INIS)
Ngoko Djiokap, J.M.; Kwato Njock, M.G.; Tetchou Nganso, H.M.
2004-09-01
We reconsider the influence of the Coulomb interaction on the process of relativistic Mott scattering in a powerful electromagnetic plane wave for which the ponderomotive energy is of the order of the magnitude of the electron's rest mass. Coulomb effects of the bare nucleus on the laser-dressed electron are treated more completely than in the previous work of Li et al. [J. Phys. B: At. Mol. Opt. Phys. 37 (2004) 653]. To this end we use Coulomb-Dirac-Volkov functions to describe the initial and the final states of the electron. First-order Born differential cross sections of induced and inverse bremsstrahlung are obtained for circularly and linearly polarized laser light. Numerical calculations are carried out from both polarizations, for various nucleus charge values, three angular configurations and an incident energy in the MeV range. It is found that for parameters used in the present work, incorporating Coulomb effects of the target nucleus either in the initial state or in the final state yields cross sections which are quite similar whatever the scattering geometry and polarization considered. When Coulomb distortions are included in both states, the cross sections are strongly modified with the increase of Z, as compared to the outcome of the prior form of the T-matrix treatment. (author)
A Tendon Cell Specific RNAi Screen Reveals Novel Candidates Essential for Muscle Tendon Interaction.
Directory of Open Access Journals (Sweden)
Prabhat Tiwari
Full Text Available Tendons are fibrous connective tissue which connect muscles to the skeletal elements thus acting as passive transmitters of force during locomotion and provide appropriate body posture. Tendon-derived cues, albeit poorly understood, are necessary for proper muscle guidance and attachment during development. In the present study, we used dorsal longitudinal muscles of Drosophila and their tendon attachment sites to unravel the molecular nature of interactions between muscles and tendons. We performed a genetic screen using RNAi-mediated knockdown in tendon cells to find out molecular players involved in the formation and maintenance of myotendinous junction and found 21 candidates out of 2507 RNAi lines screened. Of these, 19 were novel molecules in context of myotendinous system. Integrin-βPS and Talin, picked as candidates in this screen, are known to play important role in the cell-cell interaction and myotendinous junction formation validating our screen. We have found candidates with enzymatic function, transcription activity, cell adhesion, protein folding and intracellular transport function. Tango1, an ER exit protein involved in collagen secretion was identified as a candidate molecule involved in the formation of myotendinous junction. Tango1 knockdown was found to affect development of muscle attachment sites and formation of myotendinous junction. Tango1 was also found to be involved in secretion of Viking (Collagen type IV and BM-40 from hemocytes and fat cells.
Planar density of vacuum charge induced by a supercritical Coulomb potential
Energy Technology Data Exchange (ETDEWEB)
Khalilov, V.R., E-mail: khalilov@phys.msu.ru; Mamsurov, I.V.
2017-06-10
Analytical expressions for the planar density of an induced vacuum charge are obtained in a strong Coulomb potential in coordinate space. Treatment is based on a self-adjoint extension approach for constructing of the Green's function of a charged fermion in an external electromagnetic field. Induced vacuum charge density is calculated and analyzed in subcritical and supercritical Coulomb potentials for massless and massive fermions. We argue that the virtual and so-called real vacuum polarizations contribute in an induced vacuum charge in a supercritical Coulomb potential. The behavior of the polarization vacuum charge density is investigated at long and short distances from the Coulomb center. The induced vacuum charge has a screening sign. Screening of a Coulomb impurity in graphene is briefly discussed. The real vacuum polarization charge density that acquires the quantum electrodynamics vacuum in a supercritical Coulomb potential due to the real vacuum polarization is calculated. It is shown that the vacuum charge densities essentially differ in massive and massless cases. We expect that our results can, as a matter of principle, be tested in graphene with a supercritical Coulomb impurity.
Planar density of vacuum charge induced by a supercritical Coulomb potential
Directory of Open Access Journals (Sweden)
V.R. Khalilov
2017-06-01
Full Text Available Analytical expressions for the planar density of an induced vacuum charge are obtained in a strong Coulomb potential in coordinate space. Treatment is based on a self-adjoint extension approach for constructing of the Green's function of a charged fermion in an external electromagnetic field. Induced vacuum charge density is calculated and analyzed in subcritical and supercritical Coulomb potentials for massless and massive fermions. We argue that the virtual and so-called real vacuum polarizations contribute in an induced vacuum charge in a supercritical Coulomb potential. The behavior of the polarization vacuum charge density is investigated at long and short distances from the Coulomb center. The induced vacuum charge has a screening sign. Screening of a Coulomb impurity in graphene is briefly discussed. The real vacuum polarization charge density that acquires the quantum electrodynamics vacuum in a supercritical Coulomb potential due to the real vacuum polarization is calculated. It is shown that the vacuum charge densities essentially differ in massive and massless cases. We expect that our results can, as a matter of principle, be tested in graphene with a supercritical Coulomb impurity.
Gabovich, A. M.; Il'chenko, L. G.; Pashitskii, E. A.; Romanov, Yu. A.
1980-04-01
Using the Poisson equation Green function for a self-consistent field in a spatially inhomogeneous system, expressions for the electrostatic energy and screened charge interaction near the surface of a semi-infinite metal and a thin quantizing film are derived. It is shown that the decrease law and Friedel oscillation amplitude of adsorbed atom indirect interaction are determined by the electron spectrum character and the Fermi surface shape. The results obtained enable us to explain, in particular, the submonolayer adsorbed film structure on the W and Mo surfaces.
Heat Coulomb blockade of one ballistic channel
Sivre, E.; Anthore, A.; Parmentier, F. D.; Cavanna, A.; Gennser, U.; Ouerghi, A.; Jin, Y.; Pierre, F.
2018-02-01
Quantum mechanics and Coulomb interaction dictate the behaviour of small circuits. The thermal implications cover fundamental topics from quantum control of heat to quantum thermodynamics, with prospects of novel thermal machines and an ineluctably growing influence on nanocircuit engineering. Experimentally, the rare observations thus far include the universal thermal conductance quantum and heat interferometry. However, evidence for many-body thermal effects paving the way to markedly different heat and electrical behaviours in quantum circuits remains wanting. Here we report on the observation of the Coulomb blockade of electronic heat flow from a small metallic circuit node, beyond the widespread Wiedemann-Franz law paradigm. We demonstrate this thermal many-body phenomenon for perfect (ballistic) conduction channels to the node, where it amounts to the universal suppression of precisely one quantum of conductance for the transport of heat, but none for electricity. The inter-channel correlations that give rise to such selective heat current reduction emerge from local charge conservation, in the floating node over the full thermal frequency range (laws for thermal transport in nanocircuits.
Lee, Jiyon; Hardesty, Lara A; Kunzler, Nathan M; Rosenkrantz, Andrew B
2016-01-01
Anxiety has been called a "harm" of screening mammography. The authors provided direct, interactive education to lay audiences and measured these sessions' impact on anxiety and any increased understanding of breast cancer screening. Academic breast radiologist provided seven 1-hour sessions of structured lectures and question-and-answer periods. Lay language and radiologic images were used to discuss disease background, screening guidelines, and areas of debate. One hundred seventeen participants (mean age, 45 ± 15 years) completed voluntary, anonymous, institutional review board-approved pre and postsession questionnaires relaying their attitudes regarding screening and the impact of the sessions. Results are summarized descriptively. Mean reported anxiety regarding screening (on a scale ranging from 1-5; 1 = no anxiety) was 2.5 ± 1.3. Anxiety was attributed to unknown results (56.4%), anticipation of pain (21.8%), known risk factors (14.5%), general uncertainty (12.7%), waiting for results (9.1%), possibility of more procedures (3.6%), and personal breast cancer history (3.6%). Ninety-seven percent reported that immediate results would lower anxiety (78% of those women indicated a 75%-100% decrease in anxiety); 93% reported that radiologist consultation with images would lower anxiety (75.6% indicated a 75%-100% decrease in anxiety). After the lecture, women reported (on a scale ranging from 1-5) increased understanding of the topic (4.7 ± 0.6), encouragement to screen (4.6 ± 0.7), and reduced anxiety (4.0 ± 1.1). Ninety-seven percent to 100% provided correct responses to these questions: rationale for screening in the absence of family history, recall does not equate to cancer diagnosis, benefit of prior films, and continued importance of physical examination. Attendees of radiologist-provided direct public lectures reported decreased anxiety and improved knowledge regarding screening mammography. The resultant reduced anxiety ("harm") and educational
Directory of Open Access Journals (Sweden)
Riby Abraham Boby
2017-05-01
Full Text Available This article focuses on the implementation details of a portable interactive device called Image-projective Desktop Varnamala Trainer. The device uses a projector to produce a virtual display on a flat surface. For enabling interaction, the information about a user’s hand movement is obtained from a single two-dimensional scanning laser range finder in contrast with a camera sensor used in many earlier applications. A generalized calibration process to obtain exact transformation from projected screen coordinate system to sensor coordinate system is proposed in this article and implemented for enabling interaction. This permits production of large interactive displays with minimal cost. Additionally, it makes the entire system portable, that is, display can be produced on any planar surface like floor, tabletop, and so on. The calibration and its performance have been evaluated by varying screen sizes and the number of points used for calibration. The device was successfully calibrated for different screens. A novel learning-based methodology for predicting a user’s behaviour was then realized to improve the system’s performance. This has been experimentally evaluated, and the overall accuracy of prediction was about 96%. An application was then designed for this set-up to improve the learning of alphabets by the children through an interactive audiovisual feedback system. It uses a game-based methodology to help students learn in a fun way. Currently, it has bilingual (Hindi and English user interface to enable learning of alphabets and elementary mathematics. A user survey was conducted after demonstrating it to school children. The survey results are very encouraging. Additionally, a study to ascertain the improvement in the learning outcome of the children was done. The results clearly indicate an improvement in the learning outcome of the children who used the device over those who did not.
Directory of Open Access Journals (Sweden)
Angela Simeone
2014-09-01
Full Text Available Functional genomics screens using multi-parametric assays are powerful approaches for identifying genes involved in particular cellular processes. However, they suffer from problems like noise, and often provide little insight into molecular mechanisms. A bottleneck for addressing these issues is the lack of computational methods for the systematic integration of multi-parametric phenotypic datasets with molecular interactions. Here, we present Integrative Multi Profile Analysis of Cellular Traits (IMPACT. The main goal of IMPACT is to identify the most consistent phenotypic profile among interacting genes. This approach utilizes two types of external information: sets of related genes (IMPACT-sets and network information (IMPACT-modules. Based on the notion that interacting genes are more likely to be involved in similar functions than non-interacting genes, this data is used as a prior to inform the filtering of phenotypic profiles that are similar among interacting genes. IMPACT-sets selects the most frequent profile among a set of related genes. IMPACT-modules identifies sub-networks containing genes with similar phenotype profiles. The statistical significance of these selections is subsequently quantified via permutations of the data. IMPACT (1 handles multiple profiles per gene, (2 rescues genes with weak phenotypes and (3 accounts for multiple biases e.g. caused by the network topology. Application to a genome-wide RNAi screen on endocytosis showed that IMPACT improved the recovery of known endocytosis-related genes, decreased off-target effects, and detected consistent phenotypes. Those findings were confirmed by rescreening 468 genes. Additionally we validated an unexpected influence of the IGF-receptor on EGF-endocytosis. IMPACT facilitates the selection of high-quality phenotypic profiles using different types of independent information, thereby supporting the molecular interpretation of functional screens.
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Sylvie Viaux-Savelon
Full Text Available In up to 5% of pregnancies, ultrasound screening detects a "soft marker" (SM that places the foetus at risk for a severe abnormality. In most cases, prenatal diagnostic work-up rules out a severe defect. We aimed to study the effects of false positive SM on maternal emotional status, maternal representations of the infant, and mother-infant interaction.Utilizing an extreme-case prospective case control design, we selected from a group of 244 women undergoing ultrasound, 19 pregnant women whose foetus had a positive SM screening and a reassuring diagnostic work up, and 19 controls without SM matched for age and education. In the third trimester of pregnancy, within one week after delivery, and 2 months postpartum, we assessed anxiety, depression, and maternal representations. Mother-infant interactions were videotaped during feeding within one week after delivery and again at 2 months postpartum and coded blindly using the Coding Interactive Behavior (CIB scales. Anxiety and depression scores were significantly higher at all assessment points in the SM group. Maternal representations were also different between SM and control groups at all study time. Perturbations to early mother-infant interactions were observed in the SM group. These dyads showed greater dysregulation, lower maternal sensitivity, higher maternal intrusive behaviour and higher infant avoidance. Multivariate analysis showed that maternal representation and depression at third trimester predicted mother-infant interaction.False positive ultrasound screenings for SM are not benign and negatively affect the developing maternal-infant attachment. Medical efforts should be directed to minimize as much as possible such false diagnoses, and to limit their psychological adverse consequences.
Ordering in classical Coulombic systems
International Nuclear Information System (INIS)
Schiffer, J. P.
1998-01-01
The author discusses the properties of classical Coulombic matter at low temperatures. It has been well known for some time [1,2] that infinite Coulombic matter will crystallize in body-centered cubic form when the quantity Λ (the dimensionless ratio of the average two-particle Coulomb energy to the kinetic energy per particle) is larger than approximately175. But the systems of such particles that have been produced in the laboratory in ion traps, or ion beams, are finite with surfaces defined by the boundary conditions that have to be satisfied. This results in ion clouds with sharply defined curved surfaces, and interior structures that show up as a set of concentric layers that are parallel to the outer surface. The ordering does not appear to be cubic, but the charges on each shell exhibit a ''hexatic'' pattern of equilateral triangles that is the characteristic of liquid crystals. The curvature of the surfaces prevents the structures on successive shells from interlocking in any simple fashion. This class of structures was first found in simulations [3] and later in experiments [4
Local simulation algorithms for Coulombic interactions
Indian Academy of Sciences (India)
electrostatic potential, so that Monte Carlo methods must (apparently) lead to .... where ∆0 is chosen so that the Monte Carlo acceptance probability of this move is ... Debye–Hückel theory applied to a lattice gas gives the following expression.
Coulomb corrections to nuclear scattering lengths and effective ranges for weakly bound systems
International Nuclear Information System (INIS)
Mur, V.D.; Popov, V.S.; Sergeev, A.V.
1996-01-01
A procedure is considered for extracting the purely nuclear scattering length as and effective range rs (which correspond to a strong-interaction potential Vs with disregarded Coulomb interaction) from the experimentally determined nuclear quantities acs and rcs, which are modified by Coulomb interaction. The Coulomb renormalization of as and rs is especially strong if the system under study involves a level with energy close to zero (on the nuclear scale). This applies to formulas that determine the Coulomb renormalization of the low-energy parameters of s scattering (l=0). Detailed numerical calculations are performed for coefficients appearing in the equations that determine Coulomb corrections for various models of the potential Vs(r). This makes it possible to draw qualitative conclusions that the dependence of Coulomb corrections on the form of the strong-interaction potential and, in particular, on its small-distance behavior. A considerable enhancement of Coulomb corrections to the effective range rs is found for potentials with a barrier
Exclusion of nuclear forces in heavy-ion Coulomb excitation and Coulomb fission experiments
International Nuclear Information System (INIS)
Neese, R.E.; Guidry, M.W.
1982-01-01
A simple prescription for estimating the energy at which nuclear forces begin to play a role in heavy-ion Coulomb excitation and Coulomb fission experiments is presented. The method differs from most commonly used recipes in accounting for projectile and target nucleus deformation effects. Using a single adjustable parameter the formula reproduces the energy for the onset of Coulomb-nuclear interference effects for a broad range of heavy-ion systems. It is suggested that most Coulomb fission experiments which have been done involve both Coulomb and nuclear excitation processes and should more properly be termed Coulomb-nuclear fission experiments
Effects of final-state interaction and screening on strange and heavy quark production
Energy Technology Data Exchange (ETDEWEB)
Wong, Cheuk-Yin [Oak Ridge National Lab., TN (United States); Chatterjee, L. [Oak Ridge National Lab., TN (United States)]|[Tennessee Univ., Knoxville, TN (United States)]|[Jadavpur Univ., Calcutta (India)
1996-10-01
Final-state interaction and screening have a great influence on {ital q{anti q}} production cross sections, which are important quantities in many problems in quark-gluon plasma physics. They lead to an enhancement of the cross section for a {ital q{anti q}} color-singlet state and a suppression for a color-octet state. The effects are large near the production threshold. The presence of screening gives rise to resonances for {ital q{anti q}} production just above the threshold at specific plasma temperatures. These resonances, especially {ital c{anti c}} and {ital b{anti b}} resonances, may be utilized to search for the quark-gluon plasma by studying the temperature dependence of heavy-quark pair production just above the threshold.
Charge-carrier dynamics and Coulomb effects in semiconductor tetrapods
International Nuclear Information System (INIS)
Mauser, Christian
2011-01-01
In this thesis the Coulomb interaction and its influence on localization effects and dynamics of charge carriers in semiconductor nanocrystals were studied. In the studied nanostructures it deals with colloidal tetrapod heterostructures, which consist of a cadmium selenide (CdSe) core and four tetraedrical grown cadmium sulfide (CdS) respectively cadmium telluride (CdTe) legs, which exhibit a type-I respectively type-II band transition. The dynamics and interactions were studied by means of photoluminescence (PL) and absorption measurements both on the ensemble and on single nanoparticles, as well as time-resolved PL and transient absorption spectroscopy. Additionally theoretical simulations of the wave-function distributions were performed, which are based on the effective-mass approximation. The special band structure of the CdSe/CdS tetrapods offers a unique possibility to study the Coulomb interaction. The flat conduction band in these heterostructures makes the electron via the Coulomb interaction sensitive to the localization position of the hole within the structure. The valence band has instead a potential maximum in the CdSe, which leads to a directed localization of the hole and the photoluminescence of the core. Polarization-resolved measurements showed hereby an anisotropy of the photoluminescence, which could be explained by means of simulations of the wave-function distribution with an asymmetry at the branching point. Charge-carrier localization occur mainly both in longer structures and in trap states in the CdS leg and can be demonstrated in form of a dual emission from a nanocrystal. The charge-carrier dynamics of electron and hole in tetrapods is indeed coupled by the Coulomb interaction, however it cannot be completely described in an exciton picture. The coupled dynamics and the Coulomb interaction were studied concerning a possible influence of the geometry in CdSe/CdS nanorods and compared with those of the tetrapods. The interactions of the
de Boer, Jan; van Blitterswijk, Clemens; Unadkat, H.V.; Stamatialis, Dimitrios; Papenburg, B.J.; Wessling, Matthias
2009-01-01
The invention is directed to a high throughput screening method for analysing and interaction between a surface of a material and an environment. The screening method of the invention comprises: providing a micro-array comprising said material and having a multitude of units at least part of which
Shin, Dong-Hee; An, Hyeri; Kim, Jang Hyun
2016-01-01
The use of a second screen can enhance information processing and the execution of search tasks within a given period. In this study, we examined the learner's attentional shift (AS) between two screens and controlled secondary tasks (STs) in the media multitasking setting and its effect on the learning process. In particular, we analyzed how…
A modifier screen for Bazooka/PAR-3 interacting genes in the Drosophila embryo epithelium.
Directory of Open Access Journals (Sweden)
Wei Shao
2010-04-01
Full Text Available The development and homeostasis of multicellular organisms depends on sheets of epithelial cells. Bazooka (Baz; PAR-3 localizes to the apical circumference of epithelial cells and is a key hub in the protein interaction network regulating epithelial structure. We sought to identify additional proteins that function with Baz to regulate epithelial structure in the Drosophila embryo.The baz zygotic mutant cuticle phenotype could be dominantly enhanced by loss of known interaction partners. To identify additional enhancers, we screened molecularly defined chromosome 2 and 3 deficiencies. 37 deficiencies acted as strong dominant enhancers. Using deficiency mapping, bioinformatics, and available single gene mutations, we identified 17 interacting genes encoding known and predicted polarity, cytoskeletal, transmembrane, trafficking and signaling proteins. For each gene, their loss of function enhanced adherens junction defects in zygotic baz mutants during early embryogenesis. To further evaluate involvement in epithelial polarity, we generated GFP fusion proteins for 15 of the genes which had not been found to localize to the apical domain previously. We found that GFP fusion proteins for Drosophila ASAP, Arf79F, CG11210, Septin 5 and Sds22 could be recruited to the apical circumference of epithelial cells. Nine of the other proteins showed various intracellular distributions, and one was not detected.Our enhancer screen identified 17 genes that function with Baz to regulate epithelial structure in the Drosophila embryo. Our secondary localization screen indicated that some of the proteins may affect epithelial cell polarity by acting at the apical cell cortex while others may act through intracellular processes. For 13 of the 17 genes, this is the first report of a link to baz or the regulation of epithelial structure.
Jones, Denise R.; Parrish, Russell V.
1990-01-01
A piloted simulation study was conducted comparing three different input methods for interfacing to a large screen, multiwindow, whole flight deck display for management of transport aircraft systems. The thumball concept utilized a miniature trackball embedded in a conventional side arm controller. The multifunction control throttle and stick (MCTAS) concept employed a thumb switch located in the throttle handle. The touch screen concept provided data entry through a capacitive touch screen installed on the display surface. The objective and subjective results obtained indicate that, with present implementations, the thumball concept was the most appropriate for interfacing with aircraft systems/subsystems presented on a large screen display. Not unexpectedly, the completion time differences between the three concepts varied with the task being performed, although the thumball implementation consistently outperformed the other two concepts. However, pilot suggestions for improved implementations of the MCTAS and touch screen concepts could reduce some of these differences.
Last, Isidore; Jortner, Joshua
2004-11-01
In this paper we present a theoretical and computational study of the temporal dynamics and energetics of Coulomb explosion of (CD4)(n) and (CH4)(n) (n=55-4213) molecular heteroclusters in ultraintense (I=10(16)-10(19) W cm(-2)) laser fields, addressing the manifestation of electron dynamics, together with nuclear energetic and kinematic effects on the heterocluster Coulomb instability. The manifestations of the coupling between electron and nuclear dynamics were explored by molecular dynamics simulations for these heteroclusters coupled to Gaussian laser fields (pulse width tau=25 fs), elucidating outer ionization dynamics, nanoplasma screening effects (being significant for Icharges and masses. Nonuniform heterocluster Coulomb explosion (eta >1) manifests an overrun effect of the light ions relative to the heavy ions, exhibiting the expansion of two spatially separated subclusters, with the light ions forming the outer subcluster at the outer edge of the spatial distribution. Important features of the energetics of heterocluster Coulomb explosion originate from energetic triggering effects of the driving of the light ions by the heavy ions (C(4+) for I=10(17)-10(18) W cm(-2) and C(6+) for I=10(19) W cm(-2)), as well as for kinematic effects. Based on the CVI assumption, scaling laws for the cluster size (radius R(0)) dependence of the energetics of uniform Coulomb explosion of heteroclusters (eta=1) were derived, with the size dependence of the average (E(j,av)) and maximal (E(j,M)) ion energies being E(j,av)=aR(0) (2) and E(j,M)=(5a/3)R(0) (2), as well as for the ion energy distributions P(E(j)) proportional to E(j) (1/2); E(j)1) result in an isotope effect, predicting the enhancement (by 9%-11%) of E(H,av) for Coulomb explosion of (C(4+)H(4) (+))(eta) (eta=3) relative to E(D,av) for Coulomb explosion of (C(4+)D(4) (+))(eta) (eta=1.5), with the isotope effect being determined by the ratio of the kinematic parameters for the pair of Coulomb exploding clusters
Coulomb blockade induced by magnetic field
International Nuclear Information System (INIS)
Kusmartsev, F.V.
1992-01-01
In this paper, the authors found that a Coulomb blockade can be induced by magnetic field. The authors illustrated this effect on the example of a ring consisting of two and many Josephson junctions. For the ring with two junctions we present an exact solution. The transition into Coulomb blockade state on a ring transforms into a linear array of Josephson junctions, although in latter case the effect of magnetic field disappears. In the state of Coulomb blockade the magnetization may be both diamagnetic and paramagnetic. The Coulomb blockade may also be removed by external magnetic field
Directory of Open Access Journals (Sweden)
Saleem Jason J
2011-11-01
Full Text Available Abstract Background Based on barriers to the use of computerized clinical decision support (CDS learned in an earlier field study, we prototyped design enhancements to the Veterans Health Administration's (VHA's colorectal cancer (CRC screening clinical reminder to compare against the VHA's current CRC reminder. Methods In a controlled simulation experiment, 12 primary care providers (PCPs used prototypes of the current and redesigned CRC screening reminder in a within-subject comparison. Quantitative measurements were based on a usability survey, workload assessment instrument, and workflow integration survey. We also collected qualitative data on both designs. Results Design enhancements to the VHA's existing CRC screening clinical reminder positively impacted aspects of usability and workflow integration but not workload. The qualitative analysis revealed broad support across participants for the design enhancements with specific suggestions for improving the reminder further. Conclusions This study demonstrates the value of a human-computer interaction evaluation in informing the redesign of information tools to foster uptake, integration into workflow, and use in clinical practice.
Jasper, Julia B; Humbeck, Lina; Brinkjost, Tobias; Koch, Oliver
2018-03-16
Protein ligand interaction fingerprints are a powerful approach for the analysis and assessment of docking poses to improve docking performance in virtual screening. In this study, a novel interaction fingerprint approach (PADIF, protein per atom score contributions derived interaction fingerprint) is presented which was specifically designed for utilising the GOLD scoring functions' atom contributions together with a specific scoring scheme. This allows the incorporation of known protein-ligand complex structures for a target-specific scoring. Unlike many other methods, this approach uses weighting factors reflecting the relative frequency of a specific interaction in the references and penalizes destabilizing interactions. In addition, and for the first time, an exhaustive validation study was performed that assesses the performance of PADIF and two other interaction fingerprints in virtual screening. Here, PADIF shows superior results, and some rules of thumb for a successful use of interaction fingerprints could be identified.
Coulomb systems seen as critical systems: Finite-size effects in two dimensions
International Nuclear Information System (INIS)
Jancovici, B.; Manificat, G.; Pisani, C.
1994-01-01
It is known that the free energy at criticality of a finite two-dimensional system of characteristic size L has in general a term which behaves like log L as L → ∞; the coefficient of this term is universal. There are solvable models of two-dimensional classical Coulomb systems which exhibit the same finite-size correction (except for its sign) although the particle correlations are short-ranged, i.e., noncritical. Actually, the electrical potential and electrical field correlations are critical at all temperatures (as long as the Coulomb system is a conductor), as a consequence of the perfect screening property of Coulomb systems. This is why Coulomb systems have to exhibit critical finite-size effects
Coulomb corrections to scattering length and effective radius
International Nuclear Information System (INIS)
Mur, V.D.; Kudryavtsev, A.E.; Popov, V.S.
1983-01-01
The problem considered is extraction of the ''purely nuclear'' scattering length asub(s) (corresponding to the strong potential Vsub(s) at the Coulomb interaction switched off) from the Coulomb-nuclear scattering length asub(cs), which is an object of experimental measurement. The difference between asub(s) and asub(cs) is especially large if the potential Vsub(s) has a level (real or virtual) with an energy close to zero. For this case formulae are obtained relating the scattering lengths asub(s) and asub(cs), as well as the effective radii rsub(s) and rsub(cs). The results are extended to states with arbitrary angular momenta l. It is shown that the Coulomb correction is especially large for the coefficient with ksup(2l) in the expansion of the effective radius; in this case the correction contains a large logarithm ln(asub(B)/rsub(0)). The Coulomb renormalization of other terms in the effective radius espansion is of order (rsub(0)/asub(B)), where r 0 is the nuclear force radius, asub(B) is the Bohr radius. The obtained formulae are tried on a number of model potentials Vsub(s), used in nuclear physics
Coulomb fission and transfer fission at heavy ion collisions
International Nuclear Information System (INIS)
Himmele, G.
1981-01-01
In the present thesis the first direct evidence of nuclear fission after inelastic scattering of heavy ions (sup(183,184)W, 152 Sm → 238 U; 184 W → 232 Th; 184 W, 232 Th → 248 Cm) is reported. Experiments which were performed at the UNILAC of the Gesellschaft fuer Schwerionenforschung in Darmstadt show the observed heavy ion induced fission possesses significant properties of the Coulomb fission. The observed dependence of the fission probability for inelastic scattering on the projectile charge proves that the nuclear fission is mediated by the electromagnetic interaction between heavy ions. This result suggests moreover a multiple Coulomb-excitation preceding the fission. Model calculations give a first indication, that the Coulomb fission proceeds mainly from the higher β phonons. In the irradiation with 184 W the fission probability of 232 Th is for all incident energies about 40% smaller that at 238 U. The target dependence of the Coulomb fission however doesn't allow, to give quantitative statements about the position and B(E2)-values of higher lying β phonons. (orig./HSI) [de
Directory of Open Access Journals (Sweden)
Yuval Hamberg
2014-10-01
Full Text Available Cellulosic waste represents a significant and underutilized carbon source for the biofuel industry. Owing to the recalcitrance of crystalline cellulose to enzymatic degradation, it is necessary to design economical methods of liberating the fermentable sugars required for bioethanol production. One route towards unlocking the potential of cellulosic waste lies in a highly complex class of molecular machines, the cellulosomes. Secreted mainly by anaerobic bacteria, cellulosomes are structurally diverse, cell surface-bound protein assemblies that can contain dozens of catalytic components. The key feature of the cellulosome is its modularity, facilitated by the ultra-high affinity cohesin–dockerin interaction. Due to the enormous number of cohesin and dockerin modules found in a typical cellulolytic organism, a major bottleneck in understanding the biology of cellulosomics is the purification of each cohesin- and dockerin-containing component, prior to analyses of their interaction. As opposed to previous approaches, the present study utilized proteins contained in unpurified whole-cell extracts. This strategy was made possible due to an experimental design that allowed for the relevant proteins to be “purified” via targeted affinity interactions as a function of the binding assay. The approach thus represents a new strategy, appropriate for future medium- to high-throughput screening of whole genomes, to determine the interactions between cohesins and dockerins. We have selected the cellulosome of Acetivibrio cellulolyticus for this work due to its exceptionally complex cellulosome systems and intriguing diversity of its cellulosomal modular components. Containing 41 cohesins and 143 dockerins, A. cellulolyticus has one of the largest number of potential cohesin–dockerin interactions of any organism, and contains unusual and novel cellulosomal features. We have surveyed a representative library of cohesin and dockerin modules spanning the
Risk and Interaction Aversion: Screening Mechanisms in the Prisoner's Dilemma Game
Canova, Gabriel A.; Arenzon, Jeferson J.
2017-09-01
When the interactions between cooperators (C) and defectors (D) can be partially avoided within a population, there may be an overall enhancement of cooperation. One example of such screening mechanism occurs in the presence of risk-averse agents (loners, L) that are neutral towards others, i.e., both L and its opponent, whatever its strategy, receive the same payoff. Their presence in the Prisoner's Dilemma (PD) game sustains the coexistence of cooperators and defectors far beyond the level attained in their absence. Another screening mechanism is a heterogeneous landscape obtained, for example, by site diluting the lattice. In this case, cooperation is enhanced with some fraction of such inactive, interaction-averse sites. By considering the interplay of both mechanisms, we show that there is an explosive increase in the range of densities, just above the percolation threshold, where neutrality is prevented and loners become extinct, the behavior reverting to the pure PD game. Interestingly, this occurs despite defectors being usually abundant in that region. This has to be compared with the corresponding loner-free region in the undiluted case that, besides being very small, is dominated by cooperators.
Characterizing Protein Interactions Employing a Genome-Wide siRNA Cellular Phenotyping Screen
Suratanee, Apichat; Schaefer, Martin H.; Betts, Matthew J.; Soons, Zita; Mannsperger, Heiko; Harder, Nathalie; Oswald, Marcus; Gipp, Markus; Ramminger, Ellen; Marcus, Guillermo; Männer, Reinhard; Rohr, Karl; Wanker, Erich; Russell, Robert B.; Andrade-Navarro, Miguel A.; Eils, Roland; König, Rainer
2014-01-01
Characterizing the activating and inhibiting effect of protein-protein interactions (PPI) is fundamental to gain insight into the complex signaling system of a human cell. A plethora of methods has been suggested to infer PPI from data on a large scale, but none of them is able to characterize the effect of this interaction. Here, we present a novel computational development that employs mitotic phenotypes of a genome-wide RNAi knockdown screen and enables identifying the activating and inhibiting effects of PPIs. Exemplarily, we applied our technique to a knockdown screen of HeLa cells cultivated at standard conditions. Using a machine learning approach, we obtained high accuracy (82% AUC of the receiver operating characteristics) by cross-validation using 6,870 known activating and inhibiting PPIs as gold standard. We predicted de novo unknown activating and inhibiting effects for 1,954 PPIs in HeLa cells covering the ten major signaling pathways of the Kyoto Encyclopedia of Genes and Genomes, and made these predictions publicly available in a database. We finally demonstrate that the predicted effects can be used to cluster knockdown genes of similar biological processes in coherent subgroups. The characterization of the activating or inhibiting effect of individual PPIs opens up new perspectives for the interpretation of large datasets of PPIs and thus considerably increases the value of PPIs as an integrated resource for studying the detailed function of signaling pathways of the cellular system of interest. PMID:25255318
Muhič, Neža; Mrhar, Ales; Brvar, Miran
2017-07-01
Drug-drug interaction (DDI) screening systems report potential DDIs. This study aimed to find the prevalence of probable DDI-related adverse drug reactions (ADRs) and compare the clinical usefulness of different DDI screening systems to prevent or warn against these ADRs. A prospective cohort study was conducted in patients urgently admitted to medical departments. Potential DDIs were checked using Complete Drug Interaction®, Lexicomp® Online™, and Drug Interaction Checker®. The study team identified the patients with probable clinically relevant DDI-related ADRs on admission, the causality of which was assessed using the Drug Interaction Probability Scale (DIPS). Sensitivity, specificity, and positive and negative predictive values of screening systems to prevent or warn against probable DDI-related ADRs were evaluated. Overall, 50 probable clinically relevant DDI-related ADRs were found in 37 out of 795 included patients taking at least two drugs, most common of them were bleeding, hyperkalemia, digitalis toxicity, and hypotension. Complete Drug Interaction showed the best sensitivity (0.76) for actual DDI-related ADRs, followed by Lexicomp Online (0.50), and Drug Interaction Checker (0.40). Complete Drug Interaction and Drug Interaction Checker had positive predictive values of 0.07; Lexicomp Online had 0.04. We found no difference in specificity and negative predictive values among these systems. DDI screening systems differ significantly in their ability to detect probable clinically relevant DDI-related ADRs in terms of sensitivity and positive predictive value.
International Nuclear Information System (INIS)
Bolotin, Yu.L.; Gonchar, V.Yu.; Chekanov, N.A.
1985-01-01
Coulomb excitation of rotational states induced in heavyion collisions is treated in the framework of the generalized semiclassical approximation. The Hamiltonian of the system under consideration involves not only Coulomb forces (monopole, quadrupole, and hexadecapole) but as well a real nuclear potential in the form of the deformed Woods-Saxon potential. Strong dependence of the excitation probability on the interference between the Coulomb and nuclear interactions is shown. Calculations are carried out for the reaction 40 Ar+ 162 Dy at E=148.6 MeV. The calculated Coulomb excitation probabilities agree satisfactory with the corresponding experimental values
Study of the nuclear-coulomb low-energy scattering parameters on the basis of the p-matrix approach
International Nuclear Information System (INIS)
Babenko, V.A.; Petrov, N.M.
1993-01-01
The P-matrix approach application to the description of two charged strongly interacting particles nuclear-Coulomb scattering parameters is considered. The nuclear-Coulomb scattering length and effective range explicit expressions in terms of the P-matrix parameters are found. The nuclear-Coulomb low-energy parameters expansions in powers of small parameter β ≡ R/a b , involving terms with big logarithms, are obtained. The nuclear-Coulomb scattering length and effective range for the square-well and the delta-shell short range potentials are found in an explicit form. (author). 21 refs
Static and dynamic properties of two-dimensional Coulomb clusters.
Ash, Biswarup; Chakrabarti, J; Ghosal, Amit
2017-10-01
We study the temperature dependence of static and dynamic responses of Coulomb interacting particles in two-dimensional confinements across the crossover from solid- to liquid-like behaviors. While static correlations that investigate the translational and bond orientational order in the confinements show the footprints of hexatic-like phase at low temperatures, dynamics of the particles slow down considerably in this phase, reminiscent of a supercooled liquid. Using density correlations, we probe long-lived heterogeneities arising from the interplay of the irregularity in the confinement and long-range Coulomb interactions. The relaxation at multiple time scales show stretched-exponential decay of spatial correlations in irregular traps. Temperature dependence of characteristic time scales, depicting the structural relaxation of the system, show striking similarities with those observed for the glassy systems, indicating that some of the key signatures of supercooled liquids emerge in confinements with lower spatial symmetries.
Electronic cooling via interlayer Coulomb coupling in multilayer epitaxial graphene
Mihnev, Momchil T.; Tolsma, John R.; Divin, Charles J.; Sun, Dong; Asgari, Reza; Polini, Marco; Berger, Claire; de Heer, Walt A.; MacDonald, Allan H.; Norris, Theodore B.
2015-01-01
In van der Waals bonded or rotationally disordered multilayer stacks of two-dimensional (2D) materials, the electronic states remain tightly confined within individual 2D layers. As a result, electron–phonon interactions occur primarily within layers and interlayer electrical conductivities are low. In addition, strong covalent in-plane intralayer bonding combined with weak van der Waals interlayer bonding results in weak phonon-mediated thermal coupling between the layers. We demonstrate here, however, that Coulomb interactions between electrons in different layers of multilayer epitaxial graphene provide an important mechanism for interlayer thermal transport, even though all electronic states are strongly confined within individual 2D layers. This effect is manifested in the relaxation dynamics of hot carriers in ultrafast time-resolved terahertz spectroscopy. We develop a theory of interlayer Coulomb coupling containing no free parameters that accounts for the experimentally observed trends in hot-carrier dynamics as temperature and the number of layers is varied. PMID:26399955
Shakeoff Ionization near the Coulomb Barrier Energy
Sharma, Prashant; Nandi, T.
2017-11-01
We measure the projectile K x-ray spectra as a function of the beam energies around the Coulomb barrier in different collision systems. The energy is scanned in small steps around the barrier aiming to explore the nuclear effects on the elastically scattered projectile ions. The variation of the projectile x-ray energy with the ion-beam energies exhibits an unusual increase in between the interaction barrier and fusion barrier energies. This additional contribution to the projectile ionization can be attributed to the shakeoff of outer-shell electrons of the projectile ions due to the sudden nuclear recoil (˜10-21 sec ) caused by the attractive nuclear potential, which gets switched on near the interaction barrier energy. In the sudden approximation limit, the theoretical shakeoff probability calculation due to the nuclear recoil explains the observed data well. In addition to its fundamental interest, such processes can play a significant role in dark matter detection through the possible mechanism of x-ray emissions, where the weakly interacting massive particle-nucleus elastic scattering can lead to the nuclear-recoil-induced inner-shell vacancy creations. Furthermore, the present work may provide new prospects for atomic physics research at barrier energies as well as provide a novel technique to perform barrier distribution studies for two-body systems.
Interplay between dynamic screened f-f interaction and sk·sf interaction in Ce systems
International Nuclear Information System (INIS)
Lopez-Aguilar, F.; Costa-Quintana, J.; Sanchez-Lopez, M.M.
1997-01-01
Two complementary analyses for the electronic structure of Ce systems are given. The first is performed from the renormalized density of states (DOS) deduced from the interacting Green close-quote s functions. These Green close-quote s functions are obtained from a self-energy calculated from a multiband Hubbard Hamiltonian and using the random phase approximation to account for the dynamical f-f screened interactions. The resulting DOS presents agreements and discrepancies with the spectral data yielded by direct and inverse photoemission. The theoretical and experimental f widths next to the Fermi level imply f-electron masses that are in strong contradiction with those obtained from the heavy-fermion specific heat. We have carried out a second analysis that complements the first one, since it considers the spin-exchange between extended states and a spin-field that is completely excluded from the first calculation. By the marriage of the results obtained in the first calculation with those of the second analysis, we can relate the photoemission spectra and de Haas endash van Alphen masses with the measurements of the contribution of the low-energy quasiparticles to the specific heat and the magnetic susceptibility. copyright 1997 The American Physical Society
Kang, M Agnes; Zayts, Olga A
2013-07-01
In this paper, we examine the interactional means by which non-native English speaking patients in Hong Kong participate in prenatal screening sessions. Using interactional sociolinguistics as the theoretical framework, we apply the concept of contextualization cues to illustrate that patients indicate their participation in the consultation through verbal and non-verbal modes. We find that non-native English speaking patients participate: (1) by displaying the interactional difficulties they are encountering and (2) by coordinating their displays of interactional difficulties with the activities of the healthcare provider. We conclude that the notion of patient participation must be expanded to take into account non-native speaking contexts; in particular, that collaborative displays of knowledge (or lack thereof) must be included as part of the definition of patient participation. While verbal contributions represent an important mode of participation in consultations, patients also participate by contextualizing their lack of understanding, which then can serve as a resource to healthcare providers in pursuing meaningful consultations. Our analysis illustrates how health care professionals' awareness of the modes of patient participation and what these modes may signal in non-native consultations can help to establish what the patient knows in the consultation. Copyright © 2013 Elsevier Ireland Ltd. All rights reserved.
DEFF Research Database (Denmark)
Blasius, Melanie; Wagner, Sebastian A; Choudhary, Chuna Ram
2014-01-01
RNA metabolism is altered following DNA damage, but the underlying mechanisms are not well understood. Through a 14-3-3 interaction screen for DNA damage-induced protein interactions in human cells, we identified protein complexes connected to RNA biology. These include the nuclear exosome...
Core polarization and the Coulomb energy difference of mirror nuclei
International Nuclear Information System (INIS)
Barroso, A.
1977-01-01
The effect of the core polarization on the Coulomb displacement energies of mirror nuclei with a LS doubly closed shell plus or minus one nucleon is studied. Using the Kallio-Kolltveit interaction it is found that the first-order configuration mixing including 2p-2h core excitations is too small and sometimes of the wrong sign to explain the Nolen-Schiffer anomaly. (Auth.)
Coulomb two-body problem with internal structure
International Nuclear Information System (INIS)
Kuperin, Yu.A.; Makarov, K.A.; Mel'nikov, Yu.B.
1988-01-01
The methods of the theory of extensions to an enlarged Hilbert space are used to construct a model of the interaction of the external (Coulomb) and internal (quark) channels in the two-body problem. The mutual influence of the spectra of the corresponding channel Hamiltonians is studied: it leads, in particular, to a rearrangement of the spectra of hadronic atoms. An explicit representation is obtained for the S matrix, and its singularities on the energy shell are studied
Multiple Coulomb ordered strings of ions in a storage ring
International Nuclear Information System (INIS)
Hasse, Rainer W.
2002-01-01
We explain that the anomalous frequency shifts of very close masses measured in the high precision mass measurement experiments in the ESR storage ring result from the locking of Coulomb interacting strings of ions. Here two concentric strings which run horizontally close to each other for many revolutions are captured into a single string if their thermal clouds overlap. They give up their identity and lock into an average frequency
Coulomb dissociation of N-20,N-21
Roeder, Marko; Adachi, Tatsuya; Aksyutina, Yulia; Alcantara, Juan; Altstadt, Sebastian; Alvarez-Pol, Hector; Ashwood, Nicholas; Atar, Leyla; Aumann, Thomas; Avdeichikov, Vladimir; Barr, M.; Beceiro, Saul; Bemmerer, Daniel; Benlliure, Jose; Bertulani, Carlos; Boretzky, Konstanze; Borge, Maria J. G.; Burgunder, G.; Caamano, Manuel; Caesar, Christoph; Casarejos, Enrique; Catford, Wilton; Cederkall, Joakim; Chakraborty, S.; Chartier, Marielle; Chulkov, Leonid; Cortina-Gil, Dolores; Crespo, Raquel; Pramanik, Ushasi Datta; Diaz-Fernandez, Paloma; Dillmann, Iris; Elekes, Zoltan; Enders, Joachim; Ershova, Olga; Estrade, A.; Farinon, F.; Fraile, Luis M.; Freer, Martin; Freudenberger, M.; Fynbo, Hans; Galaviz, Daniel; Geissel, Hans; Gernhaeuser, Roman; Goebel, Kathrin; Kalantar-Nayestanaki, Nasser; Najafi, Mohammad Ali; Rigollet, Catherine; Stoica, V.; Streicher, Branislav; Van de Walle, J.
2016-01-01
Neutron-rich light nuclei and their reactions play an important role in the creation of chemical elements. Here, data from a Coulomb dissociation experiment on N-20,N-21 are reported. Relativistic N-20,N-21 ions impinged on a lead target and the Coulomb dissociation cross section was determined in a
Noah, Benjamin; Li, Jingwen; Rothrock, Ling
2017-10-01
The objectives of this study were to test the effect of interaction device on performance in a process control task (managing a tank farm). The study compared the following two conditions: a) 4K-resolution 55" screen with a 21" touchscreen versus b) 4K-resolution 55″ screen with keyboard/mouse. The touchscreen acted both as an interaction device for data entry and navigation and as an additional source of information. A within-subject experiment was conducted among 20 college engineering students. A primary task of preventing tanks from overfilling as well as a secondary task of manual logging with situation awareness questions were designed for the study. Primary Task performance (including tank level at discharge, number of tank discharged and performance score), Secondary Task Performance (including Tank log count, performance score), system interaction times, subjective workload, situation awareness questionnaire, user experience survey regarding usability and condition comparison were used as the measures. Parametric data resulted in two metrics statistically different means between the two conditions: The 4K-keyboard condition resulted in faster Detection + Navigation time compared to the 4K-touchscreen condition, by about 2 s, while participants within the 4K-touchscreen condition were about 2 s faster in data entry than in the 4K-keyboard condition. No significant results were found for: performance on the secondary task, situation awareness, and workload. Additionally, no clear significant differences were found in the non-parametric data analysis. However, participants showed a slight preference for the 4K-touchscreen condition compared to the 4K-keyboard condition in subjective responses in comparing the conditions. Introducing the touchscreen as an additional/alternative input device showed to have an effect in interaction times, which suggests that proper design considerations need to be made. While having values shown on the interaction device
Negative differential resistance in nanoscale transport in the Coulomb blockade regime
International Nuclear Information System (INIS)
Parida, Prakash; Lakshmi, S; Pati, Swapan K
2009-01-01
Motivated by recent experiments, we have studied the transport behavior of coupled quantum dot systems in the Coulomb blockade regime using the master (rate) equation approach. We explore how electron-electron interactions in a donor-acceptor system, resembling weakly coupled quantum dots with varying charging energy, can modify the system's response to an external bias, taking it from normal Coulomb blockade behavior to negative differential resistance (NDR) in the current-voltage characteristics.
Coulomb string tension, asymptotic string tension, and the gluon chain
Greensite, Jeff; Szczepaniak, Adam P.
2014-01-01
We compute, via numerical simulations, the non-perturbative Coulomb potential of pure SU(3) gauge theory in Coulomb gauge. We find that that the Coulomb potential scales nicely in accordance with asymptotic freedom, that the Coulomb potential is linear in the infrared, and that the Coulomb string tension is about four times larger than the asymptotic string tension. We explain how it is possible that the asymptotic string tension can be lower than the Coulomb string tension by a factor of four.
DARC 2.0: Improved Docking and Virtual Screening at Protein Interaction Sites.
Directory of Open Access Journals (Sweden)
Ragul Gowthaman
Full Text Available Over the past decade, protein-protein interactions have emerged as attractive but challenging targets for therapeutic intervention using small molecules. Due to the relatively flat surfaces that typify protein interaction sites, modern virtual screening tools developed for optimal performance against "traditional" protein targets perform less well when applied instead at protein interaction sites. Previously, we described a docking method specifically catered to the shallow binding modes characteristic of small-molecule inhibitors of protein interaction sites. This method, called DARC (Docking Approach using Ray Casting, operates by comparing the topography of the protein surface when "viewed" from a vantage point inside the protein against the topography of a bound ligand when "viewed" from the same vantage point. Here, we present five key enhancements to DARC. First, we use multiple vantage points to more accurately determine protein-ligand surface complementarity. Second, we describe a new scheme for rapidly determining optimal weights in the DARC scoring function. Third, we incorporate sampling of ligand conformers "on-the-fly" during docking. Fourth, we move beyond simple shape complementarity and introduce a term in the scoring function to capture electrostatic complementarity. Finally, we adjust the control flow in our GPU implementation of DARC to achieve greater speedup of these calculations. At each step of this study, we evaluate the performance of DARC in a "pose recapitulation" experiment: predicting the binding mode of 25 inhibitors each solved in complex with its distinct target protein (a protein interaction site. Whereas the previous version of DARC docked only one of these inhibitors to within 2 Å RMSD of its position in the crystal structure, the newer version achieves this level of accuracy for 12 of the 25 complexes, corresponding to a statistically significant performance improvement (p < 0.001. Collectively then, we find
Reflexivity, mediations and education. The subject and the interaction with audiovisual screens
Directory of Open Access Journals (Sweden)
Juan David Zabala Sandoval
2016-07-01
Full Text Available Thinking about massive media is a task that should opt for a complex conception of its effects. Also, the importance in the process of constitution of the subject in their social environment. Specially, television that is a source of particular and group ways of seeing in the world and being part of it. Which at the same time, allows us to look back on it, giving rise to processes of identification and construction of social and daily realities. As well as, deal with the world from basic socialization processes in the education of subjects and subjectivities. Thus, it is interesting to understand, the interaction between the subject and the television screen from the critical approach of reception that proposes to understand the interaction of diverse institutional, situational and contextual mediations that make possible to understand the reception as a changing process. Process in which the subject is active, who negotiates senses, positions, values, and perceptions with the massive media of communication. Therefore, it is a way to study educational processes, reflection, and social construction of realities, which purpose is not only to prohibit the media consumption or think of massive media as products sections while alienating reality; but also, the intention is to perceive that television, as massive media, is a fundamental part of the current socializing process; thus, it is necessary, to propose alternative forms in order to understand the structure/production of the subject, as well as other forms of reading and interact with these commercial and educational contents.
Schüler, M.; van Loon, E. G. C. P.; Katsnelson, M. I.; Wehling, T. O.
2018-04-01
While the Hubbard model is the standard model to study Mott metal-insulator transitions, it is still unclear to what extent it can describe metal-insulator transitions in real solids, where nonlocal Coulomb interactions are always present. By using a variational principle, we clarify this issue for short- and long-range nonlocal Coulomb interactions for half-filled systems on bipartite lattices. We find that repulsive nonlocal interactions generally stabilize the Fermi-liquid regime. The metal-insulator phase boundary is shifted to larger interaction strengths to leading order linearly with nonlocal interactions. Importantly, nonlocal interactions can raise the order of the metal-insulator transition. We present a detailed analysis of how the dimension and geometry of the lattice as well as the temperature determine the critical nonlocal interaction leading to a first-order transition: for systems in more than two dimensions with nonzero density of states at the Fermi energy the critical nonlocal interaction is arbitrarily small; otherwise, it is finite.
Screened ion-ion interaction in mercury-chain compounds: Single chain
International Nuclear Information System (INIS)
Mohan, M.M.; Griffin, A.
1985-01-01
At room temperature, the mercury chains in Hg/sub 3-delta/AsF 6 exhibit phonons characteristic of a one-dimensional lattice. We calculate the screening of the Hg ion-ion interaction in a single chain by electrons moving in a cylindrical potential of finite radius, within the random-phase approximation. The resulting Bohm-Staver-type expression for the phonon velocity is (Z 2 mN/sub I//MN/sub e/)/sup 1/2/v/sub F/, where Z is the Hg ionic charge and N/sub I/ (N/sub e/) is the number of ions (electrons) per unit length. Use of the Tomonaga-Luttinger solution for the electronic response function (keeping only the small-momentum scattering processes) just renormalizes the Fermi velocity in this expression
Sine-Gordon mean field theory of a Coulomb gas
Energy Technology Data Exchange (ETDEWEB)
Diehl, Alexandre; Barbosa, Marcia C.; Levin, Yan
1997-12-31
Full text. The Coulomb gas provides a paradigm for the study of various models of critical phenomena. In particular, it is well known that the two dimensional (2 D). Coulomb gas can be directly used to study the superfluidity transition in {sup 4} He films, arrays of Josephson junctions, roughening transition, etc. Not withstanding its versatility, our full understanding of the most basic model of Coulomb gas, namely an ensemble of hard spheres carrying either positive or negative charges at their center, is still lacking. It is now well accepted that at low density the two dimensional plasma of equal number of positive and negative particles undergoes a Kosterlitz-Thouless (KT) metal insulator transition. This transition is of an infinite order and is characterized by a diverging Debye screening length. As the density of particles increases, the validity of the KT theory becomes questionable and the possibility of the KT transition being replaced by some kind of first order discontinuity has been speculated for a long time. In this work sine-Gordon field theory is used to investigate the phase diagram of a neutral Coulomb gas. A variational mean-field free energy is constructed and the corresponding phase diagrams in two and three dimensions are obtained. When analyzed in terms of chemical potential, the sine-Gordon theory predicts the phase diagram topologically identical to the Monte Carlo simulations and a recently developed Debye-Huckel-Bjerrum theory. In 2D, we find that the infinite-order Kosterlitz-Thouless line terminates in a tricritical point, after which the metal-insulator transition becomes first order. However, when the transformation from chemical potential to the density is made the whole insulating phase is mapped onto zero density. (author)
The screening length of interatomic potential in atomic collisions
International Nuclear Information System (INIS)
Yamamura, Y.; Takeuchi, W.; Kawamura, T.
1998-03-01
In computer studies on the interaction of charged particle with solids, many authors treat the nuclear collision by the Thomas-Fermi screened Coulomb potential. For better agreement with experiment, the screening length is modified sometimes. We investigate the theoretical background for the correction factor of the screening length in the interatomic potential which can be deduced from two steps. The first step is to select the correction factor of an isolated atom so as to match the average radius of the Thomas-Fermi electron distribution with that of the Hartree-Fock electron distribution, where we use the Clementi and Roetti's table. The second step is to determine the correction factor of the screening length of the interatomic potential by using a combination rule. The correction factors obtained for the screening length are in good agreement with those determined by the computer analysis of the Impact Collision Ion Scattering Spectroscopy (ICISS) data. (author)
Shim, Hongjin; Oh, Poong; Song, Hyunjin; Lee, Yeonkyung
2015-03-01
This study explores whether, and how, motivations for two screen viewing predicted social interaction behaviors and subsequent viewing intention of TV programs. A total of 453 respondents who responded that they use social networking sites (SNSs) via smartphones and actively watch entertainment programs completed an online survey questionnaire. In agreement with uses and gratifications assumptions, motivations for TSV predicted distinctive sets of social interaction behaviors, which mediated the influence of motivations on viewing intentions. Respondents' two screen viewing was meaningfully related with social interaction, engagement with programs, information seeking, and passing time. Results suggest that two screen viewing could provide shared experiences nourishing social capital and reintegrate TV audiences by social adhesive resulting from TV with SNSs.
Nucleon-nucleon correlations and the Coulomb Displacement Energy
International Nuclear Information System (INIS)
Van Neck, D.; Waroquier, M.; Heyde, K.
1997-01-01
Coulomb Displacement Energies (CDE) are accurately known for a wide range of nuclear masses. Assuming isospin independence in the nuclear Hamiltonian, the CDE can in first instance be interpreted as the Coulomb interaction energy between the density of the excess neutrons and the proton charge density in the parent nucleus. However, when using reasonable mean-field models for the proton and neutron density one underestimates the CDE by about 8% on average. This discrepancy is known as the Nolen-Schiffer anomaly, and various explanations have been put forward in the past. In this work the role of nucleon-nucleon correlations are re-examined. Calculations for the pair density functions in various nuclei are presented. Preliminary results suggest that the modifications to the mean-field pair density functions cause an enhancement of the CDE in the order of 4%, which is rather A-independent. (author)
Coulomb effects in low-energy nuclear fragmentation
Wilson, John W.; Chun, Sang Y.; Badavi, Francis F.; John, Sarah
1993-01-01
Early versions of the Langley nuclear fragmentation code NUCFRAG (and a publicly released version called HZEFRG1) assumed straight-line trajectories throughout the interaction. As a consequence, NUCFRAG and HZEFRG1 give unrealistic cross sections for large mass removal from the projectile and target at low energies. A correction for the distortion of the trajectory by the nuclear Coulomb fields is used to derive fragmentation cross sections. A simple energy-loss term is applied to estimate the energy downshifts that greatly alter the Coulomb trajectory at low energy. The results, which are far more realistic than prior versions of the code, should provide the data base for future transport calculations. The systematic behavior of charge-removal cross sections compares favorably with results from low-energy experiments.
Coulomb excitation of atoms by fast multicharged ions
International Nuclear Information System (INIS)
Yudin, G.L.
1980-01-01
Investigated is coulomb eXcitation of discrete levels of a hydrogen-like atom by a fast multicharged ion. Obtained are dependences of probabilities of channels 1S→nS and 1S→nP on the sight parameter in the zero order of sudden excitation theory. 1S-2S transition is considered in detail. Carried out are calculations for excitation of the hydrogen atom by the wholy bare carbon atom. It is shown, that at low values of excitation pr.ocess parameter eta excitation probability is a monotonously decreasing function of the impact parameter. With the growth of eta the situation is changed, and at low impact parameters the probability of 1S-2S transition is decreased. At high impact parameters approximation of sudden excitations is unacceptable, here lagging of coulomb interaction is essential
International Nuclear Information System (INIS)
Macdonald, E.W.; Shotter, A.C.; Branford, D.; Rahighi, J.; Davinson, T.; Davis, N.J.
1992-01-01
Kinematically complete data is presented on the break-up reaction 120 Sn( 9 Be, 8 Be g.s +n) 120 Sn g.s. at E beam =90 MeV for several scattering angles inside the grazing angle. These data are compared with the predictions of a Coulomb break-up model. It is shown that the data can be understood in terms of the Coulomb model provided some account is taken of the interactions of the break-up fragments with the target. Analysis of the 9 Be break-up data, using radio-isotope measurements of the 9 Be(γ, n) cross-section, indicates that for this photo-disintegration reaction there is probably a significant direct component to the threshold cross-section, in addition to a threshold resonance at 1.69 MeV. (orig.)
Coulomb drag in the mesoscopic regime
DEFF Research Database (Denmark)
Mortensen, N. Asger; Flensberg, Karsten; Jauho, Antti-Pekka
2002-01-01
We present a theory for Coulomb drug between two mesoscopic systems which expresses the drag in terms of scattering matrices and wave functions. The formalism can be applied to both ballistic and disordered systems and the consequences can be studied either by numerical simulations or analytic...... means such as perturbation theory or random matrix theory. The physics of Coulomb drag in the mesoscopic regime is very different from Coulomb drag between extended electron systems. In the mesoscopic regime we in general find fluctuations of the drag comparable to the mean value. Examples are vanishing...
Coulomb drag in the mesoscopic regime
DEFF Research Database (Denmark)
Mortensen, N.A.; Flensberg, Karsten; Jauho, Antti-Pekka
2002-01-01
We present a theory for Coulomb drag between two mesoscopic systems which expresses the drag in terms of scattering matrices and wave functions. The formalism can be applied to both ballistic and disordered systems and the consequences can be studied either by numerical simulations or analytic...... means such as perturbation theory or random matrix theory. The physics of Coulomb drag in the mesoscopic regime is very different from Coulomb drag between extended electron systems. In the mesoscopic regime we in general find fluctuations of the drag comparable to the mean value. Examples are vanishing...
The eikonal phase of supersymmetric Coulomb partners
Lassaut, M; Lombard, R J
1998-01-01
We investigate the eikonal phase and its systematic corrections for the two supersymmetric Coulomb partners V sub 1 and V sub 2 derived by Amado. Apart from a constant shift of -pi for V sub 1 and -2 pi for V sub 2 , the eikonal phase decay to the eikonal phase of the Coulomb potential as 1/kb. For the potential V sub 2 , which is phase equivalent to the Coulomb potential, this result is only valid at b approx =0 and asymptotically; in the intermediate range, it constitutes a lower limit. (author)
Search for Screened Interactions Associated with Dark Energy below the 100 μm Length Scale.
Rider, Alexander D; Moore, David C; Blakemore, Charles P; Louis, Maxime; Lu, Marie; Gratta, Giorgio
2016-09-02
We present the results of a search for unknown interactions that couple to mass between an optically levitated microsphere and a gold-coated silicon cantilever. The scale and geometry of the apparatus enable a search for new forces that appear at distances below 100 μm and which would have evaded previous searches due to screening mechanisms. The data are consistent with electrostatic backgrounds and place upper limits on the strength of new interactions at 5.6×10^{4} in the region of parameter space where the self-coupling Λ≳5 meV and the microspheres are not fully screened.
Screening and identification of host factors interacting with UL14 of herpes simplex virus 1.
Wu, Fuqing; Xing, Junji; Wang, Shuai; Li, Meili; Zheng, Chunfu
2011-08-01
The UL14 protein of herpes simplex virus type 1 (HSV-1) is highly conserved in herpesvirus family. However, its exact function during the HSV-1 replication cycle is little known. In the present study, a high throughput yeast two-hybrid system was employed to screen the cellular factors interacting with UL14, and five target candidates were yielded: (1) TSC22 domain family protein 3 (TSC22D3); (2) Mediator of RNA polymerase II transcription subunit 8 isoform 1(MED8); (3) Runt-related transcription factor 3 (RUNX3); (4) Arrestin beta-2 (ARRB2); (5) Cereblon (CRBN). Indirect immunofluorescent assay showed that both TSC22D3 and MED8 co-localized with UL14. Co-immunoprecipitation assay demonstrated that UL14 could be immunoprecipitated by TSC22D3, suggesting that UL14 interacted with TSC22D3 under physiological condition. In summary, this study opened up new avenues toward delineating the function and physiological significance of UL14 during the HSV-1 replication cycle.
International Nuclear Information System (INIS)
Zhu Xiaodong; Guo Ya; Qu Song; Li Ling; Huang Shiting; Li Danrong; Zhang Wei
2012-01-01
Objective: To discover radioresistance associated molecular biomarkers and its mechanism in nasopharyngeal carcinoma by protein-protein interaction network analysis. Methods: Whole genome expression microarray was applied to screen out differentially expressed genes in two cell lines CNE-2R and CNE-2 with different radiosensitivity. Four differentially expressed genes were randomly selected for further verification by the semi-quantitative RT-PCR analysis with self-designed primers. The common differentially expressed genes from two experiments were analyzed with the SNOW online database in order to find out the central node related to the biomarkers of nasopharyngeal carcinoma radioresistance. The expression of STAT1 in CNE-2R and CNE-2 cells was measured by Western blot. Results: Compared with CNE-2 cells, 374 genes in CNE-2R cells were differentially expressed while 197 genes showed significant differences. Four randomly selected differentially expressed genes were verified by RT-PCR and had same change trend in consistent with the results of chip assay. Analysis with the SNOW database demonstrated that those 197 genes could form a complicated interaction network where STAT1 and JUN might be two key nodes. Indeed, the STAT1-α expression in CNE-2R was higher than that in CNE-2 (t=4.96, P<0.05). Conclusions: The key nodes of STAT1 and JUN may be the molecular biomarkers leading to radioresistance in nasopharyngeal carcinoma, and STAT1-α might have close relationship with radioresistance. (authors)
Calculation of the Coulomb nuclear energy for the 1fsub(7/2) shell
International Nuclear Information System (INIS)
Kaminski, V.A.; Shpikovski, S.
1980-01-01
Calculated was the Coulomb energy for nuclei with half-filled 1fsub(7/2) shell i.e. for configurations, where quasiparticle basis can serve as a total basis for precise calculations. Presented are calculation results of vector and tensor components of the Coulomb energy for Ca-Se-Ti-V isobaric pairs, as well as experimental and theoretical values for the Coulomb displacements. To estimate the Coulomb energies used were wave functions of a Hamiltonian taking account of pair and quadrupole interactions. There is good agreement with experimental data. Quasiparticle consideration is useful for calculating matrix elements of half-filled shells and for the cases of such an isospin value, where the technique of genealogical coefficients becomes extremely cumbersome
Optical Trapping of Ion Coulomb Crystals
Schmidt, Julian; Lambrecht, Alexander; Weckesser, Pascal; Debatin, Markus; Karpa, Leon; Schaetz, Tobias
2018-04-01
The electronic and motional degrees of freedom of trapped ions can be controlled and coherently coupled on the level of individual quanta. Assembling complex quantum systems ion by ion while keeping this unique level of control remains a challenging task. For many applications, linear chains of ions in conventional traps are ideally suited to address this problem. However, driven motion due to the magnetic or radio-frequency electric trapping fields sometimes limits the performance in one dimension and severely affects the extension to higher-dimensional systems. Here, we report on the trapping of multiple barium ions in a single-beam optical dipole trap without radio-frequency or additional magnetic fields. We study the persistence of order in ensembles of up to six ions within the optical trap, measure their temperature, and conclude that the ions form a linear chain, commonly called a one-dimensional Coulomb crystal. As a proof-of-concept demonstration, we access the collective motion and perform spectrometry of the normal modes in the optical trap. Our system provides a platform that is free of driven motion and combines advantages of optical trapping, such as state-dependent confinement and nanoscale potentials, with the desirable properties of crystals of trapped ions, such as long-range interactions featuring collective motion. Starting with small numbers of ions, it has been proposed that these properties would allow the experimental study of many-body physics and the onset of structural quantum phase transitions between one- and two-dimensional crystals.
Coulomb scattering in field and photofield emission
International Nuclear Information System (INIS)
Donders, P.J.; Lee, M.J.G.
1987-01-01
An anomalous high-energy tail has been observed in the measured total energy distribution (TED) in photofield emission from tungsten. The strength of this tail is proportional to the product of the photofield emission current and the total emission current. Similar high- and low-energy tails in the TED's in field emission, which have previously been reported by several workers, are also observed. In any given measurement, the fraction of the total photofield-emission current in the anomalous photofield-emission tail is approximately equal to the fraction of the total field-emission current in the anomalous field-emission tail. Measurements of both the absolute strengths and energy dependences of the anomalous tails are reported. The experimental observations are consistent with the predictions of a classical calculation of the energy transfer that results from the Coulomb interaction between electrons in the vacuum near the field emitter. The various internal mechanisms that have previously been invoked to account for the tails in field-emission TED's do not appear to contribute significantly to the anomalous distributions observed in the present work
Structure and Spectrum of Dust Coulomb Clusters
International Nuclear Information System (INIS)
Cheung, F.M.H.; Ford, C.; Barkby, S.; Samarian, A.A.; Vladimirov, S.V.
2005-01-01
In our study, the dynamics of Coulomb cluster systems were simulated for different number of particles. The spectra of energy states of dust Coulomb clusters corresponding to various packing sequences were obtained. The broadening of the spectrum due to inter-ring twist was discovered. It was found that the inter-ring twist will lead to a change in the energy spectrum of Coulomb cluster. This change was accompanied by a distortion of stable shells such that particles are able to compensate for any additional Coulomb energy (owing to the inter-ring twist) by further reducing their radial distance as much as possible. The overall effect is a change in the shape of the outer-shell from circular to elliptical
Directory of Open Access Journals (Sweden)
Craig A. Doupnik
2015-01-01
Full Text Available Ion channels represent a large family of membrane proteins with many being well established targets in pharmacotherapy. The ‘druggability’ of heteromeric channels comprised of different subunits remains obscure, due largely to a lack of channel-specific probes necessary to delineate their therapeutic potential in vivo. Our initial studies reported here, investigated the family of inwardly rectifying potassium (Kir channels given the availability of high resolution crystal structures for the eukaryotic constitutively active Kir2.2 channel. We describe a ‘limited’ homology modeling approach that can yield chimeric Kir channels having an outer vestibule structure representing nearly any known vertebrate or invertebrate channel. These computationally-derived channel structures were tested in silico for ‘docking’ to NMR structures of tertiapin (TPN, a 21 amino acid peptide found in bee venom. TPN is a highly selective and potent blocker for the epithelial rat Kir1.1 channel, but does not block human or zebrafish Kir1.1 channel isoforms. Our Kir1.1 channel-TPN docking experiments recapitulated published in vitro findings for TPN-sensitive and TPN-insensitive channels. Additionally, in silico site-directed mutagenesis identified ‘hot spots’ within the channel outer vestibule that mediate energetically favorable docking scores and correlate with sites previously identified with in vitro thermodynamic mutant-cycle analysis. These ‘proof-of-principle’ results establish a framework for virtual screening of re-engineered peptide toxins for interactions with computationally derived Kir channels that currently lack channel-specific blockers. When coupled with electrophysiological validation, this virtual screening approach may accelerate the drug discovery process, and can be readily applied to other ion channels families where high resolution structures are available.
Interactional behaviour as a marker for screening patients with environment-related complaints.
Brand, Serge; Heller, Pia; Bircher, Andreas; Braun-Fahrländer, Charlotte; Huss, Anke; Niederer, Markus; Schwarzenbach, Simone; Waeber, Roger; Wegmann, Lukas; Küchenhoff, Joachim
2007-01-01
Adequate assessment of symptoms of patients suffering from environmental illnesses requires appropriate procedures such as psychological and psychiatric diagnostics, medical screening and a thorough analysis of noxious environmental factors. The Basel pilot research project established a multi-methodological assessment procedure that meets these criteria. However, an exhaustive three-fold analysis is very costly in terms of both equipment and personnel, and hence the need for a heuristic approach and pre-screening persists. The three-fold diagnostic approach was preceded by a structured psychodynamic interview; the findings were used to construct a new profile of the patient's interactional behaviour (IB) in conjunction with the interviewer's countertransference. The extent to which this new profile could predict the results of the multi-method assessment was then assessed. A low level of IB on the part of the patient significantly predicted the degree of stress and the extent of the psychiatric diagnosis, including personality disorders. A negative IB was associated with negative personality traits. Furthermore, a high level of IB implied more medical, but not more environmental, findings which could plausibly be related to the patient's complaints. Assessment of patients' IB in conjunction with one's own countertransference is very helpful as a preliminary heuristic approach and may lead to consequences for treatment and therapy. Therefore, the training provided for experts who deal with patients suffering from environment-related complaints should place more specific emphasis on assessing patients' behaviour and on incorporating information gathered from countertransference. Nevertheless, an interdisciplinary assessment including medical, psychological/psychiatric, and environmental expertise remains mandatory for adequate and satisfactory diagnosis of patients with environment-related complaints.
Yeung, Jeffrey C; Heley, Sophie; Beauregard, Yves; Champagne, Sandra; Bromwich, Matthew A
2015-08-01
The timely diagnosis and treatment of acquired hearing loss in the pediatric population has significant implications for a child's development. Audiological assessment in children, however, carries both technological and logistical challenges. Typically, specialized methods (such as play audiometry) are required to maintain the child's attention and can be resource intensive. These challenges were previously addressed by a novel, calibrated, interactive play audiometer for Apple(®) iOS(®) called "ShoeBOX Audiometry". This device has potential applications for deployment in environments where traditional clinical audiometry is either unavailable or impractical. The objective of this study was to assess the screening capability of the tablet audiometer in an uncontrolled environment using consumer ear-bud headphones. Consecutive patients presenting to the Audiology Clinic at the Children's Hospital of Eastern Ontario (ages 4 and older) were recruited. Participants' hearing was evaluted using the tablet audiometer calibrated to Apple(®) In-Ear headphones. The warble tone thresholds obtained were compared to gold standard measurements taken with a traditional clinical audiometer inside a soundbooth. 80 patients were enrolled. The majority of participants were capable of completing an audiologic assessment using the tablet computer. Due to ambient noise levels outside a soundbooth, thresholds obtained at 500Hz were not consistent with traditional audiometry. Excluding 500Hz threholds, the tablet audiometer demonstrated strong negative predictive value (89.7%) as well as strong sensitivity (91.2%) for hearing loss. Thresholds obtained in an uncontrolled setting are not reflective of diagnostic thresholds due to the uncalibrated nature of the headphones and variability of the setting without a booth. Nevertheless, the tablet audiometer proved to be both a valid and sensitive instrument for unsupervised screening of warble-tone thresholds in children. Copyright © 2015
The influence of image interactivity upon user engagement when using mobile touch screens
Blazquez Cano, Marta; Perry, Patsy; Ashman, Rachel; Waite, Kathryn
2017-01-01
Touch screens are a key component of consumer mobile devices such as smartphones and tablets, as well as an increasingly common self-service component of information retrieval on fixed screens and mobile devices in-store. The ubiquity of touch screens in daily life increases consumer accessibility and extended use for shopping, whilst software innovations have increased the functionality of touch screens, for example the extent to which images respond to fingertip control. This study examines...
Cavity QED experiments with ion Coulomb crystals
DEFF Research Database (Denmark)
Herskind, Peter Fønss; Dantan, Aurélien; Marler, Joan
2009-01-01
Cavity QED experimental results demonstrating collective strong coupling between ensembles of atomic ions cooled into Coulomb crystals and optical cavity fields have been achieved. Collective Zeeman coherence times of milliseconds have furthermore been obtained.......Cavity QED experimental results demonstrating collective strong coupling between ensembles of atomic ions cooled into Coulomb crystals and optical cavity fields have been achieved. Collective Zeeman coherence times of milliseconds have furthermore been obtained....
Monotonicity of energy eigenvalues for Coulomb systems
International Nuclear Information System (INIS)
Englisch, R.
1983-01-01
Generalising results by earlier workers for a large class of Hamiltonians (among others, Hamiltonians of Coulomb systems) which can be written in the form H(α) = H 0 + αH' the present works shows that their eigenvalues decrease with increasing α. This result is applied to Coulomb systems in which the distances between the infinitely heavy particles are varying and also is used to obtain a completion and simplification of proof for the stability of the biexciton. (author)
Coulomb Distortion in the Inelastic Regime
Energy Technology Data Exchange (ETDEWEB)
Patricia Solvignon, Dave Gaskell, John Arrington
2009-09-01
The Coulomb distortion effects have been for a long time neglected in deep inelastic scattering for the good reason that the incident energies were very high. But for energies in the range of earlier data from SLAC or at JLab, the Coulomb distortion could have the potential consequence of affecting the A-dependence of the EMC effect and of the longitudinal to transverse virtual photon absorption cross section ratio $R(x,Q^2)$.
Tur\\'an type inequalities for regular Coulomb wave functions
Baricz, Árpád
2015-01-01
Tur\\'an, Mitrinovi\\'c-Adamovi\\'c and Wilker type inequalities are deduced for regular Coulomb wave functions. The proofs are based on a Mittag-Leffler expansion for the regular Coulomb wave function, which may be of independent interest. Moreover, some complete monotonicity results concerning the Coulomb zeta functions and some interlacing properties of the zeros of Coulomb wave functions are given.
Engineering drag currents in Coulomb coupled quantum dots
Lim, Jong Soo; Sánchez, David; López, Rosa
2018-02-01
The Coulomb drag phenomenon in a Coulomb-coupled double quantum dot system is revisited with a simple model that highlights the importance of simultaneous tunneling of electrons. Previously, cotunneling effects on the drag current in mesoscopic setups have been reported both theoretically and experimentally. However, in both cases the sequential tunneling contribution to the drag current was always present unless the drag level position were too far away from resonance. Here, we consider the case of very large Coulomb interaction between the dots, whereby the drag current needs to be assisted by cotunneling events. As a consequence, a quantum coherent drag effect takes place. Further, we demonstrate that by properly engineering the tunneling probabilities using band tailoring it is possible to control the sign of the drag and drive currents, allowing them to flow in parallel or antiparallel directions. We also show that the drag current can be manipulated by varying the drag gate potential and is thus governed by electron- or hole-like transport.
Quasi-exactly solvable relativistic soft-core Coulomb models
Energy Technology Data Exchange (ETDEWEB)
Agboola, Davids, E-mail: davagboola@gmail.com; Zhang, Yao-Zhong, E-mail: yzz@maths.uq.edu.au
2012-09-15
By considering a unified treatment, we present quasi exact polynomial solutions to both the Klein-Gordon and Dirac equations with the family of soft-core Coulomb potentials V{sub q}(r)=-Z/(r{sup q}+{beta}{sup q}){sup 1/q}, Z>0, {beta}>0, q{>=}1. We consider cases q=1 and q=2 and show that both cases are reducible to the same basic ordinary differential equation. A systematic and closed form solution to the basic equation is obtained using the Bethe ansatz method. For each case, the expressions for the energies and the allowed parameters are obtained analytically and the wavefunctions are derived in terms of the roots of a set of Bethe ansatz equations. - Highlights: Black-Right-Pointing-Pointer The relativistic bound-state solutions of the soft-core Coulomb models. Black-Right-Pointing-Pointer Quasi-exact treatments of the Dirac and Klein-Gordon equations for the soft-core Coulomb models. Black-Right-Pointing-Pointer Solutions obtained in terms of the roots to the Bethe ansatz equations. Black-Right-Pointing-Pointer The hidden Lie algebraic structure discussed for the models. Black-Right-Pointing-Pointer Results useful in describing mesonic atoms and interaction of intense laser fields with atom.
Photoelectron wave function in photoionization: plane wave or Coulomb wave?
Gozem, Samer; Gunina, Anastasia O; Ichino, Takatoshi; Osborn, David L; Stanton, John F; Krylov, Anna I
2015-11-19
The calculation of absolute total cross sections requires accurate wave functions of the photoelectron and of the initial and final states of the system. The essential information contained in the latter two can be condensed into a Dyson orbital. We employ correlated Dyson orbitals and test approximate treatments of the photoelectron wave function, that is, plane and Coulomb waves, by comparing computed and experimental photoionization and photodetachment spectra. We find that in anions, a plane wave treatment of the photoelectron provides a good description of photodetachment spectra. For photoionization of neutral atoms or molecules with one heavy atom, the photoelectron wave function must be treated as a Coulomb wave to account for the interaction of the photoelectron with the +1 charge of the ionized core. For larger molecules, the best agreement with experiment is often achieved by using a Coulomb wave with a partial (effective) charge smaller than unity. This likely derives from the fact that the effective charge at the centroid of the Dyson orbital, which serves as the origin of the spherical wave expansion, is smaller than the total charge of a polyatomic cation. The results suggest that accurate molecular photoionization cross sections can be computed with a modified central potential model that accounts for the nonspherical charge distribution of the core by adjusting the charge in the center of the expansion.
Infrared behavior of the Faddeev-Popov operator in Coulomb gauge QCD
International Nuclear Information System (INIS)
Nakagawa, Y.; Saito, T.; Toki, H.; Nakamura, A.
2007-01-01
We calculate the eigenvalue distribution of the Faddeev-Popov operator in Coulomb gauge QCD using quenched SU(3) lattice simulation. In the confinement phase, the density of the low-lying eigenvalues increases with lattice volume, and the confinement criterion is satisfied. Moreover, even in the deconfinement phase, the behavior of the FP eigenvalue density is qualitatively the same as in the confinement phase. This is consistent with the fact that the color-Coulomb potential is not screened in the deconfined phase
Conservation laws, vertex corrections, and screening in Raman spectroscopy
Maiti, Saurabh; Chubukov, Andrey V.; Hirschfeld, P. J.
2017-07-01
We present a microscopic theory for the Raman response of a clean multiband superconductor, with emphasis on the effects of vertex corrections and long-range Coulomb interaction. The measured Raman intensity, R (Ω ) , is proportional to the imaginary part of the fully renormalized particle-hole correlator with Raman form factors γ (k ⃗) . In a BCS superconductor, a bare Raman bubble is nonzero for any γ (k ⃗) and diverges at Ω =2 Δmax , where Δmax is the largest gap along the Fermi surface. However, for γ (k ⃗) = constant, the full R (Ω ) is expected to vanish due to particle number conservation. It was sometimes stated that this vanishing is due to the singular screening by long-range Coulomb interaction. In our general approach, we show diagrammatically that this vanishing actually holds due to vertex corrections from the same short-range interaction that gives rise to superconductivity. We further argue that long-range Coulomb interaction does not affect the Raman signal for any γ (k ⃗) . We argue that vertex corrections eliminate the divergence at 2 Δmax . We also argue that vertex corrections give rise to sharp peaks in R (Ω ) at Ω <2 Δmin (the minimum gap along the Fermi surface), when Ω coincides with the frequency of one of the collective modes in a superconductor, e.g., Leggett and Bardasis-Schrieffer modes in the particle-particle channel, and an excitonic mode in the particle-hole channel.
Plasma screening effects on the energies of hydrogen atom
International Nuclear Information System (INIS)
Soylu, A.
2012-01-01
A more general exponential cosine screened Coulomb potential is used for the first time to investigate the screening effects on the hydrogen atom in plasmas. This potential is examined for four different cases that correspond to four different type potentials when the different parameters are used in the potential within the framework of the well-known asymptotic iteration method. By solving the corresponding the radial Schrödinger equation with the screened and exponential cosine screened Coulomb potentials and comparing the obtained energy eigenvalues with the results of other studies, the applicability of the method to this kind of plasma physics problem is shown. The energy values of more general exponential cosine screened Coulomb potential are presented for various parameters in the potential. One of the advantages of the present potential is that it exhibits stronger screening effect than that of the exponential cosine screened Coulomb potential and it is also reduced to screened Coulomb and exponential cosine screened Coulomb as well as Coulomb potentials for special values of parameters. The parameters in the potential would be useful to model screening effects which cause an increase or decrease in the energy values of hydrogen atom in both Debye and quantum plasmas and in this manner this potential would be useful for the investigations of the atomic structure and collisions in plasmas.
Kinetic theory for strongly coupled Coulomb systems
Dufty, James; Wrighton, Jeffrey
2018-01-01
The calculation of dynamical properties for matter under extreme conditions is a challenging task. The popular Kubo-Greenwood model exploits elements from equilibrium density-functional theory (DFT) that allow a detailed treatment of electron correlations, but its origin is largely phenomenological; traditional kinetic theories have a more secure foundation but are limited to weak ion-electron interactions. The objective here is to show how a combination of the two evolves naturally from the short-time limit for the generator of the effective single-electron dynamics governing time correlation functions without such limitations. This provides a theoretical context for the current DFT-related approach, the Kubo-Greenwood model, while showing the nature of its corrections. The method is to calculate the short-time dynamics in the single-electron subspace for a given configuration of the ions. This differs from the usual kinetic theory approach in which an average over the ions is performed as well. In this way the effective ion-electron interaction includes strong Coulomb coupling and is shown to be determined from DFT. The correlation functions have the form of the random-phase approximation for an inhomogeneous system but with renormalized ion-electron and electron-electron potentials. The dynamic structure function, density response function, and electrical conductivity are calculated as examples. The static local field corrections in the dielectric function are identified in this way. The current analysis is limited to semiclassical electrons (quantum statistical potentials), so important quantum conditions are excluded. However, a quantization of the kinetic theory is identified for broader application while awaiting its detailed derivation.
Jackson, M I; Hiley, M J; Yeadon, M R
2011-10-13
In the table contact phase of gymnastics vaulting both dynamic and static friction act. The purpose of this study was to develop a method of simulating Coulomb friction that incorporated both dynamic and static phases and to compare the results with those obtained using a pseudo-Coulomb implementation of friction when applied to the table contact phase of gymnastics vaulting. Kinematic data were obtained from an elite level gymnast performing handspring straight somersault vaults using a Vicon optoelectronic motion capture system. An angle-driven computer model of vaulting that simulated the interaction between a seven segment gymnast and a single segment vaulting table during the table contact phase of the vault was developed. Both dynamic and static friction were incorporated within the model by switching between two implementations of the tangential frictional force. Two vaulting trials were used to determine the model parameters using a genetic algorithm to match simulations to recorded performances. A third independent trial was used to evaluate the model and close agreement was found between the simulation and the recorded performance with an overall difference of 13.5%. The two-state simulation model was found to be capable of replicating performance at take-off and also of replicating key contact phase features such as the normal and tangential motion of the hands. The results of the two-state model were compared to those using a pseudo-Coulomb friction implementation within the simulation model. The two-state model achieved similar overall results to those of the pseudo-Coulomb model but obtained solutions more rapidly. Copyright © 2011 Elsevier Ltd. All rights reserved.
Interactive vs passive screen time and nighttime sleep duration among school-aged children.
Yland, Jennifer; Guan, Stanford; Emanuele, Erin; Hale, Lauren
2015-09-01
Insufficient sleep among school-aged children is a growing concern, as numerous studies have shown that chronic short sleep duration increases the risk of poor academic performance and specific adverse health outcomes. We examined the association between weekday nighttime sleep duration and 3 types of screen exposure: television, computer use, and video gaming. We used age 9 data from an ethnically diverse national birth cohort study, the Fragile Families and Child Wellbeing Study, to assess the association between screen time and sleep duration among 9-year-olds, using screen time data reported by both the child (n = 3269) and by the child's primary caregiver (n= 2770). Within the child-reported models, children who watched more than 2 hours of television per day had shorter sleep duration by approximately 11 minutes per night compared to those who watched less than 2 hours of television (β = -0.18; P computer use were associated with reduced sleep duration. For both child- and parent-reported screen time measures, we did not find statistically significant differences in effect size across various types of screen time. Screen time from televisions and computers is associated with reduced sleep duration among 9-year-olds, using 2 sources of estimates of screen time exposure (child and parent reports). No specific type or use of screen time resulted in significantly shorter sleep duration than another, suggesting that caution should be advised against excessive use of all screens.
Coulomb Fourier transformation: A novel approach to three-body scattering with charged particles
International Nuclear Information System (INIS)
Alt, E.O.; Levin, S.B.; Yakovlev, S.L.
2004-01-01
A unitary transformation of the three-body Hamiltonian which describes a system of two charged and one neutral particles is constructed such that the Coulomb potential which acts between the charged particles is explicitly eliminated. The transformed Hamiltonian and, in particular, the transformed short-range pair interactions are worked out in detail. Thereby it is found that, after transformation, the short-range potentials acting between the neutral and either one of the charged particles become simply Fourier transformed but, in addition, multiplied by a function that represents the Coulombic three-body correlations originating from the action of the other charged particle on the considered pair. This function which is universal as it does not depend on any property of the short-range interaction is evaluated explicitly and its singularity structure is described in detail. In contrast, the short-range potential between the charged particles remains of two-body type but occurs now in the 'Coulomb representation'. Specific applications to Yukawa and Gaussian potentials are given. Since the Coulomb-Fourier-transformed Hamiltonian does no longer contain the Coulomb potential or any other effective interaction of long range, standard methods of short-range few-body scattering theory are applicable
Directory of Open Access Journals (Sweden)
Ellen C Kammula
Full Text Available HIV-1 Nef protein contributes essentially to the pathology of AIDS by a variety of protein-protein-interactions within the host cell. The versatile functionality of Nef is partially attributed to different conformational states and posttranslational modifications, such as myristoylation. Up to now, many interaction partners of Nef have been identified using classical yeast two-hybrid screens. Such screens rely on transcriptional activation of reporter genes in the nucleus to detect interactions. Thus, the identification of Nef interaction partners that are integral membrane proteins, membrane-associated proteins or other proteins that do not translocate into the nucleus is hampered. In the present study, a split-ubiquitin based yeast two-hybrid screen was used to identify novel membrane-localized interaction partners of Nef. More than 80% of the hereby identified interaction partners of Nef are transmembrane proteins. The identified hits are GPM6B, GPM6A, BAP31, TSPAN7, CYB5B, CD320/TCblR, VSIG4, PMEPA1, OCIAD1, ITGB1, CHN1, PH4, CLDN10, HSPA9, APR-3, PEBP1 and B3GNT, which are involved in diverse cellular processes like signaling, apoptosis, neurogenesis, cell adhesion and protein trafficking or quality control. For a subfraction of the hereby identified proteins we present data supporting their direct interaction with HIV-1 Nef. We discuss the results with respect to many phenotypes observed in HIV infected cells and patients. The identified Nef interaction partners may help to further elucidate the molecular basis of HIV-related diseases.
A proposal for Coulomb assisted laser cooling of piezoelectric semiconductors
Energy Technology Data Exchange (ETDEWEB)
Nia, Iman Hassani; Mohseni, Hooman, E-mail: hmohseni@ece.northwestern.edu [Bio-Inspired Sensors and Optoelectronics Laboratory (BISOL), Department of Electrical Engineering, Northwestern University, Evanston, Illinois 60208 (United States)
2014-07-28
Anti-Stokes laser cooling of semiconductors as a compact and vibration-free method is very attractive. While it has achieved significant milestones, increasing its efficiency is highly desirable. The main limitation is the lack of the pristine material quality with high luminescence efficiency. Here, we theoretically demonstrate that the Coulomb interaction among electrons and holes in piezoelectric heterostructures could lead to coherent damping of acoustic phonons; rendering a significantly higher efficiency that leads to the possibility of cooling a broad range of semiconductors.
Coulomb scattering and η-η' the mixing angle
International Nuclear Information System (INIS)
Kleefeld, F.
2006-01-01
The fascinating physics underlying η and η ' mesons can be studied theoretically and experimentally in various contexts. In this presentation we want to turn our attention to two important uncorrelated aspects of this vivid research field which provide yet unexpected challenges or surprises. First we discuss open questions in the theoretical treatment of Coulomb-interaction in the context of reaction processes like pp → ppη. Then we review η-η ' and σ (600) - F 0 (980) mixing in the U (3) x U (3) Linear Sigma Model and extract information on η-η ' mixing and K 0 (800) resonance from meson-meson scattering (Author)
The thermodynamics of a strictly non-ideal Coulomb system
International Nuclear Information System (INIS)
Krikorian V, R.
1982-01-01
Using the equation of state for a symmetric quantum Coulomb system with strong interactions, the phase transition and the existence of the plasma state are analyzed. With a reduction potential which includes quantum effects, a generalization of Saha's formula is obtained. The thermodynamics stability of the system is demonstrated analytically. The isotherms for equilibrium ionization are presented and the stability of the system is studied. The electrical conductivity is analyzed in a region of critical values, and the predictions are compared with experimental data for which one observes a quantitative change in the conductivity. (L.C.) [pt
Stommel, Wyke; te Molder, Hedwig Frederica Maria
2016-01-01
We present a conversation analysis of openings sequences of online text-based chat counseling. Particular about this chat counseling is that the clients made available their help question through pre-screening. The data consisted of 40 chat sessions with pre-screening and 34 sessions without
International Nuclear Information System (INIS)
Guigou, Marine
2009-01-01
This thesis takes place in the field of condensed matter. More precisely, we focus on the finite size effects and the screening effects caused by a STM tip in a quantum wire. For that, we use, first, the Luettinger liquid theory, which allows to describe strongly correlated systems and secondly, the Keldysh formalism, which is necessary to treat the out-of-equilibrium systems. For these studies, we consider, the currant, the noise and the conductance. The noise presents a non-Poissonian behaviour, when finite size effects appear. Through the photo-assisted transport, it is shown that those effects hide the effects of the Coulomb interactions. Considering the proximity between the STM tip, used as a probe or as an injector, and a quantum wire, screening effects appear. We can conclude that they play a similar role to those of Coulomb interactions. (author) [fr
Optical Trapping of Ion Coulomb Crystals
Directory of Open Access Journals (Sweden)
Julian Schmidt
2018-05-01
Full Text Available The electronic and motional degrees of freedom of trapped ions can be controlled and coherently coupled on the level of individual quanta. Assembling complex quantum systems ion by ion while keeping this unique level of control remains a challenging task. For many applications, linear chains of ions in conventional traps are ideally suited to address this problem. However, driven motion due to the magnetic or radio-frequency electric trapping fields sometimes limits the performance in one dimension and severely affects the extension to higher-dimensional systems. Here, we report on the trapping of multiple barium ions in a single-beam optical dipole trap without radio-frequency or additional magnetic fields. We study the persistence of order in ensembles of up to six ions within the optical trap, measure their temperature, and conclude that the ions form a linear chain, commonly called a one-dimensional Coulomb crystal. As a proof-of-concept demonstration, we access the collective motion and perform spectrometry of the normal modes in the optical trap. Our system provides a platform that is free of driven motion and combines advantages of optical trapping, such as state-dependent confinement and nanoscale potentials, with the desirable properties of crystals of trapped ions, such as long-range interactions featuring collective motion. Starting with small numbers of ions, it has been proposed that these properties would allow the experimental study of many-body physics and the onset of structural quantum phase transitions between one- and two-dimensional crystals.
Functional theory of extended Coulomb systems
International Nuclear Information System (INIS)
Martin, R.M.; Ortiz, G.
1997-01-01
A consistent formulation is presented for a functional theory of extended quantum many-particle systems with long-range Coulomb interactions, which extends the density-functional theory of Hohenberg and Kohn to encompass the theory of dielectrics formulated in terms of electric fields and polarization. We show that a complete description of insulators in the thermodynamic limit requires a functional of density and macroscopic polarization; nevertheless, for any insulator the state with zero macroscopic electric field can be considered a reference state that is a functional of the density alone. Dielectric phenomena involve the behavior of the material in the presence of macroscopic electric fields that induce changes of the macroscopic polarization from its equilibrium value in the reference state. In the thermodynamic limit there is strictly no ground state and constraints must be placed upon the electronic wave functions in order to have a well-defined energy functional; within these constrained subspaces the Hohenberg-Kohn theorems can be generalized in terms of the density and the change in the macroscopic polarization. The essential role of the polarization is shown by an explicit example of two potentials that lead to the same periodic density in a crystal, but different macroscopic electric fields and polarization. In the Kohn-Sham approach both the kinetic and the exchange-correlation energy are shown to depend upon the changes in polarization; this leads to generalized Kohn-Sham equations with a nonlocal operator. The effect can be traced to the polarization of the average exchange-correlation hole itself in the presence of macroscopic fields, which is essential for an exact description of static dielectric phenomena. copyright 1997 The American Physical Society
Pinto, Laura M.N.; Dörr, Natália C.; Ribeiro, Ana Paula A.; de Salles, Silvia M.; de Oliveira, Jaime V.; Menezes, Valmir G.; Fiuza, Lidia M.
2012-01-01
The screening of Bacillus thuringiensis (Bt) Cry proteins with high potential to control insect pests has been the goal of numerous research groups. In this study, we evaluated six monogenic Bt strains (Bt dendrolimus HD-37, Bt kurstaki HD-1, Bt kurstaki HD-73, Bt thuringiensis 4412, Bt kurstaki NRD-12 and Bt entomocidus 60.5, which codify the cry1Aa, cry1Ab, cry1Ac, cry1Ba, cry1C, cry2A genes respectively) as potential insecticides for the most important insect pests of irrigated rice: Spodoptera frugiperda, Diatraea saccharalis, Oryzophagus oryzae, Oebalus poecilus and Tibraca limbativentris. We also analyzed their compatibility with chemical insecticides (thiamethoxam, labdacyhalothrin, malathion and fipronil), which are extensively used in rice crops. The bioassay results showed that Bt thuringiensis 4412 and Bt entomocidus 60.5 were the most toxic for the lepidopterans, with a 93% and 82% mortality rate for S. frugiperda and D. saccharalis, respectively. For O. oryzae, the Bt kurstaki NRD-12 (64%) and Bt dendrolimus HD-37 (62%) strains were the most toxic. The Bt dendrolimus HD-37 strain also caused high mortality (82%) to O. poecilus, however the strains assessed to T. limbativentris caused a maximum rate of 5%. The assays for the Bt strains interaction with insecticides revealed the compatibility of the six strains with the four insecticides tested. The results from this study showed the high potential of cry1Aa and cry1Ba genes for genetic engineering of rice plants or the strains to biopesticide formulations. PMID:24031872
Coulomb drag in coherent mesoscopic systems
DEFF Research Database (Denmark)
Mortensen, Asger; Flensberg, Karsten; Jauho, Antti-Pekka
2001-01-01
We present a theory for Coulomb drag between two mesoscopic systems. Our formalism expresses the drag in terms of scattering matrices and wave functions, and its range of validity covers both ballistic and disordered systems. The consequences can be worked out either by analytic means, such as th......We present a theory for Coulomb drag between two mesoscopic systems. Our formalism expresses the drag in terms of scattering matrices and wave functions, and its range of validity covers both ballistic and disordered systems. The consequences can be worked out either by analytic means......, such as the random matrix theory, or by numerical simulations. We show that Coulomb drag is sensitive to localized states. which usual transport measurements do not probe. For chaotic 2D systems we find a vanishing average drag, with a nonzero variance. Disordered 1D wires show a finite drag, with a large variance...
Coulomb explosion of “hot spot”
Energy Technology Data Exchange (ETDEWEB)
Oreshkin, V. I., E-mail: oreshkin@ovpe.hcei.tsc.ru [Institute of High Current Electrons, SB, RAS, Tomsk (Russian Federation); Tomsk Polytechnic University, Tomsk (Russian Federation); Oreshkin, E. V. [P. N. Lebedev Physical Institute, RAS, Moscow (Russian Federation); Chaikovsky, S. A. [Institute of High Current Electrons, SB, RAS, Tomsk (Russian Federation); P. N. Lebedev Physical Institute, RAS, Moscow (Russian Federation); Institute of Electrophysics, UD, RAS, Ekaterinburg (Russian Federation); Artyomov, A. P. [Institute of High Current Electrons, SB, RAS, Tomsk (Russian Federation)
2016-09-15
The study presented in this paper has shown that the generation of hard x rays and high-energy ions, which are detected in pinch implosion experiments, may be associated with the Coulomb explosion of the hot spot that is formed due to the outflow of the material from the pinch cross point. During the process of material outflow, the temperature of the hot spot plasma increases, and conditions arise for the plasma electrons to become continuously accelerated. The runaway of electrons from the hot spot region results in the buildup of positive space charge in this region followed by a Coulomb explosion. The conditions for the hot spot plasma electrons to become continuously accelerated have been revealed, and the estimates have been obtained for the kinetic energy of the ions generated by the Coulomb explosion.
Coulomb explosion of “hot spot”
International Nuclear Information System (INIS)
Oreshkin, V. I.; Oreshkin, E. V.; Chaikovsky, S. A.; Artyomov, A. P.
2016-01-01
The study presented in this paper has shown that the generation of hard x rays and high-energy ions, which are detected in pinch implosion experiments, may be associated with the Coulomb explosion of the hot spot that is formed due to the outflow of the material from the pinch cross point. During the process of material outflow, the temperature of the hot spot plasma increases, and conditions arise for the plasma electrons to become continuously accelerated. The runaway of electrons from the hot spot region results in the buildup of positive space charge in this region followed by a Coulomb explosion. The conditions for the hot spot plasma electrons to become continuously accelerated have been revealed, and the estimates have been obtained for the kinetic energy of the ions generated by the Coulomb explosion.
"Coulombic Viscosity" In Granular Materials: Planetary and Astrophysical Implications
Marshall, J. R.
1999-01-01
The term "Coulombic viscosity" is introduced here to define an empirically observed phenomenon from experiments conducted in both microgravity, and in ground-based 1-g conditions. In the latter case, a sand attrition device was employed to test the longevity of aeolian materials by creating two intersecting grain-circulation paths or cells that would lead to most of the grain energy being expended on grain-to-grain collisions (simulating dune systems). In the areas in the device where gravitationally-driven grain-slurries recycled the sand, the slurries moved with a boundary-layer impeded motion down the chamber walls. Excessive electrostatic charging of the grains during these experiments was prevented by the use of an a.c. corona (created by a Tesla coil) through which the grains passed on every cycle. This created both positive and negative ions which neutralized the triboelectrically-generated grain charges. When the corona was switched on, the velocity of the wall-attached slurries increased by a factor of two as approximately determined by direct observation. What appeared to be a freely-flowing slurry of grains impeded only by intergranular mechanical friction, had obviously been significantly retarded in its motion by electrostatic forces between the grains; with the charging reduced, the grains were able to move past one another without a flow "viscosity" imposed by the Coulombic intergranular forces. A similar phenomenon was observed during microgravity experiments aboard Space Shuttle in USML-1 & USML-2 spacelabs where freely-suspended clouds of sand were being investigated for their potential to for-m aggregates. In this environment, the grains were also charged electrostatically (by natural processes prior to flight), but were free from the intervention of gravity in their interactions. The grains were dispersed into dense clouds by bursts of air turbulence and allowed to form aggregates as the ballistic and turbulent motions damped out. During this
"Coulombic Viscosity" In Granular Materials: Planetary and Astrophysical Implications
Marshall, J. R.
1999-09-01
The term "Coulombic viscosity" is introduced here to define an empirically observed phenomenon from experiments conducted in both microgravity, and in ground-based 1-g conditions. In the latter case, a sand attrition device was employed to test the longevity of aeolian materials by creating two intersecting grain-circulation paths or cells that would lead to most of the grain energy being expended on grain-to-grain collisions (simulating dune systems). In the areas in the device where gravitationally-driven grain-slurries recycled the sand, the slurries moved with a boundary-layer impeded motion down the chamber walls. Excessive electrostatic charging of the grains during these experiments was prevented by the use of an a.c. corona (created by a Tesla coil) through which the grains passed on every cycle. This created both positive and negative ions which neutralized the triboelectrically-generated grain charges. When the corona was switched on, the velocity of the wall-attached slurries increased by a factor of two as approximately determined by direct observation. What appeared to be a freely-flowing slurry of grains impeded only by intergranular mechanical friction, had obviously been significantly retarded in its motion by electrostatic forces between the grains; with the charging reduced, the grains were able to move past one another without a flow "viscosity" imposed by the Coulombic intergranular forces. A similar phenomenon was observed during microgravity experiments aboard Space Shuttle in USML-1 & USML-2 spacelabs where freely-suspended clouds of sand were being investigated for their potential to for-m aggregates. In this environment, the grains were also charged electrostatically (by natural processes prior to flight), but were free from the intervention of gravity in their interactions. The grains were dispersed into dense clouds by bursts of air turbulence and allowed to form aggregates as the ballistic and turbulent motions damped out. During this
Coulomb collisions in the solar wind
Klein, L. W.; Ogilvie, K. W.; Burlaga, L. F.
1985-01-01
A major improvement of the present investigation over previous studies of the subject is related to the use of helium temperatures obtained from helium ion measurements uncontaminated by the high-velocity tail of the proton distribution. More observations, covering a large parameter range, were employed, and the effects of interspecies drift were taken into account. It is shown in a more definite way than has been done previously, that Coulomb collisions provide the most important mechanism bringing about equilibrium between helium and protons in the solar wind. Other mechanisms may play some part in restricted regions, but Coulomb collisions are dominant on the macroscale.
Frictional Coulomb drag in strong magnetic fields
DEFF Research Database (Denmark)
Bønsager, Martin Christian; Flensberg, Karsten; Hu, Ben Yu-Kuang
1997-01-01
A treatment of frictional Coulomb drag between two two-dimensional electron layers in a strong perpendicular magnetic field, within the independent electron picture, is presented. Assuming fully resolved Landau levels, the linear response theory expression for the transresistivity rho(21) is eval......A treatment of frictional Coulomb drag between two two-dimensional electron layers in a strong perpendicular magnetic field, within the independent electron picture, is presented. Assuming fully resolved Landau levels, the linear response theory expression for the transresistivity rho(21...
Observation of a Coulomb flux tube
Greensite, Jeff; Chung, Kristian
2018-03-01
In Coulomb gauge there is a longitudinal color electric field associated with a static quark-antiquark pair. We have measured the spatial distribution of this field, and find that it falls off exponentially with transverse distance from a line joining the two quarks. In other words there is a Coulomb flux tube, with a width that is somewhat smaller than that of the minimal energy flux tube associated with the asymptotic string tension. A confinement criterion for gauge theories with matter fields is also proposed.
Perturbative ambiguities in Coulomb gauge QCD
International Nuclear Information System (INIS)
Doust, P.
1987-01-01
The naive Coulomb gauge Feynman rules in non-abelian gauge theory give rise to ambiguous integrals, in addition to the usual ultraviolet divergences. Generalizing the work of Cheng and Tsai, these ambiguities are resolved to all orders in perturbation theory, by defining a gauge that interpolates smoothly between the Feynman gauge and the Coulomb gauge. The extra terms V 1 +V 2 of Christ and Lee are identified with certain two-loop ambiguous terms. However, there still seem to be unsolved problems connected with renormalisation. copyright 1987 Academic Press, Inc
Coulomb dissociation of N 20,21
Röder, Marko; Adachi, Tatsuya; Aksyutina, Yulia; Alcantara, Juan; Altstadt, Sebastian; Alvarez-Pol, Hector; Ashwood, Nicholas; Atar, Leyla; Aumann, Thomas; Avdeichikov, Vladimir; Barr, M.; Beceiro, Saul; Bemmerer, Daniel; Benlliure, Jose; Bertulani, Carlos
2016-01-01
Neutron-rich light nuclei and their reactions play an important role in the creation of chemical elements. Here, data from a Coulomb dissociation experiment on N20,21 are reported. Relativistic N20,21 ions impinged on a lead target and the Coulomb dissociation cross section was determined in a kinematically complete experiment. Using the detailed balance theorem, the N19(n,γ)N20 and N20(n,γ)N21 excitation functions and thermonuclear reaction rates have been determined. The N19(n,γ)N20 rate is...
Directory of Open Access Journals (Sweden)
O'Connell Emer
2010-07-01
Full Text Available Abstract Background An understanding of the factors that encourage young women to accept, and discourage them from accepting, STI (sexually transmitted infection testing is needed to underpin opportunistic screening programs for the STI Chlamydia trachomatis (opportunistic screening involves healthcare professionals offering chlamydia tests to people while they are attending health services for reasons that are usually unrelated to their sexual health. We conducted a qualitative study to identify and explore: how young women would feel about being offered opportunistic tests for chlamydia?; how young women would like to be offered screening, and who they wanted to be offered screening by?; and what factors would influence young women's partner notification preferences for chlamydia (who they would notify in the event of a positive diagnosis of chlamydia, how they would want to do this. Methods Semi-structured interviews with 35 young women between eighteen and twenty nine years of age. The study was conducted in the Dublin and Galway regions of the Republic of Ireland. Young adults were recruited from General Practice (GP practices, Third Level College health services, Family Planning clinics and specialist STI treatment services. Results Respondents were worried that their identities would become stigmatised if they accepted screening. Younger respondents and those from lower socio-economic backgrounds had the greatest stigma-related concerns. Most respondents indicated that they would accept screening if it was offered to them, however; accepting screening was seen as a correct, responsible action to engage in. Respondents wanted to be offered screening by younger female healthcare professionals. Respondents were willing to inform their current partners about positive chlamydia diagnoses, but were more ambivalent about informing their previous partners. Conclusions If an effort is not put into reducing young women's stigma-related concerns the
Efficient evaluation of the Coulomb force in the Gaussian and finite-element Coulomb method.
Kurashige, Yuki; Nakajima, Takahito; Sato, Takeshi; Hirao, Kimihiko
2010-06-28
We propose an efficient method for evaluating the Coulomb force in the Gaussian and finite-element Coulomb (GFC) method, which is a linear-scaling approach for evaluating the Coulomb matrix and energy in large molecular systems. The efficient evaluation of the analytical gradient in the GFC is not straightforward as well as the evaluation of the energy because the SCF procedure with the Coulomb matrix does not give a variational solution for the Coulomb energy. Thus, an efficient approximate method is alternatively proposed, in which the Coulomb potential is expanded in the Gaussian and finite-element auxiliary functions as done in the GFC. To minimize the error in the gradient not just in the energy, the derived functions of the original auxiliary functions of the GFC are used additionally for the evaluation of the Coulomb gradient. In fact, the use of the derived functions significantly improves the accuracy of this approach. Although these additional auxiliary functions enlarge the size of the discretized Poisson equation and thereby increase the computational cost, it maintains the near linear scaling as the GFC and does not affects the overall efficiency of the GFC approach.
Comment on "Calculations for the one-dimensional soft Coulomb problem and the hard Coulomb limit".
Carrillo-Bernal, M A; Núñez-Yépez, H N; Salas-Brito, A L; Solis, Didier A
2015-02-01
In the referred paper, the authors use a numerical method for solving ordinary differential equations and a softened Coulomb potential -1/√[x(2)+β(2)] to study the one-dimensional Coulomb problem by approaching the parameter β to zero. We note that even though their numerical findings in the soft potential scenario are correct, their conclusions do not extend to the one-dimensional Coulomb problem (β=0). Their claims regarding the possible existence of an even ground state with energy -∞ with a Dirac-δ eigenfunction and of well-defined parity eigenfunctions in the one-dimensional hydrogen atom are questioned.
National Research Council Canada - National Science Library
Kocher, David C; Apostoaei, Julian A
2007-01-01
This report presents tabulations of equivalent doses of ionizing radiation, referred to as screening doses, that correspond to an estimated probablity of causation of specific cancers of approximately 50% at the upper 99% credibility limit...
Riaz, Muhammad; Ashfaq, Usman A; Qasim, Muhammad; Yasmeen, Erum; Ul Qamar, Muhammad T; Anwar, Farooq
2017-10-01
In most types of cancer, overexpression of murine double minute 2 (MDM2) often leads to inactivation of p53. The crystal structure of MDM2, with a 109-residue amino-terminal domain, reveals that MDM2 has a core hydrophobic region to which p53 binds as an amphipathic α helix. The interface depends on the steric complementarity between MDM2 and the hydrophobic region of p53. Especially, on p53's triad, amino acids Phe19, Trp23 and Leu26 bind to the MDM2 core. Results from studies suggest that the structural motif of both p53 and MDM2 can be attributed to similarities in the amphipathic α helix. Thus, in the current investigation it is hypothesized that the similarity in the structural motif might be the cause of p53 inactivation by MDM2. Hence, molecular docking and phytochemical screening approaches are appraised to inhibit the hydrophobic cleft of MDM2 and to stop p53-MDM2 interaction, resulting in reactivation of p53 activity. For this purpose, a library of 2295 phytochemicals were screened against p53-MDM2 to find potential candidates. Of these, four phytochemicals including epigallocatechin gallate, alvaradoin M, alvaradoin E and nordihydroguaiaretic acid were found to be potential inhibitors of p53-MDM2 interaction. The screened phytochemicals, derived from natural extracts, may have negligible side effects and can be explored as potent antagonists of p53-MDM2 interactions, resulting in reactivation of the normal transcription of p53.
Stamm, G; Eichbaum, G; Hagemann, G
1997-09-01
The following three screen-film combinations were compared: a) a combination of anticrossover film and UV-light emitting screens, b) a combination of blue-light emitting screens and film, and c) a conventional green fluorescing screen-film combination. Radiographs of a specially designed plexiglass phantom (0.2 x 0.2 x 0.12 m3) with bar patterns of lead and plaster and of air, respectively were obtained using the following parameters: 12 pulse generator, 0.6 mm focus size, 4.7 mm aluminum pre-filter, a grid with 40 lines/cm (12:1) and a focus-detector distance of 1.15 m. Image analysis was performed using an IBAS system and a Zeiss Kontron computer. Display conditions were the following: display distance 0.12 m, a vario film objective 35/70 (Zeiss), a video camera tube with a PbO photocathode, 625 lines (Siemens Heimann), an IBAS image matrix of 512 x 512 pixels with a resolution of 7 lines/mm, the projected matrix area was 5000 microns2. Grey scale ranges were measured on a line perpendicular to the grouped bar patterns. The difference between the maximum and minimum density value served as signal. The spatial resolution of the detector system was measured when the signal value was three times higher than the standard deviation of the means of multiple density measurements. The results showed considerable advantages of the two new screen-film combinations as compared to the conventional screen-film combination. The result was contradictory to the findings with pure visual assessment of thresholds (part I) that had found no differences. The authors concluded that (automatic) interactive image analysis algorithms serve as an objective measure and are specifically advantageous when small differences in image quality are to be evaluated.
Simplistic Coulomb Forces in Molecular Dynamics
DEFF Research Database (Denmark)
Hansen, Jesper Schmidt; Schrøder, Thomas; Dyre, J. C.
2012-01-01
In this paper we compare the Wolf method to the shifted forces (SF) method for efficient computer simulation of bulk systems with Coulomb forces, taking results from the Ewald summation and particle mesh Ewald methods as representing the true behavior. We find that for the Hansen–McDonald molten...
Coulomb's Electrical Measurements. Experiment No. 14.
Devons, Samuel
Presented is information related to the life and work of Charles Coulomb as well as detailed notes of his measurements of the distribution of electricity on conductors. The two methods that he used (the large torsion balance, and the timing of "force" oscillations) are described. (SA)
Coulomb Coupling Between Quantum Dots and Waveguides
National Research Council Canada - National Science Library
Porod, Wolfgang
2000-01-01
.... We considered both III-V and Si-based semiconductor systems. In later years, the AASERT award supported work on QCA realizations in Coulomb-blockade metal-dot systems, which were successful in demonstrating the basic QCA switching operation...
Generalized Coulomb gauge without Gribov ambiguity
Energy Technology Data Exchange (ETDEWEB)
Fachin, S.; Parrinello, C. (New York Univ., NY (United States). Physics Dept.)
1992-05-01
We discuss a global gauge-fixing prescription that is free of the Gribov problem, preserves reflection positivity and contains as a limiting case the (maximal) Coulomb gauge. In such a formalism it is very easy to check that only color singlet states propagate in Euclidean time, for any value of [beta]. (orig.).
Monotonicity and concavity in Coulomb systems
International Nuclear Information System (INIS)
Englisch, R.; Englisch, H.; Karl-Marx-Universitaet, Leipzig
1986-01-01
The eigenvalues of H(α) = H 0 + αH * , where H * is an arbitrary Coulomb potential, decrease with increasing α ≥ 0. Linear and parabolic bounds for the ground state energy are presented. These bounds are applied to the biexciton and the exciton at a neutral donor. (orig.)
Signatures of Coulomb fission: a theoretical study
International Nuclear Information System (INIS)
Oberacker, V.; Kruse, H.; Pinkston, W.T.; Greiner, W.
1979-01-01
Evidence for Coulomb fission (CF) is noted first. Then the Hamiltonian is set down and explained, and an expression for the CF probability of CF is obtained. Results are summarized. Figures show the CF probability of 238 U as a function of projectile charge number and the excitation functions for CF of 238 U by 184 W and 136 Xe. 3 figures
Interatomic Coulombic decay in helium nanodroplets
DEFF Research Database (Denmark)
Shcherbinin, Mykola; Laforge, Aaron; Sharma, Vandana
2017-01-01
, or in the droplet interior. ICD at the surface gives rise to energetic He+ ions as previously observed for free He dimers. ICD deeper inside leads to the ejection of slow He+ ions due to Coulomb explosion delayed by elastic collisions with neighboring He atoms, and to the formation of Hek+ complexes....
Flavivirus NS3 and NS5 proteins interaction network: a high-throughput yeast two-hybrid screen
Directory of Open Access Journals (Sweden)
Canard Bruno
2011-10-01
Full Text Available Abstract Background The genus Flavivirus encompasses more than 50 distinct species of arthropod-borne viruses, including several major human pathogens, such as West Nile virus, yellow fever virus, Japanese encephalitis virus and the four serotypes of dengue viruses (DENV type 1-4. Each year, flaviviruses cause more than 100 million infections worldwide, some of which lead to life-threatening conditions such as encephalitis or haemorrhagic fever. Among the viral proteins, NS3 and NS5 proteins constitute the major enzymatic components of the viral replication complex and are essential to the flavivirus life cycle. Results We report here the results of a high-throughput yeast two-hybrid screen to identify the interactions between human host proteins and the flavivirus NS3 and NS5 proteins. Using our screen results and literature curation, we performed a global analysis of the NS3 and NS5 cellular targets based on functional annotation with the Gene Ontology features. We finally created the first flavivirus NS3 and NS5 proteins interaction network and analysed the topological features of this network. Our proteome mapping screen identified 108 human proteins interacting with NS3 or NS5 proteins or both. The global analysis of the cellular targets revealed the enrichment of host proteins involved in RNA binding, transcription regulation, vesicular transport or innate immune response regulation. Conclusions We proposed that the selective disruption of these newly identified host/virus interactions could represent a novel and attractive therapeutic strategy in treating flavivirus infections. Our virus-host interaction map provides a basis to unravel fundamental processes about flavivirus subversion of the host replication machinery and/or immune defence strategy.
Coulomb Blockade of Tunnel-Coupled Quantum Dots
National Research Council Canada - National Science Library
Golden, John
1997-01-01
.... Though classical charging models can explain the Coulomb blockade of an isolated dot, they must be modified to explain the Coulomb blockade of dots coupled through the quantum mechanical tunneling of electrons...
Coulomb singularity effects in tunnelling spectroscopy of individual impurities
Arseyev, P. I.; Maslova, N. S.; Panov, V. I.; Savinov, S. V.
2002-01-01
Non-equilibrium Coulomb effects in resonant tunnelling processes through deep impurity states are analyzed. It is shown that Coulomb vertex corrections to the tunnelling transfer amplitude lead to a power-law singularity in current- voltage characteristics
Tornow, Sabine; Zwicknagl, Gertrud
2009-01-01
We investigate the transport characteristics of a redox system weakly coupled to leads in the Coulomb blockade regime. The redox system comprises a donor and acceptor separated by an insulating bridge in a solution. It is modeled by a two-site extended Hubbard model which includes on-site and inter-site Coulomb interactions and the coupling to a bosonic bath. The current voltage characteristics is calculated at high temperatures using a rate equation approach. For high voltages exceeding the ...
Description of the electron-hydrogen collision by the Coulomb Fourier transform method
International Nuclear Information System (INIS)
Levin, S.B.
2005-01-01
A recently developed Coulomb Fourier Transform method is applied to the system containing one heavy ion and two electrons. The transformed Hamiltonian is described with a controlled accuracy in an effective finite basis set as a finite dimensional operator matrix. The kernels of interaction are formulated in terms of the so called Nordsieck integrals
Elastic scattering study of three 4n nuclei systems above the Coulomb barrier
International Nuclear Information System (INIS)
Ashok Kumar; Sarita Kumar; Sunita Kumar
2000-01-01
A comprehensive study of elastic scattering of 4n nuclei, namely 16 O + 40 Ca, 24 Mg + 24 Mg and 32 S + 28 Si is carried out at various incident energies near and above the Coulomb barrier using a semi microscopic approach. In the present work real part of the nucleus-nucleus interaction is microscopically calculated using equivalence relation between RGM and GCM
Palatnik, Dmitriy
2002-01-01
In this note one suggests a possibility of direct observation of the $\\theta$-parameter, introduced in the Born--Infeld theory of electroweak and gravitational fields, developed in quant-ph/0202024. Namely, one may treat $\\theta$ as a universal constant, responsible for correction to the Coulomb and Newton laws, allowing direct interaction between electrical charges and masses.
Poisson equation in the Kohn-Sham Coulomb problem
Manby, F. R.; Knowles, Peter James
2001-01-01
We apply the Poisson equation to the quantum mechanical Coulomb problem for many-particle systems. By introducing a suitable basis set, the two-electron Coulomb integrals become simple overlaps. This offers the possibility of very rapid linear-scaling treatment of the Coulomb contribution to Kohn-Sham theory.
On the theory for Coulomb break-up of deuterons by atomic nuclei at low energy
International Nuclear Information System (INIS)
Grantsev, V.I.; Evlanov, M.V.
1982-01-01
The influence of a finite range of nuclear forces between nucleons in the deuteron on angular and energy distributions for products of deuteron disintegration by the Coulomb field of nucleus is investigated. This effect leads to the difference of differential cross sections of Coulomb deuteron disintegration from differential cross sections obtained in the framework of the approximation of the zero-radius interaction. Angular and energy dependences of differential cross sections of deuteron disintegration with the energy of 13.6 MeV on the 208 Pb nucleus are given [ru
Simulations of Coulomb systems confined by polarizable surfaces using periodic Green functions.
Dos Santos, Alexandre P; Girotto, Matheus; Levin, Yan
2017-11-14
We present an efficient approach for simulating Coulomb systems confined by planar polarizable surfaces. The method is based on the solution of the Poisson equation using periodic Green functions. It is shown that the electrostatic energy arising from the surface polarization can be decoupled from the energy due to the direct Coulomb interaction between the ions. This allows us to combine an efficient Ewald summation method, or any other fast method for summing over the replicas, with the polarization contribution calculated using Green function techniques. We apply the method to calculate density profiles of ions confined between the charged dielectric and metal surfaces.
Energy Technology Data Exchange (ETDEWEB)
Lara-Castells, María Pilar de, E-mail: Pilar.deLara.Castells@csic.es [Instituto de Física Fundamental (CSIC), Serrano 123, E-28006 Madrid (Spain); Fernández-Perea, Ricardo [Instituto de Estructura de la Materia (CSIC), Serrano 123, E-28006 Madrid (Spain); Madzharova, Fani; Voloshina, Elena, E-mail: elena.voloshina@hu-berlin.de [Humboldt-Universität zu Berlin, Institut für Chemie, Unter den Linden 6, 10099 Berlin (Germany)
2016-06-28
The adsorption of noble gases on metallic surfaces represents a paradigmatic case of van-der-Waals (vdW) interaction due to the role of screening effects on the corrugation of the interaction potential [J. L. F. Da Silva et al., Phys. Rev. Lett. 90, 066104 (2003)]. The extremely small adsorption energy of He atoms on the Mg(0001) surface (below 3 meV) and the delocalized nature and mobility of the surface electrons make the He/Mg(0001) system particularly challenging, even for state-of-the-art vdW-corrected density functional-based (vdW-DFT) approaches [M. P. de Lara-Castells et al., J. Chem. Phys. 143, 194701 (2015)]. In this work, we meet this challenge by applying two different procedures. First, the dispersion-corrected second-order Möller-Plesset perturbation theory (MP2C) approach is adopted, using bare metal clusters of increasing size. Second, the method of increments [H. Stoll, J. Chem. Phys. 97, 8449 (1992)] is applied at coupled cluster singles and doubles and perturbative triples level, using embedded cluster models of the metal surface. Both approaches provide clear evidences of the anti-corrugation of the interaction potential: the He atom prefers on-top sites, instead of the expected hollow sites. This is interpreted as a signature of the screening of the He atom by the metal for the on-top configuration. The strong screening in the metal is clearly reflected in the relative contribution of successively deeper surface layers to the main dispersion contribution. Aimed to assist future dynamical simulations, a pairwise potential model for the He/surface interaction as a sum of effective He–Mg pair potentials is also presented, as an improvement of the approximation using isolated He–Mg pairs.
A realistic solvable model for the Coulomb dissociation of neutron halo nuclei
International Nuclear Information System (INIS)
Baur, G.; Hencken, K.; Trautmann, D.
2003-01-01
As a model of a neutron halo nucleus we consider a neutron bound to an inert core by a zero range force. We study the breakup of this simple nucleus in the Coulomb field of a target nucleus. In the post-form DWBA (or, in our simple model CWBA (''Coulomb wave born approximation'')) an analytic solution for the T-matrix is known. We study limiting cases of this T-matrix. As it should be, we recover the Born approximation for weak Coulomb fields (i.e., for the relevant Coulomb parameters much smaller than 1). For strong Coulomb fields, high beam energies, and scattering to the forward region we find a result which is very similar to the Born result. It is only modified by a relative phase (close to 0) between the two terms and a prefactor (close to 1). A similar situation exists for bremsstrahlung emission. This formula can be related to the first order semiclassical treatment of the electromagnetic dissociation. Since our CWBA model contains the electromagnetic interaction between the core and the target nucleus to all orders, this means that higher order effects (including postacceleration effects) are small in the case of high beam energies and forward scattering. Our model also predicts a scaling behavior of the differential cross section, that is, different systems (with different binding energies, beam energies and scattering angles) show the same dependence on two variables x and y. (orig.)
International Nuclear Information System (INIS)
Wolf, D.; Keblinski, P.; Phillpot, S.R.; Eggebrecht, J.
1999-01-01
Based on a recent result showing that the net Coulomb potential in condensed ionic systems is rather short ranged, an exact and physically transparent method permitting the evaluation of the Coulomb potential by direct summation over the r -1 Coulomb pair potential is presented. The key observation is that the problems encountered in determining the Coulomb energy by pairwise, spherically truncated r -1 summation are a direct consequence of the fact that the system summed over is practically never neutral. A simple method is developed that achieves charge neutralization wherever the r -1 pair potential is truncated. This enables the extraction of the Coulomb energy, forces, and stresses from a spherically truncated, usually charged environment in a manner that is independent of the grouping of the pair terms. The close connection of our approach with the Ewald method is demonstrated and exploited, providing an efficient method for the simulation of even highly disordered ionic systems by direct, pairwise r -1 summation with spherical truncation at rather short range, i.e., a method which fully exploits the short-ranged nature of the interactions in ionic systems. The method is validated by simulations of crystals, liquids, and interfacial systems, such as free surfaces and grain boundaries. copyright 1999 American Institute of Physics
Long-Range Coulomb Effect in Intense Laser-Driven Photoelectron Dynamics.
Quan, Wei; Hao, XiaoLei; Chen, YongJu; Yu, ShaoGang; Xu, SongPo; Wang, YanLan; Sun, RenPing; Lai, XuanYang; Wu, ChengYin; Gong, QiHuang; He, XianTu; Liu, XiaoJun; Chen, Jing
2016-06-03
In strong field atomic physics community, long-range Coulomb interaction has for a long time been overlooked and its significant role in intense laser-driven photoelectron dynamics eluded experimental observations. Here we report an experimental investigation of the effect of long-range Coulomb potential on the dynamics of near-zero-momentum photoelectrons produced in photo-ionization process of noble gas atoms in intense midinfrared laser pulses. By exploring the dependence of photoelectron distributions near zero momentum on laser intensity and wavelength, we unambiguously demonstrate that the long-range tail of the Coulomb potential (i.e., up to several hundreds atomic units) plays an important role in determining the photoelectron dynamics after the pulse ends.
Frictional Magneto-Coulomb Drag in Graphene Double-Layer Heterostructures.
Liu, Xiaomeng; Wang, Lei; Fong, Kin Chung; Gao, Yuanda; Maher, Patrick; Watanabe, Kenji; Taniguchi, Takashi; Hone, James; Dean, Cory; Kim, Philip
2017-08-04
Coulomb interaction between two closely spaced parallel layers of conductors can generate the frictional drag effect by interlayer Coulomb scattering. Employing graphene double layers separated by few-layer hexagonal boron nitride, we investigate density tunable magneto- and Hall drag under strong magnetic fields. The observed large magnetodrag and Hall-drag signals can be related with Laudau level filling status of the drive and drag layers. We find that the sign and magnitude of the drag resistivity tensor can be quantitatively correlated to the variation of magnetoresistivity tensors in the drive and drag layers, confirming a theoretical formula for magnetodrag in the quantum Hall regime. The observed weak temperature dependence and ∼B^{2} dependence of the magnetodrag are qualitatively explained by Coulomb scattering phase-space argument.
Calculation of proton-deuteron phase parameters including the Coulomb force
International Nuclear Information System (INIS)
Alt, E.O.; Sandhas, W.; Ziegelmann, H.
1985-04-01
A previously proposed exact method for including the Coulomb force in three-body collisions is applied to proton-deuteron scattering. We present phase shifts for angular momenta up to L=9, from elastic threshold to 50 MeV proton laboratory energy. Separable rank-one potentials are taken for the nuclear interactions. A charge-independent and a charge-symmetric choise, while leading to different neutron-deuteron and proton-deuteron phase parameters, nevertheless yields practically the same Coulomb corrections. We, moreover, investigate the question of P-wave resonances.A critical comparison of our results with those obtained in a co-ordinate space formalism is performed. Furthermore, proposals for an approximate inclusion of the Coulomb potential are tested, and found unsatisfactory. (orig.)
Surakka, Ida; Isaacs, Aaron; Karssen, Lennart C.; Laurila, Pirkka-Pekka P.; Middelberg, Rita P. S.; Tikkanen, Emmi; Ried, Janina S.; Lamina, Claudia; Mangino, Massimo; Igl, Wilmar; Hottenga, Jouke-Jan; Lagou, Vasiliki; van der Harst, Pim; Mateo Leach, Irene; Esko, Tonu; Kutalik, Zoltan; Wainwright, Nicholas W.; Struchalin, Maksim V.; Sarin, Antti-Pekka; Kangas, Antti J.; Viikari, Jorma S.; Perola, Markus; Rantanen, Taina; Petersen, Ann-Kristin; Soininen, Pasi; Johansson, Asa; Soranzo, Nicole; Heath, Andrew C.; Papamarkou, Theodore; Prokopenko, Inga; Toenjes, Anke; Kronenberg, Florian; Doering, Angela; Rivadeneira, Fernando; Montgomery, Grant W.; Whitfield, John B.; Kahonen, Mika; Lehtimaki, Terho; Freimer, Nelson B.; Willemsen, Gonneke; de Geus, Eco J. C.; Palotie, Aarno; Sandhu, Manj S.; Waterworth, Dawn M.; Metspalu, Andres; Stumvoll, Michael; Uitterlinden, Andre G.; Navis, Gerjan; Wijmenga, Cisca; Wolffenbuttel, Bruce H. R.
2011-01-01
Recent genome-wide association (GWA) studies described 95 loci controlling serum lipid levels. These common variants explain similar to 25% of the heritability of the phenotypes. To date, no unbiased screen for gene-environment interactions for circulating lipids has been reported. We screened for
Surakka, I.; Isaacs, A.; Karssen, L.C.; Laurila, P.P.P.; Middelberg, R.P.S.; Tikkanen, E.; Ried, J.S.; Lamina, C.; Mangino, M.; Igl, W.; Hottenga, J.J.; Lagou, V.; van der Harst, P.; Mateo Leach, I.; Esko, T.; Kutalik, Z.; Wainwright, N.W.; Struchalin, M.V.; Sarin, A.P.; Kangas, A.J.; Viikari, J.S.; Perola, M.; Rantanen, T.; Petersen, A.K.; Soininen, P.; Johansson, Å.; Soranzo, N.; Heath, A.C.; Papamarkou, T.; Prokopenko, I.; Tönjes, A.; Kronenberg, F.; Döring, A.; Rivadeneira, F.; Montgomery, GW; Whitfield, J.B.; Kähönen, M.; Lehtimäki, T.; Freimer, N.B.; Willemsen, G.; de Geus, E.J.C.; Palotie, A.; Sandhu, M.S.; Waterworth, D.; Metspalu, A.; Stumvoll, M.; Uitterlinden, A.G.; Navis, G.; Wijmenga, C.; Wolffenbuttel, B.H.R.; Taskinen, M.R.; Ala-Korpela, M.; Kaprio, J.; Kyvik, K.O.; Boomsma, D.I.; Pedersen, N.L.; Gyllensten, U.; Wilson, J.F.; Rudan, I.; Campbell, H.; Pramstaller, P.P.; Spector, T.D.; Witteman, J.C.M.; Eriksson, J.G.; Salomaa, V.; Oostra, B.A.; Raitakari, O.T.; Wichmann, H.E.; Gieger, C.; Järvelin, M.J.; Martin, N.G.; Hofman, A.; McCarthy, M.I.; Peltonen, L.; van Duijn, C.M.; Aulchenko, Y.S.; Ripatti, S.
2011-01-01
Recent genome-wide association (GWA) studies described 95 loci controlling serum lipid levels. These common variants explain ~25% of the heritability of the phenotypes. To date, no unbiased screen for gene-environment interactions for circulating lipids has been reported. We screened for variants
I. Surakka (Ida); A.J. Isaacs (Aaron); L.C. Karssen (Lennart); P.-P.P. Laurila; R.P.S. Middelberg (Rita); E. Tikkanen (Emmi); J.S. Ried (Janina); C. Lamina (Claudia); M. Mangino (Massimo); W. Igl (Wilmar); J.J. Hottenga (Jouke Jan); V. Lagou (Vasiliki); P. van der Harst (Pim); I.M. Leach (Irene Mateo); T. Esko (Tõnu); Z. Kutalik (Zoltán); N.W. Wainwright (Nicholas); M.V. Struchalin (Maksim); A.-P. Sarin; A.J. Kangas (Antti); J. Viikari (Jorma); M. Perola (Markus); T. Rantanen (Taina); A.K. Petersen; P. Soininen (Pasi); A. Johansson (Åsa); N. Soranzo (Nicole); A.C. Heath (Andrew); T. Papamarkou (Theodore); I. Prokopenko (Inga); A. Tönjes (Anke); F. Kronenberg (Florian); A. Döring (Angela); F. Rivadeneira Ramirez (Fernando); G.W. Montgomery (Grant); J.B. Whitfield (John); M. Kähönen (Mika); T. Lehtimäki (Terho); N.B. Freimer (Nelson); G.A.H.M. Willemsen (Gonneke); E.J.C. de Geus (Eco); A. Palotie (Aarno); M.S. Sandhu (Manj); D. Waterworth (Dawn); A. Metspalu (Andres); M. Stumvoll (Michael); A.G. Uitterlinden (André); A. Jula (Antti); G. Navis (Gerjan); C. Wijmenga (Cisca); B.H.R. Wolffenbuttel (Bruce); M.-R. Taskinen; M. Ala-Korpela (Mika); J. Kaprio (Jaakko); K.O. Kyvik (Kirsten Ohm); D.I. Boomsma (Dorret); N.L. Pedersen (Nancy); U. Gyllensten (Ulf); J.F. Wilson (James); I. Rudan (Igor); H. Campbell (Harry); P.P. Pramstaller (Peter Paul); T.D. Spector (Timothy); J.C.M. Witteman (Jacqueline); J.G. Eriksson (Johan); V. Salomaa (Veikko); B.A. Oostra (Ben); O. Raitakari (Olli); H.E. Wichmann (Heinz Erich); C. Gieger (Christian); M.R. Järvelin; N.G. Martin (Nicholas); A. Hofman (Albert); M.I. McCarthy (Mark); Y.S. Aulchenko (Yurii); L. Peltonen (Leena Johanna); P. Tikka-Kleemola (Päivi); S. Ripatti (Samuli)
2011-01-01
textabstractRecent genome-wide association (GWA) studies described 95 loci controlling serum lipid levels. These common variants explain ~25% of the heritability of the phenotypes. To date, no unbiased screen for gene-environment interactions for circulating lipids has been reported. We screened for
P-matrix description of charged particles interaction
International Nuclear Information System (INIS)
Babenko, V.A.; Petrov, N.M.
1992-01-01
The paper deals with formalism of the P-matrix description of two charged particles interaction. Separation in the explicit form of the background part corresponding to the purely Coulomb interaction in the P-matrix is proposed. Expressions for the purely Coulomb P-matrix, its poles, residues and purely Coulomb P-matrix approach eigenfunctions are obtained. (author). 12 refs
Okamoto, Haruka; Hamaguchi, Ryohei; Kuroda, Yukihiro
2017-04-15
Cationic amphiphilic drugs (CADs) can induce the hyperaccumulation of phospholipids in cells and tissues. This side effect, which is known as drug-induced phospholipidosis, is sometimes problematic in the development and clinical use of CADs. It is known that CADs generally interact with phospholipids via both hydrophobic and acid-base interactions, and CADs with the larger affinity to phospholipid exhibit the larger induction risk. To develop a chromatographic assay system to predict the phospholipidosis-inducing potential with considering the acid-base interaction between CAD and phosphate group of phospholipid, hydrophilic interaction chromatographic (HILIC) methods were tested in this study. First, a PC HILIC column with phosphocholine groups on a packed material was used. The acid-base or other hydrophilic interactions to the stationary phase differed among basic drugs, and retention to the PC HILIC column did not accurately reflect the induction potential of phospholipidosis. As an alternative HILIC approach, the elution of CADs with the phosphate buffer from an amide column was tested. The elution effect, which is expressed as ratio of retention factors between different phosphate content in the mobile phase, closely correlated with the induction potential. Using the elution effect and retention factor to a reversed-phase HPLC column, the phospholipidosis-inducing drugs were clearly discriminated from the non-inducers. These results suggest that the proposed chromatographic approach can screen phospholipidosis-inducing drugs. Copyright © 2017 Elsevier B.V. All rights reserved.
Core polarization and Coulomb displacement energies
International Nuclear Information System (INIS)
Shlomo, S.; Love, W.G.
1982-01-01
The contributions of core polarization terms (other than the Auerbach-Kahana-Weneser (AKW) effect) to Coulomb displacement energies of mirror nuclei near A = 16 and A = 40 are examined within the particle-vibration coupling model. The parameters of the model are determined using updated data on the locations and strengths of multipole core excitations. In the absence of relevant data an energy-weighted sum rule (EWSR) is exploited. Taking into account multipole excitations up to L = 5 and subtracting the contributions which are due to short-range correlations, significant contributions (1-3%) to ΔEsub(c) are found. These corrections arise from particle coupling to low-lying collective states (long-range correlations). The implications of these results on the Coulomb energy problem are discussed. (Auth.)
Influence of screening effect on hydrogen passivation of hole silicon
Aleksandrov, O V
2002-01-01
The simulation of hole silicon passivation during hydrogen diffusion with account of hydrogen-acceptor pairs formation, internal electrical field and screening effect has been carried out. Screening by free carriers of hydrogen and acceptor ions results in shortening their interaction radii and slacking the concentration dependence of hydrogen diffusivity at high level of silicon doping. The consistency of simulated and experimental profiles of holes and hydrogen-acceptor pairs is reached in a broad band of doping levels from 4 x 10 sup 1 sup 4 to 1.2 x 10 sup 2 sup 0 cm sup - sup 3 at the pair binding energy of 0.70-0.79 eV while the radius of the Coulomb interaction of hydrogen and boron ions is equal to 35 A under low doping and decrease with increasing doping level
Influence of screening effect on hydrogen passivation of hole silicon
International Nuclear Information System (INIS)
Aleksandrov, O.V.
2002-01-01
The simulation of hole silicon passivation during hydrogen diffusion with account of hydrogen-acceptor pairs formation, internal electrical field and screening effect has been carried out. Screening by free carriers of hydrogen and acceptor ions results in shortening their interaction radii and slacking the concentration dependence of hydrogen diffusivity at high level of silicon doping. The consistency of simulated and experimental profiles of holes and hydrogen-acceptor pairs is reached in a broad band of doping levels from 4 x 10 14 to 1.2 x 10 20 cm -3 at the pair binding energy of 0.70-0.79 eV while the radius of the Coulomb interaction of hydrogen and boron ions is equal to 35 A under low doping and decrease with increasing doping level [ru
Li, Qun; Laumonnier, Yves; Syrovets, Tatiana; Simmet, Thomas
2011-11-01
To identify proteins that interact with the C-terminal fragment of annexin A2 (A2IC), generated by plasmin cleavage of the plasmin receptor, a heterotetramer (AA2t) containing annexin A2. The gene that encodes the A2IC fragment was obtained from PCR-amplified cDNA isolated from human monocytes, and was ligated into the pBTM116 vector using a DNA ligation kit. The resultant plasmid (pBTM116-A2IC) was sequenced with an ABI PRISM 310 Genetic Analyzer. The expression of an A2IC bait protein fused with a LexA-DNA binding domain (BD) was determined using Western blot analysis. The identification of proteins that interact with A2IC and are encoded in a human monocyte cDNA library was performed using yeast two-hybrid screening. The DNA sequences of the relevant cDNAs were determined using an ABI PRISM BigDye terminator cycle sequencing ready reaction kit. Nucleotide sequence databases were searched for homologous sequences using BLAST search analysis (http://www.ncbi.nlm.nih.gov). Confirmation of the interaction between the protein LexA-A2IC and each of cathepsin S and SNX17 was conducted using a small-scale yeast transformation and X-gal assay. The yeast transformed with plasmids encoding the bait proteins were screened with a human monocyte cDNA library by reconstituting full-length transcription factors containing the GAL4-active domain (GAL4-AD) as the prey in a yeast two-hybrid approach. After screening 1×10(7) clones, 23 independent β-Gal-positive clones were identified. Sequence analysis and a database search revealed that 15 of these positive clones matched eight different proteins (SNX17, ProCathepsin S, RPS2, ZBTB4, OGDH, CCDC32, PAPD4, and actin which was already known to interact with annexin A2). A2IC A2IC interacts with various proteins to form protein complexes, which may contribute to the molecular mechanism of monocyte activation induced by plasmin. The yeast two-hybrid system is an efficient approach for investigating protein interactions.
Kristensen, S; Orsteen, A L; Sande, S A; Tønnesen, H H
1994-10-01
The drugs commonly used in the treatment of malaria are photochemically unstable. Several of these compounds accumulate in melanin-rich tissues and cause toxic reactions which may be light induced. As part of the screening of the photochemical properties and phototoxic capabilities of antimalarials, the in vitro interaction of eight antimalarials with melanin was studied. The dissociation constant for the drug-melanin complex and the relative number of binding sites on melanin were estimated for six of the drugs using a curve-fitting program. The reaction rate for the formation of the melanin-drug complex was determined, and the complexes were further characterized by zeta potential measurements.
Nuclear sizes and the Coulomb Displacement Energy
International Nuclear Information System (INIS)
Van der Werf, S.Y.
1997-01-01
Data on Coulomb Displacement Energies in the mass range A = 40 - 240 are analyzed in the deformed Liquid Drop model and in the independent particle model. Reduced half-widths of Woods-Saxon mean-field potential of the resulting neutron-excess distributions are deduced. It is argued that the Nolen-Schiffer anomaly may be lifted by allowing for a slight binding-energy dependence of the mean-field potential geometry. (author)
Chaos near the Coulomb barrier. Nuclear molecules
International Nuclear Information System (INIS)
Strayer, M.R.
1984-01-01
The present work examines in detail the classical behavior of the α + 14 C and the 12 C + 12 C(O + ) collison at energies near the Coulomb barrier. The long-time motion of the compound nuclear system is identified in terms of its classical quasiperiodic and chaotic behavior. The consequences of this motion are discussed and interpreted in terms of the evolution of the system along a dynamical energy surface. 45 references
Coulomb dissociation studies for astrophysical thermonuclear reactions
Energy Technology Data Exchange (ETDEWEB)
Motobayashi, T [Dept. of Physics, Rikkyo Univ., Toshima, Tokyo (Japan)
1998-06-01
The Coulomb dissociation method was applied to several radiative capture processes of astrophysical interest. The method has an advantage of high experimental efficiency, which allow measurements with radioactive nuclear beams. The reactions {sup 13}N(p,{gamma}){sup 14}O and {sup 7}Be(p,{gamma}){sup 8}B are mainly discussed. They are the key reaction in the hot CNO cycle in massive stars and the one closely related to the solar neutrino problem, respectively. (orig.)
Coulomb excitation of radioactive 20, 21Na
Schumaker, M. A.; Cline, D.; Hackman, G.; Pearson, C.; Svensson, C. E.; Wu, C. Y.; Andreyev, A.; Austin, R. A. E.; Ball, G. C.; Bandyopadhyay, D.; Becker, J. A.; Boston, A. J.; Boston, H. C.; Buchmann, L.; Churchman, R.; Cifarelli, F.; Cooper, R. J.; Cross, D. S.; Dashdorj, D.; Demand, G. A.; Dimmock, M. R.; Drake, T. E.; Finlay, P.; Gallant, A. T.; Garrett, P. E.; Green, K. L.; Grint, A. N.; Grinyer, G. F.; Harkness, L. J.; Hayes, A. B.; Kanungo, R.; Lisetskiy, A. F.; Leach, K. G.; Lee, G.; Maharaj, R.; Martin, J.-P.; Moisan, F.; Morton, A. C.; Mythili, S.; Nelson, L.; Newman, O.; Nolan, P. J.; Orce, J. N.; Padilla-Rodal, E.; Phillips, A. A.; Porter-Peden, M.; Ressler, J. J.; Roy, R.; Ruiz, C.; Sarazin, F.; Scraggs, D. P.; Waddington, J. C.; Wan, J. M.; Whitbeck, A.; Williams, S. J.; Wong, J.
2009-12-01
The low-energy structures of the radioactive nuclei 20, 21Na have been examined using Coulomb excitation at the TRIUMF-ISAC radioactive ion beam facility. Beams of ˜ 5×106 ions/s were accelerated to 1.7MeV/A and Coulomb excited in a 0.5mg/cm^2 natTi target. Two TIGRESS HPGe clover detectors perpendicular to the beam axis were used for γ -ray detection, while scattered nuclei were observed by the Si detector BAMBINO. For 21Na , Coulomb excitation from the 3/2+ ground state to the first excited 5/2+ state was observed, while for 20Na , Coulomb excitation was observed from the 2+ ground state to the first excited 3+ and 4+ states. For both beams, B ( λ L) values were determined using the 2+ rightarrow 0+ de-excitation in 48Ti as a reference. The resulting B( E2) ↓ value for 21Na is 137±9 e^2fm^4, while the resulting B( λ L) ↓ values for 20Na are 55±6 e^2fm^4 for the 3+ rightarrow 2+ , 35.7±5.7 e^2 fm^4 for the 4+ rightarrow 2+ , and 0.154±0.030 μ_ N^2 for the 4+ rightarrow 3+ transitions. This analysis significantly improves the measurement of the 21Na B( E2) value, and provides the first experimental determination of B( λ L) values for the proton dripline nucleus 20Na .-1
How to calculate the Coulomb scattering amplitude
International Nuclear Information System (INIS)
Grosse, H.; Narnhofer, H.; Thirring, W.
1974-01-01
The derivation of scattering amplitudes for Coulomb scattering is discussed. A derivation of the S-matrix elements for a dense set of states in momentum space is given in the framework of time dependent scattering theory. The convergence of the S-matrix is studied. A purely algebraic derivation of the S-matrix elements and phase shifts is also presented. (HFdV)
A novel glutamine–RNA interaction identified by screening libraries in mammalian cells
Tan, Ruoying; Frankel, Alan D.
1998-01-01
The arginine-rich motif provides a versatile framework for RNA recognition in which few amino acids other than arginine are needed to mediate specific binding. Using a mammalian screening system based on transcriptional activation by HIV Tat, we identified novel arginine-rich peptides from combinatorial libraries that bind tightly to the Rev response element of HIV. Remarkably, a single glutamine, but not asparagine, within a stretch of polyarginine can mediate high-affinity binding. These re...
Regularization of the Coulomb scattering problem
International Nuclear Information System (INIS)
Baryshevskii, V.G.; Feranchuk, I.D.; Kats, P.B.
2004-01-01
The exact solution of the Schroedinger equation for the Coulomb potential is used within the scope of both stationary and time-dependent scattering theories in order to find the parameters which determine the regularization of the Rutherford cross section when the scattering angle tends to zero but the distance r from the center remains finite. The angular distribution of the particles scattered in the Coulomb field is studied on rather a large but finite distance r from the center. It is shown that the standard asymptotic representation of the wave functions is inapplicable in the case when small scattering angles are considered. The unitary property of the scattering matrix is analyzed and the 'optical' theorem for this case is discussed. The total and transport cross sections for scattering the particle by the Coulomb center proved to be finite values and are calculated in the analytical form. It is shown that the effects under consideration can be important for the observed characteristics of the transport processes in semiconductors which are determined by the electron and hole scattering by the field of charged impurity centers
Coulomb explosion of large penetrating molecular clusters
International Nuclear Information System (INIS)
Wegner, H.E.; Thieberger, P.
1981-01-01
The main purpose of these Coulomb explosion measurements is to determine what kind of structure these and other complex molecules may have and also to determine what other special phenomena may come into play as these complex molecules pass through matter. Although the first preliminary measurements involving the Coulomb explosion of these molecules was reported at this workshop last year, the results are briefly summarized before going on to the more recent measurements obtained with a completely new kind of detector system. This new image intensifier detector system, coupled with a microcomputer, has proven to be a valuable tool in the study of the Coulomb explosion of complex molecules that penetrate matter. In the future, with some additional improvements in the system, and much better statistics for most of the molecules studied to date, it is expected that much new information will be gained about the structure of many kinds of complex molecular ions including the special effects that may be encountered when these fast molecular ions penetrate matter
Cold transfer between deformed, Coulomb excited nuclei
International Nuclear Information System (INIS)
Bauer, H.
1998-01-01
The scattering system 162 Dy → 116 Sn has been examined at energies in the vicinity of the Coulomb barrier using the Heidelberg-Darmstadt Crystal Ball spectrometer combined with 5 Germanium-CLUSTER detectors. In order to study pairing correlations as a function of angular momentum cold events were selected in the 2n stripping channel by identifying and suppressing the dominant hot part of the transfer with the Crystal Ball. The CLUSTER detectors with their high γ-efficiency were used to identify the transfer channel and to resolve individual final states. Cross sections for the population of individual yrast states in a cold transfer reaction have been measured for the first time indicating the strong influence of higher transfer multipolarities. At small surface distances Coulomb-nuclear interferences were found to be responsible for the stronger decline of the population of higher yrast states in the transfer channel as compared to the Coulex channel. As a preparatory study for 2n transfer measurements between high spin yrast states in the backbending region of deformed nuclei the Coulomb excitation process in the crossing region of two bands in 162 Dy has been analyzed. The gross properties of the measured population probabilities could be interpreted in a simple band mixing model. (orig.)
Transient dynamics in cavity electromagnetically induced transparency with ion Coulomb crystals
Albert, Magnus; Dantan, Aurélien; Drewsen, Michael
2018-03-01
We experimentally investigate the transient dynamics of an optical cavity field interacting with large ion Coulomb crystals in a situation of electromagnetically induced transparency (EIT). EIT is achieved by injecting a probe field at the single photon level and a more intense control field with opposite circular polarization into the same mode of an optical cavity to couple Zeeman substates of a metastable level in ? ions. The EIT interaction dynamics are investigated both in the frequency-domain - by measuring the probe field steady state reflectivity spectrum - and in the time-domain - by measuring the progressive buildup of transparency. The experimental results are observed to be in excellent agreement with theoretical predictions taking into account the inhomogeneity of the control field in the interaction volume, and confirm the high degree of control on light-matter interaction that can be achieved with ion Coulomb crystals in optical cavities.
The Kosterlitz-thouless phase transition in two-dimensional hierarchical Coulomb gases
International Nuclear Information System (INIS)
Marchetti, D.H.U.; Perez, J.F.
1988-11-01
A hierarchical version of two-dimensional lattice Coulomb gases is investigated. For β>β c = 8Π there is a locally stable line of fixed points for the Renormalization Group ('block charges') transformations. For β>β - c (β c ≤β - c ≤3Π/2 β c ), these fixed points are globally stable. As a consequence, there is no screening of external charges for any activity if β > β - c . At β c a supercritical bifurcation takes place and the behavior of the model for β c as to show a weak form of screening, is investigated. (author) [pt
Maxwell-Chern-Simons theory in covariant and Coulomb gauges
International Nuclear Information System (INIS)
Haller, K.; Lim-Lombridas, E.
1996-01-01
We quantize quantum electrodynamics in 2 + 1 dimensions coupled to a Chern-Simons (CS) term and a charged spinor field, in covariant gauges and in the Coulomb gauge. The resulting Maxwell-Chern-Simons (MCS) theory describes charged fermions interacting with each other and with topologically massive propagating photons. We impose Gauss's law and the gauge conditions and investigate their effect on the dynamics and on the statistics of n-particle states. We construct charged spinor states that obey Gauss's law and the gauge conditions and transform the theory to representations in which these states constitute a Fock space. We demonstrate that, in these representations, the nonlocal interactions between charges and between charges and transverse currents-along with the interactions between currents and massive propagating photons-are identical in the different gauges we analyze in this and in earlier work. We construct the generators of the Poincare group, show that they implement the Poincare algebra, and explicitly demonstrate the effect of rotations and Lorentz boosts on the particle states. We show that the imposition of Gauss's law does not produce any open-quotes exoticclose quotes fractional statistics. In the case of the covariant gauges, this demonstration makes use of unitary transformations that provide charged particles with the gauge fields required by Gauss's law, but that leave the anticommutator algebra of the spinor fields untransformed. In the Coulomb gauge, we show that the anticommutators of the spinor fields apply to the Dirac-Bergmann constraint surfaces, on which Gauss's law and the gauge conditions obtain. We examine MCS theory in the large CS coupling constant limit, and compare that limiting form with CS theory, in which the Maxwell kinetic energy term is not included in the Larangian. 34 refs
Ihlow, Alexander; Schweizer, Patrick; Seiffert, Udo
2008-01-23
To find candidate genes that potentially influence the susceptibility or resistance of crop plants to powdery mildew fungi, an assay system based on transient-induced gene silencing (TIGS) as well as transient over-expression in single epidermal cells of barley has been developed. However, this system relies on quantitative microscopic analysis of the barley/powdery mildew interaction and will only become a high-throughput tool of phenomics upon automation of the most time-consuming steps. We have developed a high-throughput screening system based on a motorized microscope which evaluates the specimens fully automatically. A large-scale double-blind verification of the system showed an excellent agreement of manual and automated analysis and proved the system to work dependably. Furthermore, in a series of bombardment experiments an RNAi construct targeting the Mlo gene was included, which is expected to phenocopy resistance mediated by recessive loss-of-function alleles such as mlo5. In most cases, the automated analysis system recorded a shift towards resistance upon RNAi of Mlo, thus providing proof of concept for its usefulness in detecting gene-target effects. Besides saving labor and enabling a screening of thousands of candidate genes, this system offers continuous operation of expensive laboratory equipment and provides a less subjective analysis as well as a complete and enduring documentation of the experimental raw data in terms of digital images. In general, it proves the concept of enabling available microscope hardware to handle challenging screening tasks fully automatically.
Coulomb Problem for Z > Zcr in Doped Graphene
Kuleshov, V. M.; Mur, V. D.; Fedotov, A. M.; Lozovik, Yu. E.
2017-12-01
The dynamics of charge carriers in doped graphene, i.e., graphene with a gap in the energy spectrum depending on the substrate, in the presence of a Coulomb impurity with charge Z is considered within the effective two-dimensional Dirac equation. The wave functions of carriers with conserved angular momentum J = M + 1/2 are determined for a Coulomb potential modified at small distances. This case, just as any two-dimensional physical system, admits both integer and half-integer quantization of the orbital angular momentum in plane, M = 0, ±1, ±2, …. For J = 0, ±1/2, ±1, critical values of the effective charge Z cr( J, n) are calculated for which a level with angular momentum J and radial quantum numbers n = 0 and n = 1 reaches the upper boundary of the valence band. For Z function of charge Z for the lowest values of orbital angular momentum M, the level with J = 0 being the first to descend to the band edge. For Z > Z cr ( J, n = 0), scattering phases are calculated as a function of hole energy for several values of supercriticality, as well as the positions ɛ0 and widths γ of quasistationary states as a function of supercriticality. The values of ɛ0* and width γ* are pointed out for which quasidiscrete levels may show up as Breit-Wigner resonances in the scattering of holes by a supercritical impurity. Since the phases are real, the partial scattering matrix is unitary, so that the radial Dirac equation is consistent even for Z > Z cr. In this single-particle approximation, there is no spontaneous creation of electron-hole pairs, and the impurity charge cannot be screened by this mechanism.
Coulomb-Fourier representation approach to three-body scattering with charged particles
International Nuclear Information System (INIS)
Alt, E.O.; Levin, S.B.; Yakovlev, S.L.
2004-01-01
We present a novel approach for calculating charged-composite particle scattering. It consists in eliminating by means of a suitably chosen representation that part of the interaction which is of longest range and, hence, gives rise to all the troublesome features which plague charged particle scattering theories. In this paper only the simplest case is considered, namely that of two charged and one neutral particles which interact via pairwise strong potentials, and a repulsive Coulomb potential between the charged particles
Coulomb-free and Coulomb-distorted recolliding quantum orbits in photoelectron holography
Maxwell, A. S.; Figueira de Morisson Faria, C.
2018-06-01
We perform a detailed analysis of the different types of orbits in the Coulomb quantum orbit strong-field approximation (CQSFA), ranging from direct to those undergoing hard collisions. We show that some of them exhibit clear counterparts in the standard formulations of the strong-field approximation for direct and rescattered above-threshold ionization, and show that the standard orbit classification commonly used in Coulomb-corrected models is over-simplified. We identify several types of rescattered orbits, such as those responsible for the low-energy structures reported in the literature, and determine the momentum regions in which they occur. We also find formerly overlooked interference patterns caused by backscattered Coulomb-corrected orbits and assess their effect on photoelectron angular distributions. These orbits improve the agreement of photoelectron angular distributions computed with the CQSFA with the outcome of ab initio methods for high energy phtotoelectrons perpendicular to the field polarization axis.
Electromagnetic excitation with very heavy ions at and above the Coulomb barrier
International Nuclear Information System (INIS)
Wollersheim, H.J.
1988-08-01
The present report is part of a systematic study of the electromagnetic properties of strongly deformed and shape transitional nuclei carried out at GSI. The high efficiency particle-gamma detector system is described to perform multiple Coulomb excitation experiments with very heavy projectiles. Some results obtained for the shape transitional nucleus 196 Pt will be presented to exemplify the importance of having access to both the level energies and the E2-transition matrix elements when discussing the possible structure of these states. The second part of this paper is devoted to transfer reactions between very heavy nuclei. In contrast to light projectiles heavy ions offer the possibility to study new phenomena which originate in the much larger Coulomb contribution to the total interaction. In particular, heavy deformed nuclei will be Coulomb excited by the strong electromagnetic field to high spin states already at the time when they start interacting through the nuclear forces. The particle transfer therefore takes place mainly between excited collective states and thus should give information about the interplay between single-particle degrees of freedom, pair correlations and collective excitations. In this paper results of experiments will be reported in which nuclei from the rare earth and the actinide region have been bombarded by 206,208 Pb projectiles at incident energies near the Coulomb barrier. (orig./HSI)
Imaging of Coulomb-Driven Quantum Hall Edge States
Lai, Keji
2011-10-01
The edges of a two-dimensional electron gas (2DEG) in the quantum Hall effect (QHE) regime are divided into alternating metallic and insulating strips, with their widths determined by the energy gaps of the QHE states and the electrostatic Coulomb interaction. Local probing of these submicrometer features, however, is challenging due to the buried 2DEG structures. Using a newly developed microwave impedance microscope, we demonstrate the real-space conductivity mapping of the edge and bulk states. The sizes, positions, and field dependence of the edge strips around the sample perimeter agree quantitatively with the self-consistent electrostatic picture. The evolution of microwave images as a function of magnetic fields provides rich microscopic information around the ν=2 QHE state. © 2011 American Physical Society.
Convergence problems of Coulomb and multipole sums in crystals
International Nuclear Information System (INIS)
Kholopov, Evgenii V
2004-01-01
Different ways of calculating Coulomb and dipole sums over crystal lattices are analyzed comparatively. It is shown that the currently alleged disagreement between various approaches originates in ignoring the requirement for the self-consistency of surface conditions, which are of fundamental importance due to the long-range nature of the bulk interactions that these sums describe. This is especially true of surfaces arising when direct sums for infinite translation-invariant structures are truncated. The charge conditions for actual surfaces being self-consistently adjusted to the bulk state are formally the same as those on the truncation surface, consistent with the concept of the thermodynamic limit for the bulk-state absolute equilibrium and with the fact that the surface energy contribution in this case is, naturally, statistically small compared to the bulk contribution. Two-point multipole expansions are briefly discussed, and the problems associated with the boundary of their convergence circle are pointed out. (reviews of topical problems)
Electric and Magnetic Coulomb Potentials in the Deuteron
Directory of Open Access Journals (Sweden)
Bernard Schaeffer
2013-09-01
Full Text Available After one century of nuclear physics, the underlying fun- damental laws of nuclear physics are still missing. Bohr had found a formula for the H atom and another for the H2 molecule but no equivalent formula exists for the deuteron 2H. The only known Coulomb interaction in a nucleus by the mainstream nuclear physics is the long range repulsion between protons, forgetting that the neutron contains elec- tric charges with no net charge. The neutron is attracted by the proton in a way discovered two millenaries ago by the Greeks. This attraction is equilibrated by the repulsion between the opposite magnetic moments of the proton and of the neutron in the deuteron. The bare application of ge- ometry together with electric and magnetic Coulomb’s in- teractions accounts for the binding energy of the deuteron, without fitting, with only 4 per cent discrepancy, proving the electromagnetic nature of the nuclear energy.
Directory of Open Access Journals (Sweden)
Yurii M. Streliaiev
2016-06-01
Full Text Available Three-dimensional quasistatic contact problem of two linearly elastic bodies' interaction with Coulomb friction taken into account is considered. The boundary conditions of the problem have been simplified by the modification of the Coulomb's law of friction. This modification is based on the introducing of a delay in normal contact tractions that bound tangent contact tractions in the Coulomb's law of friction expressions. At this statement the problem is reduced to a sequence of similar systems of nonlinear integral equations describing bodies' interaction at each step of loading. A method for an approximate solution of the integral equations system corresponded to each step of loading is applied. This method consists of system regularization, discretization of regularized system and iterative process application for solving the discretized system. A numerical solution of a contact problem of an elastic sphere with an elastic half-space interaction under increasing and subsequently decreasing normal compressive force has been obtained.
Interaction potential for two different atoms
International Nuclear Information System (INIS)
Kuzmichev, V.E.; Peresypkin, V.V.
1991-01-01
Using the rigorous approach to the nonrelativistic four Coulomb particle problem the interaction potentials between an ordinary hydrogen and muonic-hydrogen atoms at large: R>a e +a μ (1), and intermediate: a e >R>>a μ (2) distances, where a e and a μ are the Bohr radii, are calculated in the adiabatic approximation. The van der Waals potential constants in the region (1) and an explicit potential form in the region (2) taking into account both the polarization effects and the electron screening corrections are determined. 10 refs
Directory of Open Access Journals (Sweden)
Nicola Yuill
2016-12-01
Full Text Available This study compared changes in cognitive, affective and postural aspects of interaction during shared mother and child book reading on screen and on paper. Readers commonly express strong preferences for reading on paper, but several studies have shown marginal, if any, effects of text medium on cognitive outcomes such as recall. Shared reading with a parent is an engaging, affective and embodied experience across time, as well as a cognitive task, so it is important to understand how paper vs. screen affects broader aspects of these shared experiences. Mid-childhood sees a steep rise in screen use alongside a shift from shared to independent reading. We assessed how the medium of paper or screen might alter children’s shared reading experiences at this transitional age. Twenty-four 7- to 9-year-old children and their mothers were videotaped sharing a story book for 8 minutes in each of 4 conditions: mother or child as reader, paper or tablet screen as medium. We rated videotapes for interaction warmth and child engagement by minute and analysed dyadic postural synchrony, mothers’ commentaries and quality of children’s recall, also interviewing participants about their experiences of reading and technology. We found no differences in recall quality but interaction warmth was lower for screen than for paper, and dropped over time, notably when children read on screen. Interactions also differed between mother-led and child-led reading. We propose that mother - child posture for paper reading supported more shared activity and argue that cultural affordances of screens, together with physical differences between devices, support different behaviours that affect shared engagement, with implications for the design and use of digital technology at home and at school. We advocate studying embodied and affective aspects of shared reading to understand the overall implications of screens in children’s transition to independent reading.
Yuill, Nicola; Martin, Alex F
2016-01-01
This study compared changes in cognitive, affective, and postural aspects of interaction during shared mother and child book reading on screen and on paper. Readers commonly express strong preferences for reading on paper, but several studies have shown marginal, if any, effects of text medium on cognitive outcomes such as recall. Shared reading with a parent is an engaging, affective and embodied experience across time, as well as a cognitive task, so it is important to understand how paper vs. screen affects broader aspects of these shared experiences. Mid-childhood sees a steep rise in screen use alongside a shift from shared to independent reading. We assessed how the medium of paper or screen might alter children's shared reading experiences at this transitional age. Twenty-four 7- to 9-year-old children and their mothers were videotaped sharing a story book for 8 min in each of four conditions: mother or child as reader, paper, or tablet screen as medium. We rated videotapes for interaction warmth and child engagement by minute and analyzed dyadic postural synchrony, mothers' commentaries and quality of children's recall, also interviewing participants about their experiences of reading and technology. We found no differences in recall quality but interaction warmth was lower for screen than for paper, and dropped over time, notably when children read on screen. Interactions also differed between mother-led and child-led reading. We propose that mother - child posture for paper reading supported more shared activity and argue that cultural affordances of screens, together with physical differences between devices, support different behaviors that affect shared engagement, with implications for the design and use of digital technology at home and at school. We advocate studying embodied and affective aspects of shared reading to understand the overall implications of screens in children's transition to independent reading.
Yuill, Nicola; Martin, Alex F.
2016-01-01
This study compared changes in cognitive, affective, and postural aspects of interaction during shared mother and child book reading on screen and on paper. Readers commonly express strong preferences for reading on paper, but several studies have shown marginal, if any, effects of text medium on cognitive outcomes such as recall. Shared reading with a parent is an engaging, affective and embodied experience across time, as well as a cognitive task, so it is important to understand how paper vs. screen affects broader aspects of these shared experiences. Mid-childhood sees a steep rise in screen use alongside a shift from shared to independent reading. We assessed how the medium of paper or screen might alter children’s shared reading experiences at this transitional age. Twenty-four 7- to 9-year-old children and their mothers were videotaped sharing a story book for 8 min in each of four conditions: mother or child as reader, paper, or tablet screen as medium. We rated videotapes for interaction warmth and child engagement by minute and analyzed dyadic postural synchrony, mothers’ commentaries and quality of children’s recall, also interviewing participants about their experiences of reading and technology. We found no differences in recall quality but interaction warmth was lower for screen than for paper, and dropped over time, notably when children read on screen. Interactions also differed between mother-led and child-led reading. We propose that mother - child posture for paper reading supported more shared activity and argue that cultural affordances of screens, together with physical differences between devices, support different behaviors that affect shared engagement, with implications for the design and use of digital technology at home and at school. We advocate studying embodied and affective aspects of shared reading to understand the overall implications of screens in children’s transition to independent reading. PMID:28018283
Brandenburg, Jan Gerit; Caldeweyher, Eike; Grimme, Stefan
2016-06-21
We extend the recently introduced PBEh-3c global hybrid density functional [S. Grimme et al., J. Chem. Phys., 2015, 143, 054107] by a screened Fock exchange variant based on the Henderson-Janesko-Scuseria exchange hole model. While the excellent performance of the global hybrid is maintained for small covalently bound molecules, its performance for computed condensed phase mass densities is further improved. Most importantly, a speed up of 30 to 50% can be achieved and especially for small orbital energy gap cases, the method is numerically much more robust. The latter point is important for many applications, e.g., for metal-organic frameworks, organic semiconductors, or protein structures. This enables an accurate density functional based electronic structure calculation of a full DNA helix structure on a single core desktop computer which is presented as an example in addition to comprehensive benchmark results.
Studying screen interactions long-term : the library as a case
Kanis, Marije; Groen, Maarten; Meys, W.T.; Veenstra, Mettina
2012-01-01
This paper presents the design and long-term study of BiebBeep, a large interactive touchscreen that has been developed with the aim to augment the information and social function of a library. BiebBeep displays user-generated and context-relevant content, such as information about local events and
The Factor Structure and Screening Utility of the Social Interaction Anxiety Scale
Rodebaugh, Thomas L.; Woods, Carol M.; Heimberg, Richard G.; Liebowitz, Michael R.; Schneier, Franklin R.
2006-01-01
The widely used Social Interaction Anxiety Scale (SIAS; R. P. Mattick & J. C. Clarke, 1998) possesses favorable psychometric properties, but questions remain concerning its factor structure and item properties. Analyses included 445 people with social anxiety disorder and 1,689 undergraduates. Simple unifactorial models fit poorly, and models that…
Subcycle dynamics of Coulomb asymmetry in strong elliptical laser fields.
Li, Min; Liu, Yunquan; Liu, Hong; Ning, Qicheng; Fu, Libin; Liu, Jie; Deng, Yongkai; Wu, Chengyin; Peng, Liang-You; Peng, Liangyou; Gong, Qihuang
2013-07-12
We measure photoelectron angular distributions of noble gases in intense elliptically polarized laser fields, which indicate strong structure-dependent Coulomb asymmetry. Using a dedicated semiclassical model, we have disentangled the contribution of direct ionization and multiple forward scattering on Coulomb asymmetry in elliptical laser fields. Our theory quantifies the roles of the ionic potential and initial transverse momentum on Coulomb asymmetry, proving that the small lobes of asymmetry are induced by direct ionization and the strong asymmetry is induced by multiple forward scattering in the ionic potential. Both processes are distorted by the Coulomb force acting on the electrons after tunneling. Lowering the ionization potential, the relative contribution of direct ionization on Coulomb asymmetry substantially decreases and Coulomb focusing on multiple rescattering is more important. We do not observe evident initial longitudinal momentum spread at the tunnel exit according to our simulation.
Phases and amplitudes for a modified repulsive Coulomb field
International Nuclear Information System (INIS)
Chidichimo, M.C.; Davison, T.S.
1990-01-01
The asymptotic form of the radial wave function for positive-energy states is calculated for the case of a repulsive Coulomb field. The cases of a pure Coulomb potential and a modified Coulomb potential are considered. Second-order analytic solutions for the amplitudes and phases are obtained when the modifications to the pure Coulombic potential take the form αr -2 +βr -3 +γr -4 , using the Jeffreys or WKB method. For the case of a pure Coulomb field, numerical results obtained from this method were compared with ''exact'' numerical results that were obtained using the analytic properties of the Coulomb wave functions. Tables are presented to show the conditions under which the method is accurate
Coulomb excitation of {sup 8}Li
Energy Technology Data Exchange (ETDEWEB)
Assuncao, Marlete; Britos, Tatiane Nassar [Universidade Federal de Sao Paulo (UNIFESP), SP (Brazil). Dept. de Ciencias Exatas e da Terra; Descouvemont, Pierre [Universite Libre de Bruxelles (ULB), Brussels (Belgium). Physique Nucleaire Theorique et Physique Mathematique; Lepine-Szily, Alinka; Lichtenthaler Filho, Rubens; Barioni, Adriana; Silva, Diego Medeiros da; Pereira, Dirceu; Mendes Junior, Djalma Rosa; Pires, Kelly Cristina Cezaretto; Gasques, Leandro Romero; Morais, Maria Carmen; Added, Nemitala; Neto Faria, Pedro; Rec, Rafael [Universidade de Sao Paulo (IF/USP), SP (Brazil). Inst. de Fisica. Dept. de Fisica Nuclear
2012-07-01
Full text: This work shows the Coulomb Excitation of {sup 8}Li on targets that have effectively behavior of Rutherford in angles and energies of interest for determining the value of the B(E2) electromagnetic transition. Theoretical aspects involved in this type of measure, known as COULEX [1], and some results in the literature [2-3] will be presented. Some problems with the targets and measurement system while performing an experiment on Coulomb Excitation of {sup 8}Li will be discussed: the energy resolution, background, possible contributions of the primary beam and also the excited states of the target near the region of elastic and inelastic peaks. They will be illustrated by measurements of the Coulomb Excitation of {sup 8}Li on targets of {sup 197}Au and {sup 208}Pb using the system RIBRAS(Brazilian Radioactive Ion Beam). In this case, the {sup 8}Li beam(T{sub 1/2} = 838 ms)is produced by {sup 9}Be({sup 7}Li;{sup 8} Li){sup 8}Be reaction from RIBRAS system which is installed at Instituto de Fisica of the Universidade de Sao Paulo. The primary {sup 7L}i beam is provided by Pelletron Accelerator. [1] K. Alder and A. Winther, Electromagnetic Excitation, North-Holland, New York, 1975; [2] P. Descouvemont and D. Baye, Phys. Letts. B 292, 235-238, 1992; [3] J. A. Brown, F. D. Becchetti, J. W. Jaenecke, K, Ashktorab, and D. A. Roberts, J. J. Kolata, R. J. Smith, and K. Lamkin, R. E. Warner, Phys. Rev. Letts., 66, 19, 1991; [4] R. J. Smith, J. J Kolata, K. Lamkin and A. Morsard, F. D. Becchetti, J. A. Brown, W. Z. Liu, J. W. Jaenecke, and D. A. Roberts, R. E. Warner, Phys. Rev. C, 43, 5, 1991. (author)
Microscopic theory of the Coulomb based exchange coupling in magnetic tunnel junctions.
Udalov, O G; Beloborodov, I S
2017-05-04
We study interlayer exchange coupling based on the many-body Coulomb interaction between conduction electrons in magnetic tunnel junction. This mechanism complements the known interaction between magnetic layers based on virtual electron hopping (or spin currents). We find that these two mechanisms have different behavior on system parameters. The Coulomb based coupling may exceed the hopping based exchange. We show that the Coulomb based exchange interaction, in contrast to the hopping based coupling, depends strongly on the dielectric constant of the insulating layer. The dependence of the interlayer exchange interaction on the dielectric properties of the insulating layer in magnetic tunnel junction is similar to magneto-electric effect where electric and magnetic degrees of freedom are coupled. We calculate the interlayer coupling as a function of temperature and electric field for magnetic tunnel junction with ferroelectric layer and show that the exchange interaction between magnetic leads has a sharp decrease in the vicinity of the ferroelectric phase transition and varies strongly with external electric field.
Resonances in the two centers Coulomb system
Energy Technology Data Exchange (ETDEWEB)
Seri, Marcello
2012-09-14
In this work we investigate the existence of resonances for two-centers Coulomb systems with arbitrary charges in two and three dimensions, defining them in terms of generalized complex eigenvalues of a non-selfadjoint deformation of the two-center Schroedinger operator. After giving a description of the bifurcation of the classical system for positive energies, we construct the resolvent kernel of the operators and we prove that they can be extended analytically to the second Riemann sheet. The resonances are then defined and studied with numerical methods and perturbation theory.
Resonances in the two centers Coulomb system
International Nuclear Information System (INIS)
Seri, Marcello
2012-01-01
In this work we investigate the existence of resonances for two-centers Coulomb systems with arbitrary charges in two and three dimensions, defining them in terms of generalized complex eigenvalues of a non-selfadjoint deformation of the two-center Schroedinger operator. After giving a description of the bifurcation of the classical system for positive energies, we construct the resolvent kernel of the operators and we prove that they can be extended analytically to the second Riemann sheet. The resonances are then defined and studied with numerical methods and perturbation theory.
Dynamics in few body Coulomb problems
International Nuclear Information System (INIS)
Ovchinnikov, S.Y.; Macek, J.H.; Tantawi, R.S.; Sabbah, A.S.
1999-01-01
We develop the 'positive energy Sturmian technique' for the solution of time-dependent Schroedinger equations which describe few Coulomb centers with scattering initial conditions. The 'positive energy Sturmian technique' is based on the following main steps: (i) time-dependent scaled transformation; (ii) Fourier transformation into the frequency domain; (iii) outgoing wave Sturmian expansions; and (iv) solution of coupled equations. The technique has been applied in electron-atom and ion-atom collisions for calculations of energy and angular distributions of emitted electrons and excitations of atoms. Refs. 2 (author)
Bound and resonant states in Coulomb-like potentials
International Nuclear Information System (INIS)
Papp, Z.
1985-12-01
The potential separable expansion method was generalized for calculating bound and resonant states in Coulomb-like potentials. The complete set of Coulomb-Sturmian functions was taken as the basis to expand the short-range potential. On this basis the matrix elements of the Coulomb-Green functions were given in closed form as functions of the (complex) energy. The feasibility of the method is demonstrated by a numerical example. (author)
3D Oscillator and Coulomb Systems reduced from Kahler spaces
Nersessian, Armen; Yeranyan, Armen
2003-01-01
We define the oscillator and Coulomb systems on four-dimensional spaces with U(2)-invariant Kahler metric and perform their Hamiltonian reduction to the three-dimensional oscillator and Coulomb systems specified by the presence of Dirac monopoles. We find the Kahler spaces with conic singularity, where the oscillator and Coulomb systems on three-dimensional sphere and two-sheet hyperboloid are originated. Then we construct the superintegrable oscillator system on three-dimensional sphere and ...
Coulomb sum rules in the relativistic Fermi gas model
International Nuclear Information System (INIS)
Do Dang, G.; L'Huillier, M.; Nguyen Giai, Van.
1986-11-01
Coulomb sum rules are studied in the framework of the Fermi gas model. A distinction is made between mathematical and observable sum rules. Differences between non-relativistic and relativistic Fermi gas predictions are stressed. A method to deduce a Coulomb response function from the longitudinal response is proposed and tested numerically. This method is applied to the 40 Ca data to obtain the experimental Coulomb sum rule as a function of momentum transfer
Yeast screens identify the RNA polymerase II CTD and SPT5 as relevant targets of BRCA1 interaction.
Directory of Open Access Journals (Sweden)
Craig B Bennett
2008-01-01
Full Text Available BRCA1 has been implicated in numerous DNA repair pathways that maintain genome integrity, however the function responsible for its tumor suppressor activity in breast cancer remains obscure. To identify the most highly conserved of the many BRCA1 functions, we screened the evolutionarily distant eukaryote Saccharomyces cerevisiae for mutants that suppressed the G1 checkpoint arrest and lethality induced following heterologous BRCA1 expression. A genome-wide screen in the diploid deletion collection combined with a screen of ionizing radiation sensitive gene deletions identified mutants that permit growth in the presence of BRCA1. These genes delineate a metabolic mRNA pathway that temporally links transcription elongation (SPT4, SPT5, CTK1, DEF1 to nucleopore-mediated mRNA export (ASM4, MLP1, MLP2, NUP2, NUP53, NUP120, NUP133, NUP170, NUP188, POM34 and cytoplasmic mRNA decay at P-bodies (CCR4, DHH1. Strikingly, BRCA1 interacted with the phosphorylated RNA polymerase II (RNAPII carboxy terminal domain (P-CTD, phosphorylated in the pattern specified by the CTDK-I kinase, to induce DEF1-dependent cleavage and accumulation of a RNAPII fragment containing the P-CTD. Significantly, breast cancer associated BRCT domain defects in BRCA1 that suppressed P-CTD cleavage and lethality in yeast also suppressed the physical interaction of BRCA1 with human SPT5 in breast epithelial cells, thus confirming SPT5 as a relevant target of BRCA1 interaction. Furthermore, enhanced P-CTD cleavage was observed in both yeast and human breast cells following UV-irradiation indicating a conserved eukaryotic damage response. Moreover, P-CTD cleavage in breast epithelial cells was BRCA1-dependent since damage-induced P-CTD cleavage was only observed in the mutant BRCA1 cell line HCC1937 following ectopic expression of wild type BRCA1. Finally, BRCA1, SPT5 and hyperphosphorylated RPB1 form a complex that was rapidly degraded following MMS treatment in wild type but not BRCA1
Hyperspherical Coulomb spheroidal basis in the Coulomb three-body problem
International Nuclear Information System (INIS)
Abramov, D. I.
2013-01-01
A hyperspherical Coulomb spheroidal (HSCS) representation is proposed for the Coulomb three-body problem. This is a new expansion in the set of well-known Coulomb spheroidal functions. The orthogonality of Coulomb spheroidal functions on a constant-hyperradius surface ρ = const rather than on a constant-internuclear-distance surface R = const, as in the traditional Born-Oppenheimer approach, is a distinguishing feature of the proposed approach. Owing to this, the HSCS representation proves to be consistent with the asymptotic conditions for the scattering problem at energies below the threshold for three-body breakup: only a finite number of radial functions do not vanish in the limit of ρ→∞, with the result that the formulation of the scattering problem becomes substantially simpler. In the proposed approach, the HSCS basis functions are considerably simpler than those in the well-known adiabatic hyperspherical representation, which is also consistent with the asymptotic conditions. Specifically, the HSCS basis functions are completely factorized. Therefore, there arise no problems associated with avoided crossings of adiabatic hyperspherical terms.
[Identification of C(2)M interacting proteins by yeast two-hybrid screening].
Yue, Shan-shan; Xia, Lai-xin
2015-11-01
The synaptonemal complex (SC) is a huge structure which assembles between the homologous chromosomes during meiotic prophase I. Drosophila germ cell-specific nucleoprotein C(2)M clustering at chromosomes can induce SC formation. To further study the molecular function and mechanism of C(2)M in meiosis, we constructed a bait vector for C(2)M and used the yeast two-hybrid system to identify C(2)M interacting proteins. Forty interacting proteins were obtained, including many DNA and histone binding proteins, ATP synthases and transcription factors. Gene silencing assays in Drosophila showed that two genes, wech and Psf1, may delay the disappearance of SC. These results indicate that Wech and Psf1 may form a complex with C(2)M to participate in the formation or stabilization of the SC complex.
Screening and Selection of New Antagonists of the RING-Mediated Hdm2/Hdmx Interaction
2013-05-01
Biochem. 2005; 337:149–153. [PubMed: 15649388] 122. Shenkarev ZO, Nadezhdin KD, Lyukmanova EN, Sobol VA, Skjeldal L, Arseniev AS. Divalent cation...1246–1256. [PubMed: 18295894] 123. Shenkarev ZO, Nadezhdin KD, Sobol VA, Sobol AG, Skjeldal L, Arseniev AS. Conformation and mode of membrane interaction...resonance. Anal Biochem. 2005; 337:149–153. [PubMed: 15649388] [42]. Shenkarev ZO, Nadezhdin KD, Sobol VA, Sobol AG, Skjeldal L, Arseniev AS. Conformation and
Correlated Coulomb drag in capacitively coupled quantum-dot structures
DEFF Research Database (Denmark)
Kaasbjerg, Kristen; Jauho, Antti-Pekka
2016-01-01
We study theoretically Coulomb drag in capacitively coupled quantum dots (CQDs) -- a biasdriven dot coupled to an unbiased dot where transport is due to Coulomb mediated energy transfer drag. To this end, we introduce a master-equation approach which accounts for higher-order tunneling (cotunneling......) processes as well as energy-dependent lead couplings, and identify a mesoscopic Coulomb drag mechanism driven by nonlocal multi-electron cotunneling processes. Our theory establishes the conditions for a nonzero drag as well as the direction of the drag current in terms of microscopic system parameters...... on Coulomb drag in CQD systems....
Asymptotic freedom in the axial and Coulomb gauges
International Nuclear Information System (INIS)
Frenkel, J.; Taylor, J.C.
1976-01-01
The sources of the negative contribution to the charge renormalization factor gsup(B)/g-1 in Yang-Mills theories are investigated in the axial and Coulomb gauges. In the axial gauge, a Kaellen dispersion relation exists but the spectral function is not positive definite because of the prescription that is used to integrate the singular polarization vectors. In the Coulomb gauge, the negative contributions are (to the lowest order) isolated in the Coulomb self-energy corrections to the Coulomb field. (Auth.)
Directory of Open Access Journals (Sweden)
Yuchen HAN
2008-08-01
Full Text Available Background and objective MCM7 is a subunit of the MCM complex that plays a key role in DNA replication initiation. But little is known about its interaction proteins. In this study yeast two hybrid screening was used to identify the MCM7 interacting proteins. Methods Yeast expression vector containing human full length MCM7-pGBKT7 plasmid was constructed, and with a library of cDNAs from human lung cancer-pACT2 plasmid was transformed into yeast strain AH109, and was electively grew in X-a-gal auxotrophy medium SD/-Trp-Leu-His-Ade, and the blue colonies were picked up, the plasmid of the yeast colonies was extracted , and transformed into E. Coli to extract DNA and performed sequence analysis. Results Eleven proteins were identified which could specifically interact with MCM7 proteins, among these five were cytoskeleton proteins, six were enzymes, kinases and related receptors. Conclusion The investigation provides functional clues for further exploration of MCM7 gene.
Spectral sum for the color-Coulomb potential in SU(3) Coulomb gauge lattice Yang-Mills theory
International Nuclear Information System (INIS)
Nakagawa, Y.; Nakamura, A.; Saito, T.; Toki, H.
2010-01-01
We discuss the essential role of the low-lying eigenmodes of the Faddeev-Popov (FP) ghost operator on the confining color-Coulomb potential using SU(3) quenched lattice simulations in the Coulomb gauge. The color-Coulomb potential is expressed as a spectral sum of the FP ghost operator and has been explored by partially summing the FP eigenmodes. We take into account the Gribov copy effects that have a great impact on the FP eigenvalues and the color-Coulomb potential. We observe that the lowest eigenvalue vanishes in the thermodynamic limit much faster than that in the Landau gauge. The color-Coulomb potential at large distances is governed by the near-zero FP eigenmodes; in particular, the lowest one accounts for a substantial portion of the color-Coulomb string tension comparable to the Wilson string tension.
Directory of Open Access Journals (Sweden)
Mohan Babu
2014-02-01
Full Text Available Large-scale proteomic analyses in Escherichia coli have documented the composition and physical relationships of multiprotein complexes, but not their functional organization into biological pathways and processes. Conversely, genetic interaction (GI screens can provide insights into the biological role(s of individual gene and higher order associations. Combining the information from both approaches should elucidate how complexes and pathways intersect functionally at a systems level. However, such integrative analysis has been hindered due to the lack of relevant GI data. Here we present a systematic, unbiased, and quantitative synthetic genetic array screen in E. coli describing the genetic dependencies and functional cross-talk among over 600,000 digenic mutant combinations. Combining this epistasis information with putative functional modules derived from previous proteomic data and genomic context-based methods revealed unexpected associations, including new components required for the biogenesis of iron-sulphur and ribosome integrity, and the interplay between molecular chaperones and proteases. We find that functionally-linked genes co-conserved among γ-proteobacteria are far more likely to have correlated GI profiles than genes with divergent patterns of evolution. Overall, examining bacterial GIs in the context of protein complexes provides avenues for a deeper mechanistic understanding of core microbial systems.
Simulation of the formation of two-dimensional Coulomb liquids and solids in dusty plasmas
International Nuclear Information System (INIS)
Hwang, H.H.; Kushner, M.J.
1997-01-01
Dust particle transport in low-temperature plasmas has recently received considerable attention due to the desire to minimize contamination of wafers during plasma processing of microelectronics devices. Laser light scattering observations of dust particles near wafers in reactive-ion-etching (RIE) radio frequency (rf) discharges have revealed clouds which display collective behavior. These observations have motivated experimental studies of the Coulomb liquid and solid properties of these systems. In this paper, we present results from a two-dimensional model for dust particle transport in RIE rf discharges in which we include particle-particle Coulomb interactions. We predict the formation of Coulomb liquids and solids. These predictions are based both on values of Γ>2 (liquid) and Γ>170 (solid), where Γ is the ratio of electrostatic potential energy to thermal energy, and on crystal-like structure in the pair correlation function. We find that Coulomb liquids and solids composed of trapped dust particles in RIE discharges are preferentially formed with increasing gas pressure, decreasing particle size, and decreasing rf power. We also observe the ejection of particles from dust crystals which completely fill trapping sites, as well as lattice disordering followed by annealing and refreezing. copyright 1997 American Institute of Physics
Coulomb excitation of radioactive {sup 79}Pb
Energy Technology Data Exchange (ETDEWEB)
Lister, C.J.; Blumenthal, D.; Davids, C.N. [and others
1995-08-01
The technical challenges expected in experiments with radioactive beams can already be explored by using ions produced in primary reactions. In addition, the re-excitation of these ions by Coulomb excitation allows a sensitive search for collective states that are well above the yrast line. We are building an experiment to study Coulomb excitation of radioactive ions which are separated from beam particles by the Fragment Mass Analyzer. An array of gamma detectors will be mounted at the focal plane to measure the gamma radiation following re-excitation. Five Compton-suppressed Ge detectors and five planar LEPS detectors will be used. The optimum experiment of this type appears to be the study of {sup 79}Rb following the {sup 24}Mg ({sup 58}Ni,3p) reaction. We calculate that about 5 x 10{sup 5} {sup 79}Rb nuclei/second will reach the excitation foil. This rubidium isotope was selected for study as it is strongly produced and is highly deformed, so easily re-excited. The use of a {sup 58}Ni re-excitation foil offers the best yields. After re-excitation the ions will be subsequently transported into a shielded beamdump to prevent the accumulation of activity.
Rayleigh approximation to ground state of the Bose and Coulomb glasses
Ryan, S. D.; Mityushev, V.; Vinokur, V. M.; Berlyand, L.
2015-01-01
Glasses are rigid systems in which competing interactions prevent simultaneous minimization of local energies. This leads to frustration and highly degenerate ground states the nature and properties of which are still far from being thoroughly understood. We report an analytical approach based on the method of functional equations that allows us to construct the Rayleigh approximation to the ground state of a two-dimensional (2D) random Coulomb system with logarithmic interactions. We realize a model for 2D Coulomb glass as a cylindrical type II superconductor containing randomly located columnar defects (CD) which trap superconducting vortices induced by applied magnetic field. Our findings break ground for analytical studies of glassy systems, marking an important step towards understanding their properties. PMID:25592417
The parametrization of Coulomb barrier heights and positions using the double folding model
International Nuclear Information System (INIS)
Qu, W.W.; Zhang, G.L.; Le, X.Y.
2011-01-01
The Coulomb barrier heights and positions are systematically shown with mass numbers and charge radii of the interacting nuclei. The nuclear potential is calculated by using the double folding model with the density-dependence nucleon-nucleon interaction (CDM3Y6). The pocket formulas are obtained for the Coulomb barrier heights and positions by analyzing several hundreds of heavy-ion systems with mass numbers from light nuclei to heavy nuclei. The parameterized formulas can reproduce the calculated barrier heights and positions by using the double folding model within the accuracy of ±1%. Moreover, the results are agreeable with the experimental data. The relation between the barrier height and the barrier position is also studied.
Coulomb drag in electron-hole bilayer: Mass-asymmetry and exchange correlation effects
Arora, Priya; Singh, Gurvinder; Moudgil, R. K.
2018-04-01
Motivated by a recent experiment by Zheng et al. [App. Phys. Lett. 108, 062102 (2016)] on coulomb drag in electron-hole and hole-hole bilayers based on GaAs/AlGaAs semiconductor heterostructure, we investigate theoretically the influence of mass-asymmetry and temperature-dependence of correlations on the drag rate. The correlation effects are dealt with using the Vignale-Singwi effective inter-layer interaction model which includes correlations through local-field corrections to the bare coulomb interactions. However, in this work, we have incorporated only the intra-layer correlations using the temperature-dependent Hubbard approximation. Our results display a reasonably good agreement with the experimental data. However, it is crucial to include both the electron-hole mass-asymmetry and temperature-dependence of correlations. Mass-asymmetry and correlations are found to result in a substantial enhancement of drag resistivity.
The exact solution of a four-body Coulomb problem
Ray, Hasi
2018-03-01
The elastic collision between two H-like atoms utilizing an ab initio static-exchange model (SEM) in the center of mass (CM) frame considering the system as a four-body Coulomb problem where all the Coulomb interaction terms in the direct and exchange channels are treated exactly, is studied thoroughly. A coupled-channel methodology in momentum space is used to solve Lippman-Schwinger equation following the integral approach. The new SEM code [Ray, Pramana 83, 907 (2014)] in which the Born-Oppenheimer (BO) scattering amplitude acts as input to derive the SEM amplitude using partial wave analysis, is utilized to study the s-, p-, d-wave elastic phase shifts and the corresponding partial cross sections. An augmented-Born approximation is used to include the contribution of higher partial waves more accurately to determine the total/integrated elastic cross sections. The effective range theory is used to determine the scattering lengths and effective ranges in the s-wave elastic scattering. The systems studied are Ps-Ps, Ps-Mu, Ps-H, Ps-D, Ps-T, Mu-Mu, Mu-H, Mu-D, Mu-T, H-H, H-D, H-T, D-D, D-T, T-T. The SEM includes the non-adiabatic short-range effects due to exchange. The MSEM code [Ray, Pramana 83, 907 (2014)] is used to study the effect of the long-range van der Waals interaction due to induced dipole polarizabilities of the atoms in H(1s)-H(1s) elastic collision. The dependence of scattering length on the reduced mass of the system and the dependence of scattering length on the strength of long-range van der Waals interaction that varies with the minimum interatomic distance are observed. Contribution to the Topical Issue "Low Energy Positron and Electron Interactions", edited by James Sullivan, Ron White, Michael Bromley, Ilya Fabrikant, and David Cassidy.
DEFF Research Database (Denmark)
Surakka, I.; Isaacs, A.; Karssen, L. C.
2011-01-01
Recent genome-wide association (GWA) studies described 95 loci controlling serum lipid levels. These common variants explain similar to 25% of the heritability of the phenotypes. To date, no unbiased screen for gene-environment interactions for circulating lipids has been reported. We screened......, and rs6448771 on 4p15 demonstrated genome-wide significant interaction with waist-to-hip-ratio (WHR) on total cholesterol (TC) with a combined P-value of 4.79 x 10(-9). There were two potential candidate genes in the region, PCDH7 and CCKAR, with differential expression levels for rs6448771 genotypes...
Elastic Coulomb breakup of 34Na
Singh, G.; Shubhchintak, Chatterjee, R.
2016-08-01
Background: 34Na is conjectured to play an important role in the production of seed nuclei in the alternate r -process paths involving light neutron rich nuclei very near the β -stability line, and as such, it is important to know its ground state properties and structure to calculate rates of the reactions it might be involved in, in the stellar plasma. Found in the region of `island of inversion', its ground state might not be in agreement with normal shell model predictions. Purpose: The aim of this paper is to study the elastic Coulomb breakup of 34Na on 208Pb to give us a core of 33Na with a neutron and in the process we try and investigate the one neutron separation energy and the ground state configuration of 34Na. Method: A fully quantum mechanical Coulomb breakup theory within the architecture of post-form finite range distorted wave Born approximation extended to include the effects of deformation is used to research the elastic Coulomb breakup of 34Na on 208Pb at 100 MeV/u. The triple differential cross section calculated for the breakup is integrated over the desired components to find the total cross-section, momentum, and angular distributions as well as the average momenta, along with the energy-angular distributions. Results: The total one neutron removal cross section is calculated to test the possible ground state configurations of 34Na. The average momentum results along with energy-angular calculations indicate 34Na to have a halo structure. The parallel momentum distributions with narrow full widths at half-maxima signify the same. Conclusion: We have attempted to analyze the possible ground state configurations of 34Na and in congruity with the patterns in the `island of inversion' conclude that even without deformation, 34Na should be a neutron halo with a predominant contribution to its ground state most probably coming from 33Na(3 /2+)⊗ 2 p3 /2ν configuration. We also surmise that it would certainly be useful and rewarding to test our
The statistical mechanics of the classical two-dimensional Coulomb gas is exactly solved
International Nuclear Information System (INIS)
Samaj, L
2003-01-01
The model under consideration is a classical 2D Coulomb gas of pointlike positive and negative unit charges, interacting via a logarithmic potential. In the whole stability range of temperatures, the equilibrium statistical mechanics of this fluid model is exactly solvable via an equivalence with the integrable 2D sine-Gordon field theory. The exact solution includes the bulk thermodynamics, special cases of the surface thermodynamics and the large-distance asymptotic behaviour of the two-body correlation functions
Xue, Xin; Wei, Jin-Lian; Xu, Li-Li; Xi, Mei-Yang; Xu, Xiao-Li; Liu, Fang; Guo, Xiao-Ke; Wang, Lei; Zhang, Xiao-Jin; Zhang, Ming-Ye; Lu, Meng-Chen; Sun, Hao-Peng; You, Qi-Dong
2013-10-28
Protein-protein interactions (PPIs) play a crucial role in cellular function and form the backbone of almost all biochemical processes. In recent years, protein-protein interaction inhibitors (PPIIs) have represented a treasure trove of potential new drug targets. Unfortunately, there are few successful drugs of PPIIs on the market. Structure-based pharmacophore (SBP) combined with docking has been demonstrated as a useful Virtual Screening (VS) strategy in drug development projects. However, the combination of target complexity and poor binding affinity prediction has thwarted the application of this strategy in the discovery of PPIIs. Here we report an effective VS strategy on p53-MDM2 PPI. First, we built a SBP model based on p53-MDM2 complex cocrystal structures. The model was then simplified by using a Receptor-Ligand complex-based pharmacophore model considering the critical binding features between MDM2 and its small molecular inhibitors. Cascade docking was subsequently applied to improve the hit rate. Based on this strategy, we performed VS on NCI and SPECS databases and successfully discovered 6 novel compounds from 15 hits with the best, compound 1 (NSC 5359), K(i) = 180 ± 50 nM. These compounds can serve as lead compounds for further optimization.
4-center STO interelectron repulsion integrals with Coulomb Sturmians
DEFF Research Database (Denmark)
Avery, James Emil; Avery, John Scales
2018-01-01
Abstract We present a method for evaluating 4-center electron repulsion integrals (ERI) for Slater-type orbitals by way of expansions in terms of Coulomb Sturmians. The ERIs can then be evaluated using our previously published methods for rapid evaluation of Coulomb Sturmians through hyperspherical...
Coulomb corrections in the low-energy scattering
International Nuclear Information System (INIS)
Mur, V.D.; Popov, V.S.
1985-01-01
Renormalization of the coefficients of the ''effective range expansion'' is considered for the short-range Coulomb problem. The exactly solvable model of the Coulomb plus short range potential is considered. Exact solutions are compared with approximations frequently used in the theory of hadronic atoms
Known-to-Unknown Approach to Teach about Coulomb's Law
Thamburaj, P. K.
2007-01-01
Analogies from life experiences help students understand various relationships presented in an introductory chemistry course. Coulomb's law is a complex relationship encountered in introductory general chemistry. A proper understanding of the relationships between the quantities involved in Coulomb's law is necessary in order for students to…
Coulomb-gas scaling, superfluid films, and the XY model
International Nuclear Information System (INIS)
Minnhagen, P.; Nylen, M.
1985-01-01
Coulomb-gas-scaling ideas are invoked as a link between the superfluid density of two-dimensional 4 He films and the XY model; the Coulomb-gas-scaling function epsilon(X) is extracted from experiments and is compared with Monte Carlo simulations of the XY model. The agreement is found to be excellent
Antilocalization of Coulomb Blockade in a Ge-Si Nanowire
DEFF Research Database (Denmark)
Higginbotham, Andrew P.; Kuemmeth, Ferdinand; Larsen, Thorvald Wadum
2014-01-01
The distribution of Coulomb blockade peak heights as a function of magnetic field is investigated experimentally in a Ge-Si nanowire quantum dot. Strong spin-orbit coupling in this hole-gas system leads to antilocalization of Coulomb blockade peaks, consistent with theory. In particular, the peak...
Firman, Keith; Evans, Luke; Youell, James
2012-07-16
This review describes a European-funded project in the area of Synthetic Biology. The project seeks to demonstrate the application of engineering techniques and methodologies to the design and construction of a biosensor for detecting drug-target interactions at the single-molecule level. Production of the proteins required for the system followed the principle of previously described "bioparts" concepts (a system where a database of biological parts - promoters, genes, terminators, linking tags and cleavage sequences - is used to construct novel gene assemblies) and cassette-type assembly of gene expression systems (the concept of linking different "bioparts" to produce functional "cassettes"), but problems were quickly identified with these approaches. DNA substrates for the device were also constructed using a cassette-system. Finally, micro-engineering was used to build a magnetoresistive Magnetic Tweezer device for detection of single molecule DNA modifying enzymes (motors), while the possibility of constructing a Hall Effect version of this device was explored. The device is currently being used to study helicases from Plasmodium as potential targets for anti-malarial drugs, but we also suggest other potential uses for the device. Copyright © 2012 Federation of European Biochemical Societies. Published by Elsevier B.V. All rights reserved.
Generalized coherent states for the Coulomb problem in one dimension
International Nuclear Information System (INIS)
Nouri, S.
2002-01-01
A set of generalized coherent states for the one-dimensional Coulomb problem in coordinate representation is constructed. At first, we obtain a mapping for proper transformation of the one-dimensional Coulomb problem into a nonrotating four-dimensional isotropic harmonic oscillator in the hyperspherical space, and the generalized coherent states for the one-dimensional Coulomb problem is then obtained in exact closed form. This exactly soluble model can provide an adequate means for a quantum coherency description of the Coulomb problem in one dimension, sample for coherent aspects of the exciton model in one-dimension example in high-temperature superconductivity, semiconductors, and polymers. Also, it can be useful for investigating the coherent scattering of the Coulomb particles in one dimension
Eikonal representation of N-body Coulomb scattering amplitudes
International Nuclear Information System (INIS)
Fried, H.M.; Kang, K.; McKellar, B.H.J.
1983-01-01
A new technique for the construction of N-body Coulomb scattering amplitudes is proposed, suggested by the simplest case of N = 2: Calculate the scattering amplitude in eikonal approximation, discard the infinite phase factors which appear upon taking the limit of a Coulomb potential, and treat the remainder as an amplitude whose absolute value squared produces the exact, Coulomb differential cross section. The method easily generalizes to the N-body Coulomb problem for elastic scattering, and for inelastic rearrangement scattering of Coulomb bound states. We give explicit results for N = 3 and 4; in the N = 3 case we extract amplitudes for the processes (12)+3->1+2+3 (breakup), (12)+3->1+(23) (rearrangement), and (12)+3→(12)'+3 (inelastic scattering) as residues at the appropriate poles in the free-free amplitude. The method produces scattering amplitudes f/sub N/ given in terms of explicit quadratures over (N-2) 2 distinct integrands
Interplay between superconductivity and Coulomb blockade
Energy Technology Data Exchange (ETDEWEB)
Lorenz, Thomas; Sprenger, Susanne; Scheer, Elke [Universitaet Konstanz (Germany)
2016-07-01
Studying the interplay between superconductivity and Coulomb blockade (CB) can be achieved by investigating an all superconducting single electron transistor (SSET) consisting of an island coupled to the leads by two tunneling contacts. The majority of experiments performed so far were using superconducting tunnel contacts made from oxide layers, in which multiple Andreev reflections (MAR) can be excluded. Using a mechanically controlled break junction (MCBJ) made of aluminum enables tuning the contributions of MAR in one junction continuously and thereby addressing different transport regimes within the same sample. Our results offer the possibility to attribute particular features in the transport characteristics to the transmission probabilities of individual modes in the MCBJ contact. We discuss our findings in terms of dynamical CB, SSET behaviour and MAR when continuously opening the MCBJ from the fully closed state to a tunneling contact.
Tests of a Coulomb-nuclear polarimeter
International Nuclear Information System (INIS)
Pauletta, G.; University of Texas, Austin, TX, 78712)
1989-01-01
We report on the development and testing of a polarimeter for the high energy polarized proton and antiproton beam at Fermi National Accelerator Laboratory (FNAL). The polarimeter was designed to make use of a small but well-known analyzing power in the region of Coulomb-nuclear interference (CNI) in order to obtain an absolute measurement of the polarization. Feasibility was established in the course of a brief running period at the end of the last fixed-target period at FNAL and potential for considerable improvement was revealed. Beam-time was insufficient to measure polarization accurately but the data obtained bears out design expectations for the beam-line and confirms polarization-tagging techniques to within uncertainties
Coulomb excitation of {sup 123}Cd
Energy Technology Data Exchange (ETDEWEB)
Hartig, Anna-Lena; Kroell, Thorsten; Ilieva, Stoyanka; Boenig, Sabine; Thuerauf, Michael [IKP, TU Darmstadt (Germany); Simpson, Gary; Drouet, Floriane; Ramdhane, Mourad [LPSC, Grenoble (France); Georgiev, Georgi [CSNSM, Orsay (France); Kesteloot, Nele; Wrzosek-Lipska, Kasia [KU, Leuven (Belgium); Jungclaus, Andrea; Illana Sison, Andres [CSIC, Madrid (Spain); Balabanski, Dimiter [INRNE-BAS, Sofia (Bulgaria); Warr, Nigel [Koeln Univ. (Germany). IKP; Voulot, Didier; Wenander, Fredrik; Marsh, Bruce [CERN, Geneva (Switzerland)
2013-07-01
On the neutron-rich side of the valley of stability in the vicinity of the double magic nucleus {sup 132}Sn one can find the {sup 123}Cd isotope. Surprisingly the neutron-rich even-A Cd isotopes in this region are showing signs of collectivity beyond that calculated by modern shell-model predictions. In order to gain a deeper insight in this phenomenon we started to extend these studies to odd-A Cd isotopes. As first isotope the exotic nucleus {sup 123}Cd was produced for safe Coulomb excitation by the ISOLDE facility at CERN and post-accelerated by REX-ISOLDE. The γ-decay from excited states was detected with the MINIBALL array. A report on the status of the ongoing analysis is given.
The ghost propagator in Coulomb gauge
International Nuclear Information System (INIS)
Watson, P.; Reinhardt, H.
2011-01-01
We present results for a numerical study of the ghost propagator in Coulomb gauge whereby lattice results for the spatial gluon propagator are used as input to solving the ghost Dyson-Schwinger equation. We show that in order to solve completely, the ghost equation must be supplemented by a boundary condition (the value of the inverse ghost propagator dressing function at zero momentum) which determines if the solution is critical (zero value for the boundary condition) or subcritical (finite value). The various solutions exhibit a characteristic behavior where all curves follow the same (critical) solution when going from high to low momenta until 'forced' to freeze out in the infrared to the value of the boundary condition. The boundary condition can be interpreted in terms of the Gribov gauge-fixing ambiguity; we also demonstrate that this is not connected to the renormalization. Further, the connection to the temporal gluon propagator and the infrared slavery picture of confinement is discussed.