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Sample records for local correlation theory

  1. Locality of correlation in density functional theory

    Energy Technology Data Exchange (ETDEWEB)

    Burke, Kieron [Department of Chemistry, University of California, Irvine, California 92697 (United States); Cancio, Antonio [Department of Physics and Astronomy, Ball State University, Muncie, Indiana 47306 (United States); Gould, Tim [Qld Micro- and Nanotechnology Centre, Griffith University, Nathan, Qld 4111 (Australia); Pittalis, Stefano [CNR-Istituto di Nanoscienze, Via Campi 213A, I-41125 Modena (Italy)

    2016-08-07

    The Hohenberg-Kohn density functional was long ago shown to reduce to the Thomas-Fermi (TF) approximation in the non-relativistic semiclassical (or large-Z) limit for all matter, i.e., the kinetic energy becomes local. Exchange also becomes local in this limit. Numerical data on the correlation energy of atoms support the conjecture that this is also true for correlation, but much less relevant to atoms. We illustrate how expansions around a large particle number are equivalent to local density approximations and their strong relevance to density functional approximations. Analyzing highly accurate atomic correlation energies, we show that E{sub C} → −A{sub C} ZlnZ + B{sub C}Z as Z → ∞, where Z is the atomic number, A{sub C} is known, and we estimate B{sub C} to be about 37 mhartree. The local density approximation yields A{sub C} exactly, but a very incorrect value for B{sub C}, showing that the local approximation is less relevant for the correlation alone. This limit is a benchmark for the non-empirical construction of density functional approximations. We conjecture that, beyond atoms, the leading correction to the local density approximation in the large-Z limit generally takes this form, but with B{sub C} a functional of the TF density for the system. The implications for the construction of approximate density functionals are discussed.

  2. Non-local correlations within dynamical mean field theory

    Energy Technology Data Exchange (ETDEWEB)

    Li, Gang

    2009-03-15

    The contributions from the non-local fluctuations to the dynamical mean field theory (DMFT) were studied using the recently proposed dual fermion approach. Straight forward cluster extensions of DMFT need the solution of a small cluster, where all the short-range correlations are fully taken into account. All the correlations beyond the cluster scope are treated in the mean-field level. In the dual fermion method, only a single impurity problem needs to be solved. Both the short and long-range correlations could be considered on equal footing in this method. The weak-coupling nature of the dual fermion ensures the validity of the finite order diagram expansion. The one and two particle Green's functions calculated from the dual fermion approach agree well with the Quantum Monte Carlo solutions, and the computation time is considerably less than with the latter method. The access of the long-range order allows us to investigate the collective behavior of the electron system, e.g. spin wave excitations. (orig.)

  3. Non-local correlations within dynamical mean field theory

    International Nuclear Information System (INIS)

    Li, Gang

    2009-03-01

    The contributions from the non-local fluctuations to the dynamical mean field theory (DMFT) were studied using the recently proposed dual fermion approach. Straight forward cluster extensions of DMFT need the solution of a small cluster, where all the short-range correlations are fully taken into account. All the correlations beyond the cluster scope are treated in the mean-field level. In the dual fermion method, only a single impurity problem needs to be solved. Both the short and long-range correlations could be considered on equal footing in this method. The weak-coupling nature of the dual fermion ensures the validity of the finite order diagram expansion. The one and two particle Green's functions calculated from the dual fermion approach agree well with the Quantum Monte Carlo solutions, and the computation time is considerably less than with the latter method. The access of the long-range order allows us to investigate the collective behavior of the electron system, e.g. spin wave excitations. (orig.)

  4. Towards a Density Functional Theory Exchange-Correlation Functional able to describe localization/delocalization

    Science.gov (United States)

    Mattsson, Ann E.; Wills, John M.

    2013-03-01

    The inability to computationally describe the physics governing the properties of actinides and their alloys is the poster child of failure of existing Density Functional Theory exchange-correlation functionals. The intricate competition between localization and delocalization of the electrons, present in these materials, exposes the limitations of functionals only designed to properly describe one or the other situation. We will discuss the manifestation of this competition in real materials and propositions on how to construct a functional able to accurately describe properties of these materials. I addition we will discuss both the importance of using the Dirac equation to describe the relativistic effects in these materials, and the connection to the physics of transition metal oxides. Sandia National Laboratories is a multi-program laboratory managed and operated by Sandia Corporation, a wholly owned subsidiary of Lockheed Martin Corporation, for the U.S. Department of Energy's National Nuclear Security Administration under contract DE-AC04-94AL85000.

  5. Hydrogen plasmas beyond density-functional theory: dynamic correlations and the onset of localization

    International Nuclear Information System (INIS)

    Perrot, F.; Dharma-Wardana, M.W.C.

    1984-01-01

    The density-functional theory (DFT) equations - previously considered in their application to the study of a system of ions and electrons in thermodynamic equilibrium at arbitrary temperatures and pressure - are reviewed with attention given to extending their validity in obtaining the one-electron excitation spectrum. The DFT model developed here provides structure factors and Kohn-Sham eigenstates which are then used to calculate the self-energy of the one-electron Green function, thus transcending the local-density approximations and the well-known limitations of DFT, especially with regard to the excitation spectrum. The one-particle formalism used makes contact with the multiple-scattering theories of disordered materials, liquid metals, etc., and is a necessary first step to a future calculation of two-particle propagators and related properties. 28 references

  6. A note on the algebraic evaluation of correlators in local chiral conformal field theory

    International Nuclear Information System (INIS)

    Honecker, A.

    1992-09-01

    We comment on a program designed for the study of local chiral algebras and their representations in 2D conformal field theory. Based on the algebraic approach described by W. Nahm, this program efficiently calculates arbitrary n-point functions of these algebras. The program is designed such that calculations involving e.g. current algebras, W-algebras and N-Superconformal algebras can be performed. As a non-trivial application we construct an extension of the Virasoro algebra by two fields with spin four and six using the N=1-Super-Virasoro algebra. (orig.)

  7. On the chain length dependence of local correlations in polymer melts and a perturbation theory of symmetric polymer blends.

    Science.gov (United States)

    Morse, David C; Chung, Jun Kyung

    2009-06-14

    The self-consistent field (SCF) approach to the thermodynamics of dense polymer liquids is based on the idea that short-range correlations in a polymer liquid are almost independent of how monomers are connected into polymers over larger scales. Some limits of this idea are explored in the context of a perturbation theory for symmetric polymer blends. We consider mixtures of two structurally identical polymers, A and B, in which the AB monomer pair interaction differs slightly from the AA and BB interactions by an amount proportional to a parameter alpha. An expansion of the free energy to first order in alpha yields an excess free energy of mixing per monomer of the form alphaz(N)phi(A)phi(B) in both lattice and continuum models, where z(N) is a measure of the number of intermolecular near neighbors per monomer in a one-component (alpha=0) reference liquid with chains of length N. The quantity z(N) decreases slightly with increasing N because the concentration of intramolecular near neighbors is slightly higher for longer chains, creating a slightly deeper intermolecular correlation hole. We predict that z(N)=z(infinity)[1+betaN(-1/2)], where N is an invariant degree of polymerization and beta=(6/pi)(3/2) is a universal coefficient. This and related predictions about the slight N dependence of local correlations are confirmed by comparison to simulations of a continuum bead-spring model and to published lattice Monte Carlo simulations. We show that a renormalized one-loop theory for blends correctly describes this N dependence of local liquid structure. We also propose a way to estimate the effective interaction parameter appropriate for comparisons of simulation data to SCF theory and to coarse-grained theories of corrections to SCF theory, which is based on an extrapolation of perturbation theory to the limit N-->infinity.

  8. Comparison and combination of "direct" and fragment based local correlation methods: Cluster in molecules and domain based local pair natural orbital perturbation and coupled cluster theories

    Science.gov (United States)

    Guo, Yang; Becker, Ute; Neese, Frank

    2018-03-01

    Local correlation theories have been developed in two main flavors: (1) "direct" local correlation methods apply local approximation to the canonical equations and (2) fragment based methods reconstruct the correlation energy from a series of smaller calculations on subsystems. The present work serves two purposes. First, we investigate the relative efficiencies of the two approaches using the domain-based local pair natural orbital (DLPNO) approach as the "direct" method and the cluster in molecule (CIM) approach as the fragment based approach. Both approaches are applied in conjunction with second-order many-body perturbation theory (MP2) as well as coupled-cluster theory with single-, double- and perturbative triple excitations [CCSD(T)]. Second, we have investigated the possible merits of combining the two approaches by performing CIM calculations with DLPNO methods serving as the method of choice for performing the subsystem calculations. Our cluster-in-molecule approach is closely related to but slightly deviates from approaches in the literature since we have avoided real space cutoffs. Moreover, the neglected distant pair correlations in the previous CIM approach are considered approximately. Six very large molecules (503-2380 atoms) were studied. At both MP2 and CCSD(T) levels of theory, the CIM and DLPNO methods show similar efficiency. However, DLPNO methods are more accurate for 3-dimensional systems. While we have found only little incentive for the combination of CIM with DLPNO-MP2, the situation is different for CIM-DLPNO-CCSD(T). This combination is attractive because (1) the better parallelization opportunities offered by CIM; (2) the methodology is less memory intensive than the genuine DLPNO-CCSD(T) method and, hence, allows for large calculations on more modest hardware; and (3) the methodology is applicable and efficient in the frequently met cases, where the largest subsystem calculation is too large for the canonical CCSD(T) method.

  9. Local homotopy theory

    CERN Document Server

    Jardine, John F

    2015-01-01

    This monograph on the homotopy theory of topologized diagrams of spaces and spectra gives an expert account of a subject at the foundation of motivic homotopy theory and the theory of topological modular forms in stable homotopy theory. Beginning with an introduction to the homotopy theory of simplicial sets and topos theory, the book covers core topics such as the unstable homotopy theory of simplicial presheaves and sheaves, localized theories, cocycles, descent theory, non-abelian cohomology, stacks, and local stable homotopy theory. A detailed treatment of the formalism of the subject is interwoven with explanations of the motivation, development, and nuances of ideas and results. The coherence of the abstract theory is elucidated through the use of widely applicable tools, such as Barr's theorem on Boolean localization, model structures on the category of simplicial presheaves on a site, and cocycle categories. A wealth of concrete examples convey the vitality and importance of the subject in topology, n...

  10. 3d-4f magnetic interaction with density functional theory plus u approach: local Coulomb correlation and exchange pathways.

    Science.gov (United States)

    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.

  11. Eliminating the domain error in local explicitly correlated second-order Møller-Plesset perturbation theory.

    Science.gov (United States)

    Werner, Hans-Joachim

    2008-09-14

    A new explicitly correlated local MP2-F12 method is proposed in which the error caused by truncating the virtual orbital space to pair-specific local domains is almost entirely removed. This is achieved by a simple modification of the ansatz for the explicitly correlated wave function, which makes it possible that the explicitly correlated terms correct both for the basis set incompleteness error as well as for the domain error in the LMP2. Benchmark calculations are presented for 21 molecules and 16 chemical reactions. The results demonstrate that the local approximations have hardly any effect on the accuracy of the computed correlation energies and reaction energies, and the LMP2-F12 reaction energies agree within 0.1-0.2 kcal/mol with estimated MP2 basis set limits.

  12. Local Descriptors of Dynamic and Nondynamic Correlation.

    Science.gov (United States)

    Ramos-Cordoba, Eloy; Matito, Eduard

    2017-06-13

    Quantitatively accurate electronic structure calculations rely on the proper description of electron correlation. A judicious choice of the approximate quantum chemistry method depends upon the importance of dynamic and nondynamic correlation, which is usually assesed by scalar measures. Existing measures of electron correlation do not consider separately the regions of the Cartesian space where dynamic or nondynamic correlation are most important. We introduce real-space descriptors of dynamic and nondynamic electron correlation that admit orbital decomposition. Integration of the local descriptors yields global numbers that can be used to quantify dynamic and nondynamic correlation. Illustrative examples over different chemical systems with varying electron correlation regimes are used to demonstrate the capabilities of the local descriptors. Since the expressions only require orbitals and occupation numbers, they can be readily applied in the context of local correlation methods, hybrid methods, density matrix functional theory, and fractional-occupancy density functional theory.

  13. Quantum mechanics and the theories of local hidden variables: an experimental test by measuring the spin correlation function in p-p scattering

    International Nuclear Information System (INIS)

    Lamehi-Rachti, Mohammad.

    1976-01-01

    The Einstein-Podolsky-Rosen paradox is briefly exposed with the Bell theorem on hidden variables and the locality principle. The conditions for an ideal experiment are discussed and the results from γ-γ correlation experiments are given. The principle of an experimental measurement of the spin correlation function predicted by the quantum mechanics theory is derived, new hypotheses to be introduced are discussed. The formula giving the dependence of the counting asymmetry on the spin correlation function, polarimeter analyzing power, and geometric correlation is developed. The principle of a Monte Carlo calculation is also exposed. The experimental device is described with the methods for measuring the subsidiary quantities and experimental results are analyzed [fr

  14. MN15-L: A New Local Exchange-Correlation Functional for Kohn-Sham Density Functional Theory with Broad Accuracy for Atoms, Molecules, and Solids.

    Science.gov (United States)

    Yu, Haoyu S; He, Xiao; Truhlar, Donald G

    2016-03-08

    Kohn-Sham density functional theory is widely used for applications of electronic structure theory in chemistry, materials science, and condensed-matter physics, but the accuracy depends on the quality of the exchange-correlation functional. Here, we present a new local exchange-correlation functional called MN15-L that predicts accurate results for a broad range of molecular and solid-state properties including main-group bond energies, transition metal bond energies, reaction barrier heights, noncovalent interactions, atomic excitation energies, ionization potentials, electron affinities, total atomic energies, hydrocarbon thermochemistry, and lattice constants of solids. The MN15-L functional has the same mathematical form as a previous meta-nonseparable gradient approximation exchange-correlation functional, MN12-L, but it is improved because we optimized it against a larger database, designated 2015A, and included smoothness restraints; the optimization has a much better representation of transition metals. The mean unsigned error on 422 chemical energies is 2.32 kcal/mol, which is the best among all tested functionals, with or without nonlocal exchange. The MN15-L functional also provides good results for test sets that are outside the training set. A key issue is that the functional is local (no nonlocal exchange or nonlocal correlation), which makes it relatively economical for treating large and complex systems and solids. Another key advantage is that medium-range correlation energy is built in so that one does not need to add damped dispersion by molecular mechanics in order to predict accurate noncovalent binding energies. We believe that the MN15-L functional should be useful for a wide variety of applications in chemistry, physics, materials science, and molecular biology.

  15. Quantum theory and local causality

    CERN Document Server

    Hofer-Szabó, Gábor

    2018-01-01

    This book summarizes the results of research the authors have pursued in the past years on the problem of implementing Bell's notion of local causality in local physical theories and relating it to other important concepts and principles in the foundations of physics such as the Common Cause Principle, Bell's inequalities, the EPR (Einstein-Podolsky-Rosen) scenario, and various other locality and causality concepts. The book is intended for philosophers of science with an interest in the formal background of sciences, philosophers of physics and physicists working in foundation of physics.

  16. Local quantum channels preserving classical correlations

    International Nuclear Information System (INIS)

    Guo Zhihua; Cao Huaixin

    2013-01-01

    The aim of this paper is to discuss local quantum channels that preserve classical correlations. First, we give two equivalent characterizations of classical correlated states. Then we obtain the relationships among classical correlation-preserving local quantum channels, commutativity-preserving local quantum channels and commutativity-preserving quantum channels on each subsystem. Furthermore, for a two-qubit system, we show the general form of classical correlation-preserving local quantum channels. (paper)

  17. H3+-WZNW correlators from Liouville theory

    International Nuclear Information System (INIS)

    Ribault, Sylvain; Teschner, Joerg

    2005-01-01

    We prove that arbitrary correlation functions of the H 3 + -WZNW model on a sphere have a simple expression in terms of Liouville theory correlation functions. This is based on the correspondence between the KZ and BPZ equations, and on relations between the structure constants of Liouville theory and the H 3 + -WZNW model. In the critical level limit, these results imply a direct link between eigenvectors of the Gaudin hamiltonians and the problem of uniformization of Riemann surfaces. We also present an expression for correlation functions of the SL(2)/U(1) gauged WZNW model in terms of correlation functions in Liouville theory

  18. Causal quantum theory and the collapse locality loophole

    International Nuclear Information System (INIS)

    Kent, Adrian

    2005-01-01

    Causal quantum theory is an umbrella term for ordinary quantum theory modified by two hypotheses: state vector reduction is a well-defined process, and strict local causality applies. The first of these holds in some versions of Copenhagen quantum theory and need not necessarily imply practically testable deviations from ordinary quantum theory. The second implies that measurement events which are spacelike separated have no nonlocal correlations. To test this prediction, which sharply differs from standard quantum theory, requires a precise definition of state vector reduction. Formally speaking, any precise version of causal quantum theory defines a local hidden variable theory. However, causal quantum theory is most naturally seen as a variant of standard quantum theory. For that reason it seems a more serious rival to standard quantum theory than local hidden variable models relying on the locality or detector efficiency loopholes. Some plausible versions of causal quantum theory are not refuted by any Bell experiments to date, nor is it evident that they are inconsistent with other experiments. They evade refutation via a neglected loophole in Bell experiments--the collapse locality loophole--which exists because of the possible time lag between a particle entering a measurement device and a collapse taking place. Fairly definitive tests of causal versus standard quantum theory could be made by observing entangled particles separated by ≅0.1 light seconds

  19. Locality and realism in contextual theories

    International Nuclear Information System (INIS)

    Hoekzema, D.

    1987-01-01

    Two types of contextual theories are distinguished and shown to be related. For theories of each type a criterion of locality is formulated which is weaker than the classical requirement of separability at spacelike intervals. The relations between the concepts of locality, realism, and ontic chance are discussed

  20. Local deterministic theory surviving the violation of Bell's inequalities

    International Nuclear Information System (INIS)

    Cormier-Delanoue, C.

    1984-01-01

    Bell's theorem which asserts that no deterministic theory with hidden variables can give the same predictions as quantum theory, is questioned. Such a deterministic theory is presented and carefully applied to real experiments performed on pairs of correlated photons, derived from the EPR thought experiment. The ensuing predictions violate Bell's inequalities just as quantum mechanics does, and it is further shown that this discrepancy originates in the very nature of radiations. Complete locality is therefore restored while separability remains more limited [fr

  1. Introduction to localization in quantum field theory

    International Nuclear Information System (INIS)

    Pestun, Vasily; Zabzine, Maxim

    2017-01-01

    This is the introductory chapter to this issue. We review the main idea of the localization technique and its brief history both in geometry and in QFT. We discuss localization in diverse dimensions and give an overview of the major applications of the localization calculations for supersymmetric theories. We explain the focus of the present issue. (topical review)

  2. Macroscopic quantum waves in non local theories

    International Nuclear Information System (INIS)

    Ventura, I.

    1979-01-01

    By means of an expansion in the density, it is shown that Macroscopic Quantum Waves also apear in non local theories. This result reinforces the conjecture that these waves should exist in liquid 4 He. (Author) [pt

  3. Macroscopic quantum waves in non local theories

    International Nuclear Information System (INIS)

    Ventura, I.

    1979-01-01

    By means of an expansion in the density, it is shown that Macroscopic Quantum Waves also appear in non local theories. This result reinforces the conjecture that these waves should exist in liquid 4 He [pt

  4. Diagrammatic routes to nonlocal correlations beyond dynamical mean field theory

    Science.gov (United States)

    Rohringer, G.; Hafermann, H.; Toschi, A.; Katanin, A. A.; Antipov, A. E.; Katsnelson, M. I.; Lichtenstein, A. I.; Rubtsov, A. N.; Held, K.

    2018-04-01

    Strong electronic correlations pose one of the biggest challenges to solid state theory. Recently developed methods that address this problem by starting with the local, eminently important correlations of dynamical mean field theory (DMFT) are reviewed. In addition, nonlocal correlations on all length scales are generated through Feynman diagrams, with a local two-particle vertex instead of the bare Coulomb interaction as a building block. With these diagrammatic extensions of DMFT long-range charge, magnetic, and superconducting fluctuations as well as (quantum) criticality can be addressed in strongly correlated electron systems. An overview is provided of the successes and results achieved, mainly for model Hamiltonians, and an outline is given of future prospects for realistic material calculations.

  5. Local algebras in Euclidean quantum field theory

    International Nuclear Information System (INIS)

    Guerra, Francesco.

    1975-06-01

    The general structure of the local observable algebras of Euclidean quantum field theory is described, considering the very simple examples of the free scalar field, the vector meson field, and the electromagnetic field. The role of Markov properties, and the relations between Euclidean theory and Hamiltonian theory in Minkowski space-time are especially emphasized. No conflict appears between covariance (in the Euclidean sense) and locality (in the Markov sense) on one hand and positive definiteness of the metric on the other hand [fr

  6. A Systems-Theoretical Generalization of Non-Local Correlations

    Science.gov (United States)

    von Stillfried, Nikolaus

    Non-local correlations between quantum events are not due to a causal interaction in the sense of one being the cause for the other. In principle, the correlated events can thus occur simultaneously. Generalized Quantum Theory (GQT) formalizes the idea that non-local phenomena are not exclusive to quantum mechanics, e.g. due to some specific properties of (sub)atomic particles, but that they instead arise as a consequence of the way such particles are arranged into systems. Non-local phenomena should hence occur in any system which fulfils the necessary systems-theoretical parameters. The two most important parameters with respect to non-local correlations seem to be a conserved global property of the system as a whole and sufficient degrees of freedom of the corresponding property of its subsystems. Both factors place severe limitations on experimental observability of the phenomena, especially in terms of replicability. It has been suggested that reported phenomena of a so-called synchronistic, parapsychological or paranormal kind could be understood as instances of systems-inherent non-local correlations. From a systems-theoretical perspective, their phenomenology (including the favorable conditions for their occurrence and their lack of replicability) displays substantial similarities to non-local correlations in quantum systems and matches well with systems-theoretical parameters, thus providing circumstantial evidence for this hypothesis.

  7. Hidden variables and locality in quantum theory

    International Nuclear Information System (INIS)

    Shiva, Vandana.

    1978-12-01

    The status of hidden variables in quantum theory has been debated since the 1920s. The author examines the no-hidden-variable theories of von Neumann, Kochen, Specker and Bell, and finds that they all share one basic assumption: averaging over the hidden variables should reproduce the quantum mechanical probabilities. Von Neumann also makes a linearity assumption, Kochen and Specker require the preservation of certain functional relations between magnitudes, and Bell proposes a locality condition. It has been assumed that the extrastatistical requirements are needed to serve as criteria of success for the introduction of hidden variables because the statistical condition is trivially satisfied, and that Bell's result is based on a locality condition that is physically motivated. The author shows that the requirement of weak locality, which is not physically motivated, is enough to give Bell's result. The proof of Bell's inequality works equally well for any pair of commuting magnitudes satisfying a condition called the degeneracy principle. None of the no-hidden-variable proofs apply to a class of hidden variable theories that are not phase-space reconstructions of quantum mechanics. The author discusses one of these theories, the Bohm-Bub theory, and finds that hidden variable theories that re all the quantum statistics, for single and sequential measurements, must introduce a randomization process for the hidden variables after each measurement. The philosophical significance of this theory lies in the role it can play in solving the conceptual puzzles posed by quantum theory

  8. Correlation Theory of Static and Dynamic Properties

    DEFF Research Database (Denmark)

    Lindgård, Per-Anker; Yang, D.

    1980-01-01

    A simple and practical Green's function theory, including correlations by the memory function technique, is developed for a general magnetic Hamiltonian yielding the exact results at T → 0 and T → ∞ and giving results for any q, ω and T which are considerably more accurate than obtained by the RPA...

  9. Correlation control theory of chaotic laser systems

    International Nuclear Information System (INIS)

    Li Fuli.

    1986-04-01

    A novel control theory of chaotic systems is studied. The correlation functions are calculated and used as feedback signals of the chaotic lasers. Computer experiments have shown that in this way the chaotic systems can be controlled to have time-independent output when the external control parameters are in chaotic domain. (author)

  10. Are there realistically interpretable local theories?

    International Nuclear Information System (INIS)

    d'Espagnat, B.

    1989-01-01

    Although it rests on strongly established proofs, the statement that no realistically interpretable local theory is compatible with some experimentally testable predictions of quantum mechanics seems at first sight to be incompatible with a few general ideas and clear-cut statements occurring in recent theoretical work by Griffiths, Omnes, and Ballentine and Jarrett. It is shown here that in fact none of the developments due to these authors can be considered as a realistically interpretable local theory, so that there is no valid reason for suspecting that the existing proofs of the statement in question are all flawed

  11. Generalized interferometry - I: theory for interstation correlations

    Science.gov (United States)

    Fichtner, Andreas; Stehly, Laurent; Ermert, Laura; Boehm, Christian

    2017-02-01

    We develop a general theory for interferometry by correlation that (i) properly accounts for heterogeneously distributed sources of continuous or transient nature, (ii) fully incorporates any type of linear and nonlinear processing, such as one-bit normalization, spectral whitening and phase-weighted stacking, (iii) operates for any type of medium, including 3-D elastic, heterogeneous and attenuating media, (iv) enables the exploitation of complete correlation waveforms, including seemingly unphysical arrivals, and (v) unifies the earthquake-based two-station method and ambient noise correlations. Our central theme is not to equate interferometry with Green function retrieval, and to extract information directly from processed interstation correlations, regardless of their relation to the Green function. We demonstrate that processing transforms the actual wavefield sources and actual wave propagation physics into effective sources and effective wave propagation. This transformation is uniquely determined by the processing applied to the observed data, and can be easily computed. The effective forward model, that links effective sources and propagation to synthetic interstation correlations, may not be perfect. A forward modelling error, induced by processing, describes the extent to which processed correlations can actually be interpreted as proper correlations, that is, as resulting from some effective source and some effective wave propagation. The magnitude of the forward modelling error is controlled by the processing scheme and the temporal variability of the sources. Applying adjoint techniques to the effective forward model, we derive finite-frequency Fréchet kernels for the sources of the wavefield and Earth structure, that should be inverted jointly. The structure kernels depend on the sources of the wavefield and the processing scheme applied to the raw data. Therefore, both must be taken into account correctly in order to make accurate inferences on

  12. Algebraic theory of locally nilpotent derivations

    CERN Document Server

    Freudenburg, Gene

    2017-01-01

    This book explores the theory and application of locally nilpotent derivations, a subject motivated by questions in affine algebraic geometry and having fundamental connections to areas such as commutative algebra, representation theory, Lie algebras and differential equations. The author provides a unified treatment of the subject, beginning with 16 First Principles on which the theory is based. These are used to establish classical results, such as Rentschler's Theorem for the plane and the Cancellation Theorem for Curves. More recent results, such as Makar-Limanov's theorem for locally nilpotent derivations of polynomial rings, are also discussed. Topics of special interest include progress in classifying additive actions on three-dimensional affine space, finiteness questions (Hilbert's 14th Problem), algorithms, the Makar-Limanov invariant, and connections to the Cancellation Problem and the Embedding Problem. A lot of new material is included in this expanded second edition, such as canonical factoriza...

  13. Generalized locally Toeplitz sequences theory and applications

    CERN Document Server

    Garoni, Carlo

    2017-01-01

    Based on their research experience, the authors propose a reference textbook in two volumes on the theory of generalized locally Toeplitz sequences and their applications. This first volume focuses on the univariate version of the theory and the related applications in the unidimensional setting, while the second volume, which addresses the multivariate case, is mainly devoted to concrete PDE applications. This book systematically develops the theory of generalized locally Toeplitz (GLT) sequences and presents some of its main applications, with a particular focus on the numerical discretization of differential equations (DEs). It is the first book to address the relatively new field of GLT sequences, which occur in numerous scientific applications and are especially dominant in the context of DE discretizations. Written for applied mathematicians, engineers, physicists, and scientists who (perhaps unknowingly) encounter GLT sequences in their research, it is also of interest to those working in the fields of...

  14. A correlated Walks' theory for DNA denaturation

    International Nuclear Information System (INIS)

    Mejdani, R.

    1994-08-01

    We have shown that by using a correlated Walks' theory for the lattice gas model on a one-dimensional lattice, we can study, beside the saturation curves obtained before for the enzyme kinetics, also the DNA denaturation process. In the limit of no interactions between sites the equation for melting curves of DNA reduces to the random model equation. Thus our leads naturally to this classical equation in the limiting case. (author). 22 refs, 3 figs

  15. Quantum Theories of Self-Localization

    Science.gov (United States)

    Bernstein, Lisa Joan

    In the classical dynamics of coupled oscillator systems, nonlinearity leads to the existence of stable solutions in which energy remains localized for all time. Here the quantum-mechanical counterpart of classical self-localization is investigated in the context of two model systems. For these quantum models, the terms corresponding to classical nonlinearities modify a subset of the stationary quantum states to be particularly suited to the creation of nonstationary wavepackets that localize energy for long times. The first model considered here is the Quantized Discrete Self-Trapping model (QDST), a system of anharmonic oscillators with linear dispersive coupling used to model local modes of vibration in polyatomic molecules. A simple formula is derived for a particular symmetry class of QDST systems which gives an analytic connection between quantum self-localization and classical local modes. This formula is also shown to be useful in the interpretation of the vibrational spectra of some molecules. The second model studied is the Frohlich/Einstein Dimer (FED), a two-site system of anharmonically coupled oscillators based on the Frohlich Hamiltonian and motivated by the theory of Davydov solitons in biological protein. The Born-Oppenheimer perturbation method is used to obtain approximate stationary state wavefunctions with error estimates for the FED at the first excited level. A second approach is used to reduce the first excited level FED eigenvalue problem to a system of ordinary differential equations. A simple theory of low-energy self-localization in the FED is discussed. The quantum theories of self-localization in the intrinsic QDST model and the extrinsic FED model are compared.

  16. Propositional systems in local field theories

    International Nuclear Information System (INIS)

    Banai, M.

    1980-07-01

    The authors investigate propositional systems for local field theories, which reflect intrinsically the uncertainties of measurements made on the physical system, and satisfy the isotony and local commutativity postulates of Haag and Kastler. The spacetime covariance can be implemented in natural way in these propositional systems. New techniques are introduced to obtain these propositional systems: the lattice-valued logics. The decomposition of the complete orthomodular lattice-valued logics shows that these logics are more general than the usual two-valued ones and that in these logics there is enough structure to characterize the classical and quantum, non relativistic and relativistic local field theories in a natural way. The Hilbert modules give the natural inner product ''spaces'' (modules) for the realization of the lattice-valued logics. (author)

  17. Non-local charges in local quantum field theory

    International Nuclear Information System (INIS)

    Buchholz, D.; Lopuszanski, J.T.; Rabsztyn, S.

    1985-05-01

    Non-local charges are studied in the general setting of local quantum field theory. It is shown, that these charges can be represented as polynomials in the incoming respectively outgoing fields with coefficients (kernels) which are subject to specific constraints. For the restricted class of models of a scalar, massive, self interacting particle in four dimensions, a more detailed analysis shows that all non-local charges of the generic type (genus 2) are products of generators of the Poincare group. This analysis, which is based on the macroscopic causality properties of the S-matrix, seems to indicate that less trivial examples of non-local charges can only exist in two dimensions. (orig.)

  18. Hidden variable interpretation of spontaneous localization theory

    Energy Technology Data Exchange (ETDEWEB)

    Bedingham, Daniel J, E-mail: d.bedingham@imperial.ac.uk [Blackett Laboratory, Imperial College, London SW7 2BZ (United Kingdom)

    2011-07-08

    The spontaneous localization theory of Ghirardi, Rimini, and Weber (GRW) is a theory in which wavepacket reduction is treated as a genuine physical process. Here it is shown that the mathematical formalism of GRW can be given an interpretation in terms of an evolving distribution of particles on configuration space similar to Bohmian mechanics (BM). The GRW wavefunction acts as a pilot wave for the set of particles. In addition, a continuous stream of noisy information concerning the precise whereabouts of the particles must be specified. Nonlinear filtering techniques are used to determine the dynamics of the distribution of particles conditional on this noisy information and consistency with the GRW wavefunction dynamics is demonstrated. Viewing this development as a hybrid BM-GRW theory, it is argued that, besides helping to clarify the relationship between the GRW theory and BM, its merits make it worth considering in its own right.

  19. Localization of elastic layers by correlated disorder

    International Nuclear Information System (INIS)

    Balents, L.

    1993-01-01

    The equilibrium behavior of a system of elastic layers under tension in the presence of correlated disorder is studied using functional renormalization group techniques. The model exhibits many of the features of the Bose-glass phase of type-II superconductors induced by columnar defects, but may be more directly applicable to charge density waves, incommensurate striped magnetic phases, stacked membranes under tension, vicinal crystal surfaces, or superconducting ''vortex-chains''. Below five dimensions, an epsilon expansion for the stable zero-temperature fixed point yields the properties of the glassy phase. Transverse to the direction of correlation, the randomness induces logarithmic growth of displacements. The absence of a response to a weak applied transverse field (transverse Meissner effect) is demonstrated analytically. In this simple model, the localized phase is stable to point disorder, in contrast to the behavior in the presence of dislocations, in which the converse is believed to be true. (orig.)

  20. Set Theory Correlation Free Algorithm for HRRR Target Tracking

    National Research Council Canada - National Science Library

    Blasch, Erik

    1999-01-01

    .... Recently a few fusionists including Mahler 1 and Mori 2 are using a set theory approach for a unified data fusion theory which is a correlation free paradigm 3 This paper uses the set theory approach...

  1. Local grand unification and string theory

    International Nuclear Information System (INIS)

    Nilles, Hans Peter; Vaudrevange, Patrick K.S.

    2009-09-01

    The low energy effective action of string theory depends strongly on the process of compactification and the localization of fields in extra dimensions. Explicit string constructions towards the minimal supersymmetric standard model (MSSM) reveal interesting results leading to the concept of local grand unification. Properties of the MSSM indicate that we might live at a special location close to an orbifold fixed point rather than a generic point in Calabi-Yau moduli space. We observe an enhancement of (discrete) symmetries that have various implications for the properties of the MSSM such as proton stability as well as solutions to the flavor problem, the m-problem and the strong CP-problem. (orig.)

  2. The incompatibility between local hidden variable theories and the ...

    Indian Academy of Sciences (India)

    Thus, any theory with a different correlation function, like any ... the conservation laws goes to the core of the theories of quantized observables and ... that theories or models allowing perpetual motion are ruled out on first principles.

  3. A local homology theory for linearly compact modules

    International Nuclear Information System (INIS)

    Nguyen Tu Cuong; Tran Tuan Nam

    2004-11-01

    We introduce a local homology theory for linearly modules which is in some sense dual to the local cohomology theory of A. Grothendieck. Some basic properties of local homology modules are shown such as: the vanishing and non-vanishing, the noetherianness of local homology modules. By using duality, we extend some well-known results in theory of local cohomology of A. Grothendieck. (author)

  4. Effective field theories for correlated electrons

    International Nuclear Information System (INIS)

    Wallington, J.P.

    1999-10-01

    In this thesis, techniques of functional integration are applied to the construction of effective field theories for models of strongly correlated electrons. This is accomplished by means of the Hubbard-Stratonovic transformation which maps a system of interacting fermions onto one of free fermions interacting, not with each other, but with bosonic fields representing the collective modes of the system. Different choices of transformation are investigated throughout the thesis. It is shown that there exists a new group of discrete symmetries and transformations of the Hubbard model. Using this new group, the problem of choosing a Hubbard-Stratonovic decomposition of the Hubbard interaction term is solved. In the context of the exotic doped barium bismuthates, an extended Hubbard model with on-site attraction and nearest neighbour repulsion is studied. Mean field and renormalisation group analyses show a 'pseudospin-flop' from charge density wave to superconductivity as a function of filling. The nearest neighbour attractive Hubbard model on a quasi-2D lattice is studied as a simple phenomenological model for the high-T c cuprates. Mean field theory shows a transition from pure d-wave to pure s-wave superconductivity, via a mixed symmetry s + id state. Using Gaussian fluctuations, the BCS-Bose crossover is examined and suggestions are made about the origin of the angle dependence of the pseudogap. The continuum delta-shell potential model is introduced for anisotropic superconductors. Its mean field phases are studied and found to have some unusual properties. The BCS-Bose crossover is examined and the results are compared with those of the lattice model. Quasi-2D (highly anisotropic 3D) systems are considered. The critical properties of a Bose gas are investigated as the degree of anisotropy is varied. A new 2D Bose condensate state is found. A renormalisation group analysis is used to investigate the crossover from 2D to 3D. (author)

  5. Supergauge symmetry in local quantum field theory

    International Nuclear Information System (INIS)

    Ferrara, S.

    1974-01-01

    The extension of supergauge symmetry to four-dimensional space-time allows to investigate the possible role of this symmetry in conventional local quantum field theory. The supergauge algebra is obtained by adding to the conformal group of space-time two Majorana spinor generators and the chiral charge. The commutation properties of the algebra are used to derive the most general form of the superfield. This field contains two Majorana spinors, two scalar fields, a chiral doublet, and a real vector field called the vector superfield. The covariant derivatives defined, together with the scalar and vector multiplets are the basic ingredients used in order to build up supergauge symmetric Lagrangians. It is shown that the only possible fields which can be considered as supergauge invariant Lagrangians are the F and D components of the scalar and vector multiplets respectively

  6. Wigner particle theory and local quantum physics

    International Nuclear Information System (INIS)

    Fassarella, Lucio; Schroer, Bert

    2002-01-01

    Wigner's irreducible positive energy representations of the Poincare group are often used to give additional justifications for the Lagrangian quantization formalism of standard QFT. Here we study another more recent aspect. We explain in this paper modular concepts by which we are able to construct the local operator algebras for all standard positive energy representations directly without going through field coordinations. In this way the artificial emphasis on Lagrangian field coordinates is avoided from the very beginning. These new concepts allow to treat also those cases of 'exceptional' Wigner representations associated with anyons and the famous Wigner spin tower which have remained inaccessible to Lagrangian quantization. Together with the d=1+1 factorizing models (whose modular construction has been studied previously), they form an interesting family of theories with a rich vacuum-polarization structure (but no on shell real particle creation) to which the modular methods can be applied for their explicit construction. We explain and illustrate the algebraic strategy of this construction. We also comment on possibilities of formulating the Wigner theory in a setting of a noncommutativity. (author)

  7. Wigner particle theory and local quantum physics

    Energy Technology Data Exchange (ETDEWEB)

    Fassarella, Lucio; Schroer, Bert [Centro Brasileiro de Pesquisas Fisicas (CBPF), Rio de Janeiro, RJ (Brazil)]. E-mail: fassarel@cbpf.br; schroer@cbpf.br

    2002-01-01

    Wigner's irreducible positive energy representations of the Poincare group are often used to give additional justifications for the Lagrangian quantization formalism of standard QFT. Here we study another more recent aspect. We explain in this paper modular concepts by which we are able to construct the local operator algebras for all standard positive energy representations directly without going through field coordinations. In this way the artificial emphasis on Lagrangian field coordinates is avoided from the very beginning. These new concepts allow to treat also those cases of 'exceptional' Wigner representations associated with anyons and the famous Wigner spin tower which have remained inaccessible to Lagrangian quantization. Together with the d=1+1 factorizing models (whose modular construction has been studied previously), they form an interesting family of theories with a rich vacuum-polarization structure (but no on shell real particle creation) to which the modular methods can be applied for their explicit construction. We explain and illustrate the algebraic strategy of this construction. We also comment on possibilities of formulating the Wigner theory in a setting of a noncommutativity. (author)

  8. Describing a Strongly Correlated Model System with Density Functional Theory.

    Science.gov (United States)

    Kong, Jing; Proynov, Emil; Yu, Jianguo; Pachter, Ruth

    2017-07-06

    The linear chain of hydrogen atoms, a basic prototype for the transition from a metal to Mott insulator, is studied with a recent density functional theory model functional for nondynamic and strong correlation. The computed cohesive energy curve for the transition agrees well with accurate literature results. The variation of the electronic structure in this transition is characterized with a density functional descriptor that yields the atomic population of effectively localized electrons. These new methods are also applied to the study of the Peierls dimerization of the stretched even-spaced Mott insulator to a chain of H 2 molecules, a different insulator. The transitions among the two insulating states and the metallic state of the hydrogen chain system are depicted in a semiquantitative phase diagram. Overall, we demonstrate the capability of studying strongly correlated materials with a mean-field model at the fundamental level, in contrast to the general pessimistic view on such a feasibility.

  9. Limits on nonlocal correlations from the structure of the local state space

    International Nuclear Information System (INIS)

    Janotta, Peter; Gogolin, Christian; Barrett, Jonathan; Brunner, Nicolas

    2011-01-01

    The outcomes of measurements on entangled quantum systems can be nonlocally correlated. However, while it is easy to write down toy theories allowing arbitrary nonlocal correlations, those allowed in quantum mechanics are limited. Quantum correlations cannot, for example, violate a principle known as macroscopic locality, which implies that they cannot violate Tsirelson's bound. This paper shows that there is a connection between the strength of nonlocal correlations in a physical theory and the structure of the state spaces of individual systems. This is illustrated by a family of models in which local state spaces are regular polygons, where a natural analogue of a maximally entangled state of two systems exists. We characterize the nonlocal correlations obtainable from such states. The family allows us to study the transition between classical, quantum and super-quantum correlations by varying only the local state space. We show that the strength of nonlocal correlations - in particular whether the maximally entangled state violates Tsirelson's bound or not-depends crucially on a simple geometric property of the local state space, known as strong self-duality. This result is seen to be a special case of a general theorem, which states that a broad class of entangled states in probabilistic theories-including, by extension, all bipartite classical and quantum states-cannot violate macroscopic locality. Finally, our results show that models exist that are locally almost indistinguishable from quantum mechanics, but can nevertheless generate maximally nonlocal correlations.

  10. Theory of L -edge spectroscopy of strongly correlated systems

    Science.gov (United States)

    Lüder, Johann; Schött, Johan; Brena, Barbara; Haverkort, Maurits W.; Thunström, Patrik; Eriksson, Olle; Sanyal, Biplab; Di Marco, Igor; Kvashnin, Yaroslav O.

    2017-12-01

    X-ray absorption spectroscopy measured at the L edge of transition metals (TMs) is a powerful element-selective tool providing direct information about the correlation effects in the 3 d states. The theoretical modeling of the 2 p →3 d excitation processes remains to be challenging for contemporary ab initio electronic structure techniques, due to strong core-hole and multiplet effects influencing the spectra. In this work, we present a realization of the method combining the density-functional theory with multiplet ligand field theory, proposed in Haverkort et al. [Phys. Rev. B 85, 165113 (2012), 10.1103/PhysRevB.85.165113]. In this approach, a single-impurity Anderson model (SIAM) is constructed, with almost all parameters obtained from first principles, and then solved to obtain the spectra. In our implementation, we adopt the language of the dynamical mean-field theory and utilize the local density of states and the hybridization function, projected onto TM 3 d states, in order to construct the SIAM. The developed computational scheme is applied to calculate the L -edge spectra for several TM monoxides. A very good agreement between the theory and experiment is found for all studied systems. The effect of core-hole relaxation, hybridization discretization, possible extensions of the method as well as its limitations are discussed.

  11. Localization in a one-dimensional spatially correlated random potential

    International Nuclear Information System (INIS)

    Kasner, M.; Weller, W.

    1986-01-01

    The motion of an electron in a random one-dimensional spatially correlated potential is investigated. The spatial correlation is generated by a Markov chain. It is shown that the influence of the spatial correlation can be described by means of oscillating vertices usually neglected in the Berezinskii diagram technique. Correlation mainly leads to an increase of the localization length in comparison with an uncorrelated potential. However, there is a region of the parameter, where the localization decreases. (author)

  12. Local observables in non-Abelian gauge theories

    International Nuclear Information System (INIS)

    Sharatchandra, H.S.

    1981-09-01

    Labelling of the physical states of a non-Abelian gauge theory on a lattice in terms of local observables in considered. The labelling is in terms of local color electric field observables and (separately) local color magnetic field observables. Matter field is also included. The non-local variables required when space is multiply-connected, are specified. Non-Abelian version of the Stokes' theorem is considered. Relevance to the continuum theory is discussed in detail. (orig.)

  13. Edge localized modes control: experiment and theory

    Energy Technology Data Exchange (ETDEWEB)

    Bedoulet, M.; Huysmans, G.; Thomas, P.; Joffrin, E.; Rimini, F.; Monier-Garbet, P.; Grosman, A.; Ghendrih, P. [Association Euratom-CEA, Centre d' Etudes de Cadarache, 13 - Saint-Paul-lez-Durance (France). Dept. de Recherches sur la Fusion Controlee; Parail, V.; Lomas, P.; Matthews, G.; Wilson, H.; Gryaznevich, M.; Gonsell, G.; Loarte, A.; Saibene, G.; Sartori, R.; Leonard, A.; Snyder, P.; Evans, T.; Gohil, P.; Burell, H.; Moyer, R.; Kamada, Y.; Oyama, N.; Hatae, T.; Degeling, A.; Martin, Y.; Lister, J.; Rapp, J.; Perez, C.; Lang, P.; Chankin, A.; Eich, T.; Sips, A.; Stober, J.; Horton, L.; Kallenbach, A.; Suttrop, W.; Saarelma, S.; Cowley, S.; Lonnroth, J.; Kamiya, K.; Shimada, M.; Polevoi, A.; Federici, G

    2004-07-01

    The paper reviews recent theoretical and experimental results focusing on the identification of the key factors controlling ELM (energy localized mode) energy and particle losses both in natural ELMs and in the presence of external controlling mechanisms. The theoretical description of the most studied Type-I ELMs is progressing from linear MHD stability analysis for peeling and ballooning modes to the non-linear explosive models and transport codes. Present theories cannot predict the ELM size self-consistently, however they pointed out the benefit of the high plasma shaping, high q{sub 95} and high pedestal density in reducing the ELM affected area. The experimental data also suggest that the conductive energy losses in Type-I ELM can be controlled by working in specific plasma conditions. In particular, the existence of purely convective small Type-I ELMs regimes at high q{sub 95} (>4.5) with {delta}W{sub ELM}/W{sub ped}<5% was demonstrated in high triangularity ({delta} {approx} 0.5) plasmas in JET. Small benign ELMs regimes in present machines (EDA, HRS, Type-II, grassy, QH, Type-III in impurity seeded discharges at high {delta} and their relevance for ITER parameters are reviewed briefly. The absence of already developed ITER relevant high confinement scenarios with acceptable ELMs has motivated recent intensive experimental and theoretical studies of active control of ELMs. The possibility of suppression of Type-I ELMs in H-mode scenarios at constant confinement was demonstrated in DIII-D experiments with a stochastic boundary created by external coils. It has been demonstrated in AUG that small pellets can trigger Type-I ELMs with a frequency imposed by the pellet injector. Pellet induced ELMs are similar to the intrinsic Type-I ELMs with the same frequency. At the same time the confinement degradation due to the fuelling can be minimized with pellets small as compared to the gas injection. Recent plasma current ramp experiments (JET, COMPASS-D) and

  14. Edge localized modes control: experiment and theory

    International Nuclear Information System (INIS)

    Bedoulet, M.; Huysmans, G.; Thomas, P.; Joffrin, E.; Rimini, F.; Monier-Garbet, P.; Grosman, A.; Ghendrih, P.; Parail, V.; Lomas, P.; Matthews, G.; Wilson, H.; Gryaznevich, M.; Gonsell, G.; Loarte, A.; Saibene, G.; Sartori, R.; Leonard, A.; Snyder, P.; Evans, T.; Gohil, P.; Burell, H.; Moyer, R.; Kamada, Y.; Oyama, N.; Hatae, T.; Degeling, A.; Martin, Y.; Lister, J.; Rapp, J.; Perez, C.; Lang, P.; Chankin, A.; Eich, T.; Sips, A.; Stober, J.; Horton, L.; Kallenbach, A.; Suttrop, W.; Saarelma, S.; Cowley, S.; Lonnroth, J.; Kamiya, K.; Shimada, M.; Polevoi, A.; Federici, G.

    2004-01-01

    The paper reviews recent theoretical and experimental results focusing on the identification of the key factors controlling ELM (energy localized mode) energy and particle losses both in natural ELMs and in the presence of external controlling mechanisms. The theoretical description of the most studied Type-I ELMs is progressing from linear MHD stability analysis for peeling and ballooning modes to the non-linear explosive models and transport codes. Present theories cannot predict the ELM size self-consistently, however they pointed out the benefit of the high plasma shaping, high q 95 and high pedestal density in reducing the ELM affected area. The experimental data also suggest that the conductive energy losses in Type-I ELM can be controlled by working in specific plasma conditions. In particular, the existence of purely convective small Type-I ELMs regimes at high q 95 (>4.5) with ΔW ELM /W ped <5% was demonstrated in high triangularity (δ ∼ 0.5) plasmas in JET. Small benign ELMs regimes in present machines (EDA, HRS, Type-II, grassy, QH, Type-III in impurity seeded discharges at high δ and their relevance for ITER parameters are reviewed briefly. The absence of already developed ITER relevant high confinement scenarios with acceptable ELMs has motivated recent intensive experimental and theoretical studies of active control of ELMs. The possibility of suppression of Type-I ELMs in H-mode scenarios at constant confinement was demonstrated in DIII-D experiments with a stochastic boundary created by external coils. It has been demonstrated in AUG that small pellets can trigger Type-I ELMs with a frequency imposed by the pellet injector. Pellet induced ELMs are similar to the intrinsic Type-I ELMs with the same frequency. At the same time the confinement degradation due to the fuelling can be minimized with pellets small as compared to the gas injection. Recent plasma current ramp experiments (JET, COMPASS-D) and modelling (JETTO) demonstrated that the edge

  15. Reduced density-matrix functional theory: Correlation and spectroscopy.

    Science.gov (United States)

    Di Sabatino, S; Berger, J A; Reining, L; Romaniello, P

    2015-07-14

    In this work, we explore the performance of approximations to electron correlation in reduced density-matrix functional theory (RDMFT) and of approximations to the observables calculated within this theory. Our analysis focuses on the calculation of total energies, occupation numbers, removal/addition energies, and spectral functions. We use the exactly solvable Hubbard dimer at 1/4 and 1/2 fillings as test systems. This allows us to analyze the underlying physics and to elucidate the origin of the observed trends. For comparison, we also report the results of the GW approximation, where the self-energy functional is approximated, but no further hypothesis is made concerning the approximations of the observables. In particular, we focus on the atomic limit, where the two sites of the dimer are pulled apart and electrons localize on either site with equal probability, unless a small perturbation is present: this is the regime of strong electron correlation. In this limit, using the Hubbard dimer at 1/2 filling with or without a spin-symmetry-broken ground state allows us to explore how degeneracies and spin-symmetry breaking are treated in RDMFT. We find that, within the used approximations, neither in RDMFT nor in GW, the signature of strong correlation is present, when looking at the removal/addition energies and spectral function from the spin-singlet ground state, whereas both give the exact result for the spin-symmetry broken case. Moreover, we show how the spectroscopic properties change from one spin structure to the other.

  16. Energy momentum tensor in local causal perturbation theory

    International Nuclear Information System (INIS)

    Prange, D.

    2001-01-01

    We study the energy momentum tensor in the Bogolyubov-Epstein-Glaser approach to perturbation theory. It is found to be locally conserved for a class of theories containing to derivated fields in the interaction. For the massless φ 4 -theory we derive the trace anomaly of the improved tensor. (orig.)

  17. Localization transition in SU(3) gauge theory

    Science.gov (United States)

    Kovács, Tamás G.; Vig, Réka Á.

    2018-01-01

    We study the Anderson-like localization transition in the spectrum of the Dirac operator of quenched QCD. Above the deconfining transition we determine the temperature dependence of the mobility edge separating localized and delocalized eigenmodes in the spectrum. We show that the temperature where the mobility edge vanishes and localized modes disappear from the spectrum coincides with the critical temperature of the deconfining transition. We also identify topological charge related close to zero modes in the Dirac spectrum and show that they account for only a small fraction of localized modes, a fraction that is rapidly falling as the temperature increases.

  18. Theory of Intergovernmental Grants and Local Government

    Science.gov (United States)

    Rittenoure, R. Lynn; Pluta, Joseph E.

    1977-01-01

    The article prepares the ground for an investigation designed to trace the economic effects of intergovernmental transfers by examining the motivations for the expenditure behavior of local governments and anticipates local responses to revenue sharing, both general and special. (Author/NQ)

  19. Non-local deformation of a supersymmetric field theory

    Energy Technology Data Exchange (ETDEWEB)

    Zhao, Qin [National University of Singapore, Department of Physics, Singapore (Singapore); Faizal, Mir [University of Lethbridge, Department of Physics and Astronomy, Lethbridge (Canada); University of British Columbia - Okanagan, Irving K. Barber School of Arts and Sciences, Kelowna, BC (Canada); Shah, Mushtaq B.; Ganai, Prince A. [National Institute of Technology, Department of Physics, Srinagar, Kashmir (India); Bhat, Anha [National Institute of Technology, Department of Metallurgical and Materials Engineering, Srinagar (India); Zaz, Zaid [University of Kashmir, Department of Electronics and Communication Engineering, Srinagar, Kashmir (India); Masood, Syed; Raza, Jamil; Irfan, Raja Muhammad [International Islamic University, Department of Physics, Islamabad (Pakistan)

    2017-09-15

    In this paper, we will analyze a supersymmetric field theory deformed by generalized uncertainty principle and Lifshitz scaling. It will be observed that this deformed supersymmetric field theory contains non-local fractional derivative terms. In order to construct such a deformed N = 1 supersymmetric theory, a harmonic extension of functions will be used. However, the supersymmetry will only be preserved for a free theory and will be broken by the inclusion of interaction terms. (orig.)

  20. Theory of non-hermitian localization in one dimension: Localization ...

    Indian Academy of Sciences (India)

    of the finite depinning field H . The degree of depinning is measured by the averaged .... system [2] shows a direct relationship between the localization length of the ... tight-binding model in a non-hermitian field h, where the discrete sites n, ..... shows that complex eigenvalues do not appear for field strengths less thanh2.

  1. Deformation theory and local-global compatibility of Langlands correspondences

    CERN Document Server

    Luu, Martin

    2015-01-01

    The deformation theory of automorphic representations is used to study local properties of Galois representations associated to automorphic representations of general linear groups and symplectic groups. In some cases this allows to identify the local Galois representations with representations predicted by a local Langlands correspondence.

  2. Global and local curvature in density functional theory.

    Science.gov (United States)

    Zhao, Qing; Ioannidis, Efthymios I; Kulik, Heather J

    2016-08-07

    Piecewise linearity of the energy with respect to fractional electron removal or addition is a requirement of an electronic structure method that necessitates the presence of a derivative discontinuity at integer electron occupation. Semi-local exchange-correlation (xc) approximations within density functional theory (DFT) fail to reproduce this behavior, giving rise to deviations from linearity with a convex global curvature that is evidence of many-electron, self-interaction error and electron delocalization. Popular functional tuning strategies focus on reproducing piecewise linearity, especially to improve predictions of optical properties. In a divergent approach, Hubbard U-augmented DFT (i.e., DFT+U) treats self-interaction errors by reducing the local curvature of the energy with respect to electron removal or addition from one localized subshell to the surrounding system. Although it has been suggested that DFT+U should simultaneously alleviate global and local curvature in the atomic limit, no detailed study on real systems has been carried out to probe the validity of this statement. In this work, we show when DFT+U should minimize deviations from linearity and demonstrate that a "+U" correction will never worsen the deviation from linearity of the underlying xc approximation. However, we explain varying degrees of efficiency of the approach over 27 octahedral transition metal complexes with respect to transition metal (Sc-Cu) and ligand strength (CO, NH3, and H2O) and investigate select pathological cases where the delocalization error is invisible to DFT+U within an atomic projection framework. Finally, we demonstrate that the global and local curvatures represent different quantities that show opposing behavior with increasing ligand field strength, and we identify where these two may still coincide.

  3. Localization in abelian Chern-Simons theory

    DEFF Research Database (Denmark)

    McLellan, Brendan Donald Kenneth

    2013-01-01

    Chern-Simons theory on a closed contact three-manifold is studied when the Lie group for gauge transformations is compact, connected, and abelian. The abelian Chern-Simons partition function is derived using the Faddeev-Popov gauge fixing method. The partition function is then formally computed...

  4. Damage correlation in theory and practice

    International Nuclear Information System (INIS)

    Doran, D.G.; Odette, G.R.; Simons, R.L.; Mansur, L.K.

    1977-01-01

    Common to all reactor development work is the problem of differences between the irradiation environments used for materials testing and those typical of service conditions. Efforts are being made to develop damage models that incorporate irradiation parameters such as type and energy of radiation, flux, and exposure. Models relating radiation damage production and microstructural evolution to changes in mechanical properties are primitive. Nevertheless, they suggest that the inability to account quantitatively for differences in test and service neutron spectra leads to overly conservative design of out-of-core components. Direct experimental corroboration is difficult because of the low neutron fluxes associated with the desired soft spectra. Further development of mechanistic models and new approaches to model testing are needed. Models of the growth stage of swelling, on the other hand, are relatively advanced. These models are discussed briefly as an example of how damage models can be used to help guide and analyze irradiation experiments. Accelerated damage studies using charged particles are expected to continue. Current empirical correlations of damage rates can be given a firmer theoretical basis as analysis of experiments and modeling of damage continue to improve. Damage correlation methodology practices in reactor design must necessarily follow different rules from that practiced in materials research and development. Nevertheless, decreasing the gap between them is a laudable objective with potentially significant economic impact

  5. Correlation inequalities for the Yukawa2 quantum field theory

    International Nuclear Information System (INIS)

    Rosen, L.

    1981-01-01

    Correlation inequalities have been useful in statistical mechanics and quantum field theory. In particular, in the case of strongly coupled bose quantum field models such as P(phi) 2 , correlation inequalities provide the best control of the infinite volume limit. The author reports on work in which the FKG inequality was established in the Yukawa 2 quantum field theory. An elementary proof of the first Griffiths inequality is also given. (Auth.)

  6. The velocity correlation function in cosmic-ray diffusion theory

    International Nuclear Information System (INIS)

    Forman, M.A.

    1977-01-01

    The concept of velocity correlation functions is introduced and applied to the calculation of cosmic ray spatial diffusion coefficients. It is assumed that the pitch angle scattering coefficient is already known from some other theory, and is reasonably well-behaved. Previous results for the coefficient for diffusion parallel to the mean field are recovered when the velocity-changing mechanism is artificially restricted to pitch angle scattering. The velocity correlation method is then applied to the more general case where there are fluctuations in the local mean field. It is found that the parallel diffusion coefficient is reduced in proportion to the amplitude of the field fluctuations, and that the ratio of the perpendicular to parallel diffusion coefficients cannot be greater than 2 >/B 0 2 . It is shown in the appendix that the Liouville form of the scattering equation implies that the Fokker-Planck coefficients (Δμ 2 )/Δt=2Dsub(μμ) and (Δμ)/Δt=deltaDsub(μμ)/deltaμ, and that all higher-order coefficients are identically zero. (Auth.)

  7. Index theory for locally compact noncommutative geometries

    CERN Document Server

    Carey, A L; Rennie, A; Sukochev, F A

    2014-01-01

    Spectral triples for nonunital algebras model locally compact spaces in noncommutative geometry. In the present text, the authors prove the local index formula for spectral triples over nonunital algebras, without the assumption of local units in our algebra. This formula has been successfully used to calculate index pairings in numerous noncommutative examples. The absence of any other effective method of investigating index problems in geometries that are genuinely noncommutative, particularly in the nonunital situation, was a primary motivation for this study and the authors illustrate this point with two examples in the text. In order to understand what is new in their approach in the commutative setting the authors prove an analogue of the Gromov-Lawson relative index formula (for Dirac type operators) for even dimensional manifolds with bounded geometry, without invoking compact supports. For odd dimensional manifolds their index formula appears to be completely new.

  8. Correlated effective field theory in transition metal compounds

    International Nuclear Information System (INIS)

    Mukhopadhyay, Subhasis; Chatterjee, Ibha

    2004-01-01

    Mean field theory is good enough to study the physical properties at higher temperatures and in higher dimensions. It explains the critical phenomena in a restricted sense. Near the critical temperatures, when fluctuations become important, it may not give the correct results. Similarly in low dimensions, the correlations become important and the mean field theory seems to be inadequate to explain the physical phenomena. At low-temperatures too, the quantum correlations become important and these effects are to be treated in an appropriate way. In 1974, Prof. M.E. Lines of Bell Laboratories, developed a theory which goes beyond the mean field theory and is known as the correlated effective field (CEF) theory. It takes into account the fluctuations in a semiempirical way. Lines and his collaborators used this theory to explain the short-range correlations and their anisotropy in the paramagnetic phase. Later Suzuki et al., Chatterjee and Desai, Mukhopadhyay and Chatterjee applied this theory to the magnetically ordered phase and a tremendous success of the theory has been found in real systems. The success of the CEF theory is discussed in this review. In order to highlight the success of this theory, earlier effective field theories and their improvements over mean field theories e.g., Bethe-Peierls-Weiss method, reaction field approximation, etc., are also discussed in this review for completeness. The beauty of the CEF theory is that it is mean field-like, but captures the essential physics of real systems to a great extent. However, this is a weak correlated theory and as a result is inappropriate for the metallic phase when strong correlations become important. In recent times, transition metal oxides become important due to the discovery of the high-temperature superconductivity and the colossal magnetoresistance phenomena. These oxides seem to be Mott insulators and undergo an insulator to metal transition by applying magnetic field, pressure and by changing

  9. Localizability and local gauge symmetry in quantum theory

    International Nuclear Information System (INIS)

    Leveille, J.P.

    1976-01-01

    An attempt is made to generalize a theorem of Jauch on the equivalence of local gauge symmetry and Galilean symmetry to relativistic theories. One first proves a converse to Jauch's theorem deriving the Galilei algebra from a locality postulate. When generalized to the relativistic case the locality postulate leads one to the relativistic dynamical group g 5 . A possible physical interpretation of g 5 as a relativistic dynamical group is given. An attempt to describe the dynamics solely in Minkowski space-time leads, in conjunction with the locality postulate, to a new relativistic dynamical algebra. We found that this new algebra is realized by field theoretical examples which exclude quantum electrodynamics, however, and other known gauge theories. This latter development forces one to seriously question the validity of the locality postulate. One concludes by proving a general theorem about the nonimplementability of local transformations by global operators independent of space-time in field theory

  10. Acoustic source localization : Exploring theory and practice

    NARCIS (Netherlands)

    Wind, Jelmer

    2009-01-01

    Over the past few decades, noise pollution became an important issue in modern society. This has led to an increased effort in the industry to reduce noise. Acoustic source localization methods determine the location and strength of the vibrations which are the cause of sound based onmeasurements of

  11. Gravitational theory with the local quadratic Lagrangian

    International Nuclear Information System (INIS)

    Tentyukov, M.N.

    1992-01-01

    It is suggested that the vacuum gravitational equations should be derived from the local Lagrangian containing only first-order derivatives. As an example we demonstrate the properties of the derived equations by studying of the exact spherically-symmetric solutions. 23 refs

  12. Negatively correlated local and global stock externalities: tax or subsidy?

    International Nuclear Information System (INIS)

    Zili Yang

    2006-01-01

    Fossil fuel combustion generates both CO 2 and SO 2 . CO 2 is the most important greenhouse gas; SO 2 can cause serious local pollution. But it can alleviate the potential global warming because of negative radiative forcing. Such a phenomenon can be characterized as negatively correlated local and global stock externalities. In this paper, we set up an optimal control problem of negatively correlated local and global stock externality provision. The efficiency conditions for this problem are derived. These conditions modify the Samuelson rules for optimal provision of externalities. In addition, we examine several policy related scenarios of negatively correlated local and global stock externality provisions. Finally, we discuss policy implications and limitation of the theoretical results derived in this paper. We also indicate applications of the theoretical results here to empirical research, particularly to economic analysis of multiple-gas issues in climate change. (Author)

  13. Correlation theory of crystal field and anisotropic exchange effects

    DEFF Research Database (Denmark)

    Lindgård, Per-Anker

    1985-01-01

    A general theory for including correlation effects in static and dynamic properties is presented in terms of Raccah or Stevens operators. It is explicitly developed for general crystal fields and anisotropic interactions and systems with several sublattices, like the rare earth compounds....... The theory gives explicitly a temperature dependent renormalization of both the crystal field and the interactions, and a damping of the excitations and in addition a central park component. The general theory is illustrated by a discussion of the singlet-doublet system. The correlation effects...

  14. Novel hybrid optical correlator: theory and optical simulation.

    Science.gov (United States)

    Casasent, D; Herold, R L

    1975-02-01

    The inverse transform of the product of two Fourier transform holograms is analyzed and shown to contain the correlation of the two images from which the holograms were formed. The theory, analysis, and initial experimental demonstration of the feasibility of a novel correlation scheme using this multiplied Fourier transform hologram system are presented.

  15. Theory and Algorithms for Global/Local Design Optimization

    National Research Council Canada - National Science Library

    Watson, Layne T; Guerdal, Zafer; Haftka, Raphael T

    2005-01-01

    The motivating application for this research is the global/local optimal design of composite aircraft structures such as wings and fuselages, but the theory and algorithms are more widely applicable...

  16. Nonlinear theory of localized standing waves

    OpenAIRE

    Denardo, Bruce; Larraza, Andrés; Putterman, Seth; Roberts, Paul

    1992-01-01

    An investigation of the nonlinear dispersive equations of continuum mechanics reveals localized standing-wave solutions that are domain walls between regions of different wave number. These states can appear even when the dispersion law is a single-valued function of the wave number. In addition, we calculate solutions for kinks in cutoff and noncutoff modes, as well as cutoff breather solitons. Division of Engineering and Geophysics of the Office of Basic Energy Science of U.S. DOE for su...

  17. Higher point spin field correlators in D=4 superstring theory

    International Nuclear Information System (INIS)

    Haertl, D.; Schlotterer, O.; Stieberger, S.

    2010-01-01

    Calculational tools are provided allowing to determine general tree-level scattering amplitudes for processes involving bosons and fermions in heterotic and superstring theories in four space-time dimensions. We compute higher-point superstring correlators involving massless four-dimensional fermionic and spin fields. In D=4 these correlators boil down to a product of two pure spin field correlators of left- and right-handed spin fields. This observation greatly simplifies the computation of such correlators. The latter are basic ingredients to compute multi-fermion superstring amplitudes in D=4. Their underlying fermionic structure and the fermionic couplings in the effective action are determined by these correlators.

  18. Correlations in the quantum theory of plasma line broadening

    International Nuclear Information System (INIS)

    Dufty, J.W.; Boercker, D.B.

    1976-01-01

    A unified theory of plasma line broadening is obtained from a quantum kinetic equation, paralleling existing results for a classical plasma. The atom-electron interactions are shielded by equilibrium electron correlation functions and a frequency dependent dielectric function. A 'ring' approximation is used to replace the classical plasma parameter expansion, for typical laboratory conditions. Atom-electron correlations are included as well as electron-electron correlations. (author)

  19. Nuclear collision theory with many-body correlations, 2

    International Nuclear Information System (INIS)

    Kurihara, Yukio.

    1984-12-01

    A nuclear collision theory, in which the many-body correlation induced by the strong short-ranged repulsion and medium-ranged attraction of the realistic NN interaction is explicitly included, is applied to the deuteron+deuteron elastic scattering at low energies. Pair correlation functions calculated by the present theory are very different from the Hackenbroich et al. 's one. They contain not only the short-ranged suppressive correlation, but also the medium-ranged enhancing correlation. The former changes the shape of the d-d potential from the wine-bottle one. And the latter makes the d-d potential much more attractive. This effect is necessary for reproducing a bump around thatesub(cm)=90 0 in the experimental elastic differential cross section. The phase shifts evaluated by the present theory are compared with those from the resonating-group method. (author)

  20. Statistical theory of correlations in random packings of hard particles.

    Science.gov (United States)

    Jin, Yuliang; Puckett, James G; Makse, Hernán A

    2014-05-01

    A random packing of hard particles represents a fundamental model for granular matter. Despite its importance, analytical modeling of random packings remains difficult due to the existence of strong correlations which preclude the development of a simple theory. Here, we take inspiration from liquid theories for the n-particle angular correlation function to develop a formalism of random packings of hard particles from the bottom up. A progressive expansion into a shell of particles converges in the large layer limit under a Kirkwood-like approximation of higher-order correlations. We apply the formalism to hard disks and predict the density of two-dimensional random close packing (RCP), ϕ(rcp) = 0.85 ± 0.01, and random loose packing (RLP), ϕ(rlp) = 0.67 ± 0.01. Our theory also predicts a phase diagram and angular correlation functions that are in good agreement with experimental and numerical data.

  1. Local Finite Density Theory, Statistical Blocking and Color Superconductivity

    OpenAIRE

    Ying, S.

    2000-01-01

    The motivation for the development of a local finite density theory is discussed. One of the problems related to an instability in the baryon number fluctuation of the chiral symmetry breaking phase of the quark system in the local theory is shown to exist. Such an instability problem is removed by taking into account the statistical blocking effects for the quark propagator, which depends on a macroscopic {\\em statistical blocking parameter} $\\epsilon$. This new frame work is then applied to...

  2. The incompatibility between local hidden variable theories and the ...

    Indian Academy of Sciences (India)

    I discuss in detail the result that the Bell's inequalities derived in the context of local hidden variable theories for discrete quantized observables can be satisfied only if a fundamental conservation law is violated on the average. This result shows that such theories are physically nonviable, and makes the demarcating criteria ...

  3. Multiple-Trace Operators and Non-Local String Theories

    International Nuclear Information System (INIS)

    Silverstein, Eva M.

    2001-01-01

    We propose that a novel deformation of string perturbation theory, involving non-local interactions between strings, is required to describe the gravity duals of field theories deformed by multiple-trace operators. The new perturbative expansion involves a new parameter, which is neither the string coupling nor the coefficient of a vertex operator on the worldsheet. We explore some of the properties of this deformation, focusing on a special case where the deformation in the field theory is exactly marginal

  4. Localized Donaldson-Thomas theory of surfaces

    DEFF Research Database (Denmark)

    Gholampour, Amin; Sheshmani, Artan; Yau, Shing-Tung

    2017-01-01

    Let S be a projective simply connected complex surface and  be a line bundle on S. We study the moduli space of stable compactly supported 2-dimensional sheaves on the total spaces of . The moduli space admits a ℂ∗-action induced by scaling the fibers of . We identify certain components of the......  is the canonical bundle of S, the Vafa-Witten invariants defined recently by Tanaka-Thomas, can be extracted from these localized DT invariants. VW invariants are expected to have modular properties as predicted by S-duality....

  5. Dynamic localization in quantum dots: Analytical theory

    International Nuclear Information System (INIS)

    Basko, D.M.; Skvortsov, M.A.; Kravtsov, V.E.

    2003-02-01

    We analyze the response of a complex quantum-mechanical system (e.g., a quantum dot) to a time-dependent perturbation φ(t). Assuming the dot to be described by random matrix theory for GOE we find the quantum correction to the energy absorption rate as a function of the dephasing time t φ . If φ(t) is a sum of d harmonics with incommensurate frequencies, the correction behaves similarly to that to the conductivity δσ d (t φ ) in the d-dimensional Anderson model of the orthogonal symmetry class. For a generic periodic perturbation the leading quantum correction is absent as in the systems of the unitary symmetry class, unless φ(-t+τ)=φ(t+τ) for some τ, which falls into the quasi-1d orthogonal universality class. (author)

  6. Edge localized modes control: experiment and theory

    International Nuclear Information System (INIS)

    Becoulet, M.; Huysmans, G.; Thomas, P.; Joffrin, E.; Rimini, F.; Monier-Garbet, P.; Grosman, A.; Ghendrih, P.; Parail, V.; Lomas, P.; Matthews, G.; Wilson, H.; Gryaznevich, M.; Counsell, G.; Loarte, A.; Saibene, G.; Sartori, R.; Leonard, A.; Snyder, P.; Evans, T.; Gohil, P.; Moyer, R.; Kamada, Y.; Oyama, N.; Hatae, T.; Kamiya, K.; Degeling, A.; Martin, Y.; Lister, J.; Rapp, J.; Perez, C.; Lang, P.; Chankin, A; Eich, T.; Sips, A.; Stober, J.; Horton, L.; Kallenbach, A.; Suttrop, W.; Saarelma, S.; Cowley, S.; Loennroth, J.; Shimada, M.; Polevoi, A.; Federici, G.

    2005-01-01

    The paper reviews recent theoretical and experimental results focussing on the identification of the key factors controlling ELM energy and particle losses both in natural ELMs and in the presence of external controlling mechanisms. Present experiment and theory pointed out the benefit of the high plasma shaping, high q 95 and high pedestal density in reducing the ELM affected area and conductive energy losses in Type I ELMs. Small benign ELMs regimes in present machines (EDA, HRS, Type II, Grassy, QH, Type III in impurity seeded discharges at high δ ) and their relevance for ITER are reviewed. Recent studies of active control of ELMs using stochastic boundaries, small pellets and edge current generation are presented

  7. Quantum field theory with infinite component local fields as an alternative to the string theories

    International Nuclear Information System (INIS)

    Krasnikov, N.V.

    1987-05-01

    We show that the introduction of the infinite component local fields with higher order derivatives in the interaction makes the theory completely ultraviolet finite. For the γ 5 -anomalous theories the introduction of the infinite component field makes the theory renormalizable or superrenormalizable. (orig.)

  8. Correlation and network topologies in global and local stock indices

    DEFF Research Database (Denmark)

    Nobi, A.; Lee, S.; Kim, D. H.

    2014-01-01

    the crises. A significant change in the network topologies was observed due to the financial crises in both markets. The Jaccard similarities identified the change in the market state due to a crisis in both markets. The dynamic change of the Jaccard index can be used as an indicator of systemic risk......We examined how the correlation and network structure of the global indices and local Korean indices have changed during years 2000-2012. The average correlations of the global indices increased with time, while the local indices showed a decreasing trend except for drastic changes during...... or precursors of the crisis. (C) 2014 Elsevier B.V. All rights reserved....

  9. Correlation and network topologies in global and local stock indices

    Science.gov (United States)

    Nobi, Ashadun; Lee, Sungmin; Kim, Doo Hwan; Lee, Jae Woo

    2014-07-01

    We examined how the correlation and network structure of the global indices and local Korean indices have changed during years 2000-2012. The average correlations of the global indices increased with time, while the local indices showed a decreasing trend except for drastic changes during the crises. A significant change in the network topologies was observed due to the financial crises in both markets. The Jaccard similarities identified the change in the market state due to a crisis in both markets. The dynamic change of the Jaccard index can be used as an indicator of systemic risk or precursors of the crisis.

  10. CORRELATION BETWEEN GROUP LOCAL DENSITY AND GROUP LUMINOSITY

    Energy Technology Data Exchange (ETDEWEB)

    Deng Xinfa [School of Science, Nanchang University, Jiangxi 330031 (China); Yu Guisheng [Department of Natural Science, Nanchang Teachers College, Jiangxi 330103 (China)

    2012-11-10

    In this study, we investigate the correlation between group local number density and total luminosity of groups. In four volume-limited group catalogs, we can conclude that groups with high luminosity exist preferentially in high-density regions, while groups with low luminosity are located preferentially in low-density regions, and that in a volume-limited group sample with absolute magnitude limit M{sub r} = -18, the correlation between group local number density and total luminosity of groups is the weakest. These results basically are consistent with the environmental dependence of galaxy luminosity.

  11. Effective theory of rotationally faulted multilayer graphene - the local limit

    International Nuclear Information System (INIS)

    Kindermann, M; First, P N

    2012-01-01

    Interlayer coupling in rotationally faulted graphene multilayers breaks the local sublattice-symmetry of the individual layers. Earlier we have presented a theory of this mechanism, which reduces to an effective Dirac model with space-dependent mass in an important limit. It thus makes a wealth of existing knowledge available for the study of rotationally faulted graphene multilayers. Agreement of this theory with a recent experiment in a strong magnetic field was demonstrated. Here we explore some of the predictions of this theory for the system in zero magnetic field at large interlayer bias, when it becomes local in space. We use that theory to illuminate the physics of localization and velocity renormalization in twisted graphene layers. (paper)

  12. Density functional theory and dynamical mean-field theory. A way to model strongly correlated systems

    International Nuclear Information System (INIS)

    Backes, Steffen

    2017-04-01

    The study of the electronic properties of correlated systems is a very diverse field and has lead to valuable insight into the physics of real materials. In these systems, the decisive factor that governs the physical properties is the ratio between the electronic kinetic energy, which promotes delocalization over the lattice, and the Coulomb interaction, which instead favours localized electronic states. Due to this competition, correlated electronic systems can show unique and interesting properties like the Metal-Insulator transition, diverse phase diagrams, strong temperature dependence and in general a high sensitivity to the environmental conditions. A theoretical description of these systems is not an easy task, since perturbative approaches that do not preserve the competition between the kinetic and interaction terms can only be applied in special limiting cases. One of the most famous approaches to obtain the electronic properties of a real material is the ab initio density functional theory (DFT) method. It allows one to obtain the ground state density of the system under investigation by mapping onto an effective non-interacting system that has to be found self-consistently. While being an exact theory, in practical implementations certain approximations have to be made to the exchange-correlation potential. The local density approximation (LDA), which approximates the exchange-correlation contribution to the total energy by that of a homogeneous electron gas with the corresponding density, has proven quite successful in many cases. Though, this approximation in general leads to an underestimation of electronic correlations and is not able to describe a metal-insulator transition due to electronic localization in the presence of strong Coulomb interaction. A different approach to the interacting electronic problem is the dynamical mean-field theory (DMFT), which is non-perturbative in the kinetic and interaction term but neglects all non-local

  13. Density functional theory and dynamical mean-field theory. A way to model strongly correlated systems

    Energy Technology Data Exchange (ETDEWEB)

    Backes, Steffen

    2017-04-15

    The study of the electronic properties of correlated systems is a very diverse field and has lead to valuable insight into the physics of real materials. In these systems, the decisive factor that governs the physical properties is the ratio between the electronic kinetic energy, which promotes delocalization over the lattice, and the Coulomb interaction, which instead favours localized electronic states. Due to this competition, correlated electronic systems can show unique and interesting properties like the Metal-Insulator transition, diverse phase diagrams, strong temperature dependence and in general a high sensitivity to the environmental conditions. A theoretical description of these systems is not an easy task, since perturbative approaches that do not preserve the competition between the kinetic and interaction terms can only be applied in special limiting cases. One of the most famous approaches to obtain the electronic properties of a real material is the ab initio density functional theory (DFT) method. It allows one to obtain the ground state density of the system under investigation by mapping onto an effective non-interacting system that has to be found self-consistently. While being an exact theory, in practical implementations certain approximations have to be made to the exchange-correlation potential. The local density approximation (LDA), which approximates the exchange-correlation contribution to the total energy by that of a homogeneous electron gas with the corresponding density, has proven quite successful in many cases. Though, this approximation in general leads to an underestimation of electronic correlations and is not able to describe a metal-insulator transition due to electronic localization in the presence of strong Coulomb interaction. A different approach to the interacting electronic problem is the dynamical mean-field theory (DMFT), which is non-perturbative in the kinetic and interaction term but neglects all non-local

  14. Transport through correlated systems with density functional theory.

    Science.gov (United States)

    Kurth, S; Stefanucci, G

    2017-10-18

    We present recent advances in density functional theory (DFT) for applications in the field of quantum transport, with particular emphasis on transport through strongly correlated systems. We review the foundations of the popular Landauer-Büttiker(LB)  +  DFT approach. This formalism, when using approximations to the exchange-correlation (xc) potential with steps at integer occupation, correctly captures the Kondo plateau in the zero bias conductance at zero temperature but completely fails to capture the transition to the Coulomb blockade (CB) regime as the temperature increases. To overcome the limitations of LB  +  DFT, the quantum transport problem is treated from a time-dependent (TD) perspective using TDDFT, an exact framework to deal with nonequilibrium situations. The steady-state limit of TDDFT shows that in addition to an xc potential in the junction, there also exists an xc correction to the applied bias. Open shell molecules in the CB regime provide the most striking examples of the importance of the xc bias correction. Using the Anderson model as guidance we estimate these corrections in the limit of zero bias. For the general case we put forward a steady-state DFT which is based on one-to-one correspondence between the pair of basic variables, steady density on and steady current across the junction and the pair local potential on and bias across the junction. Like TDDFT, this framework also leads to both an xc potential in the junction and an xc correction to the bias. Unlike TDDFT, these potentials are independent of history. We highlight the universal features of both xc potential and xc bias corrections for junctions in the CB regime and provide an accurate parametrization for the Anderson model at arbitrary temperatures and interaction strengths, thus providing a unified DFT description for both Kondo and CB regimes and the transition between them.

  15. Study of local correlations of magnetic and multiferroic compounds

    CERN Multimedia

    Alves, E J

    We propose to study magnetic and multiferroic strongly correlated electron materials using radioactive nuclear probe techniques, at ISOLDE . Following the strategy of a previous project, IS390, our aim is to provide local and element selective information on some of the mechanisms that rule structural, charge and orbital correlations, electronic and magnetic interactions and the coupling of the associated degrees of freedom. The main technique used is Perturbed Angular Correlations (PAC), which allows combined magnetic and electric hyperfine studies. This study is complemented by the use of conventional characterisation techniques, and the investigation of relevant macroscopic properties.

  16. No-signaling, perfect bipartite dichotomic correlations and local randomness

    International Nuclear Information System (INIS)

    Seevinck, M. P.

    2011-01-01

    The no-signaling constraint on bi-partite correlations is reviewed. It is shown that in order to obtain non-trivial Bell-type inequalities that discern no-signaling correlations from more general ones, one must go beyond considering expectation values of products of observables only. A new set of nontrivial no-signaling inequalities is derived which have a remarkably close resemblance to the CHSH inequality, yet are fundamentally different. A set of inequalities by Roy and Singh and Avis et al., which is claimed to be useful for discerning no-signaling correlations, is shown to be trivially satisfied by any correlation whatsoever. Finally, using the set of newly derived no-signaling inequalities a result with potential cryptographic consequences is proven: if different parties use identical devices, then, once they have perfect correlations at spacelike separation between dichotomic observables, they know that because of no-signaling the local marginals cannot but be completely random.

  17. Globally and locally supersymmetric effective theories for light fields

    CERN Document Server

    Brizi, Leonardo; Scrucca, Claudio A

    2009-01-01

    We reconsider the general question of how to characterize most efficiently the low-energy effective theory obtained by integrating out heavy modes in globally and locally supersymmetric theories. We consider theories with chiral and vector multiplets and identify the conditions under which an approximately supersymmetric low-energy effective theory can exist. These conditions translate into the requirements that all the derivatives, fermions and auxiliary fields should be small in units of the heavy mass scale. They apply not only to the matter sector, but also to the gravitational one if present, and imply in that case that the gravitino mass should be small. We then show how to determine the unique exactly supersymmetric theory that approximates this effective theory at the lowest order in the counting of derivatives, fermions and auxiliary fields, by working both at the superfield level and with component fields. As a result we give a simple prescription for integrating out heavy superfields in an algebrai...

  18. Biometric feature extraction using local fractal auto-correlation

    International Nuclear Information System (INIS)

    Chen Xi; Zhang Jia-Shu

    2014-01-01

    Image texture feature extraction is a classical means for biometric recognition. To extract effective texture feature for matching, we utilize local fractal auto-correlation to construct an effective image texture descriptor. Three main steps are involved in the proposed scheme: (i) using two-dimensional Gabor filter to extract the texture features of biometric images; (ii) calculating the local fractal dimension of Gabor feature under different orientations and scales using fractal auto-correlation algorithm; and (iii) linking the local fractal dimension of Gabor feature under different orientations and scales into a big vector for matching. Experiments and analyses show our proposed scheme is an efficient biometric feature extraction approach. (condensed matter: structural, mechanical, and thermal properties)

  19. Local models and hidden nonlocality in Quantum Theory

    OpenAIRE

    Guerini, Leonardo

    2014-01-01

    This Master's thesis has two central subjects: the simulation of correlations generated by local measurements on entangled quantum states by local hidden-variables models and the revelation of hidden nonlocality. We present and detail the Werner's local model and the hidden nonlocality of some Werner states of dimension $d\\geq5$, the Gisin-Degorre's local model for a Werner state of dimension $d=2$ and the local model of Hirsch et al. for mixtures of the singlet state and noise, all of them f...

  20. Framing and localization in Chern-Simons theories with matter

    Energy Technology Data Exchange (ETDEWEB)

    Bianchi, Marco S. [Center for Research in String Theory - School of Physics and Astronomy,Queen Mary University of London,Mile End Road, London E1 4NS (United Kingdom); Griguolo, Luca [Dipartimento di Fisica e Scienze della Terra, Università di Parma andINFN Gruppo Collegato di Parma,Viale G.P. Usberti 7/A, 43100 Parma (Italy); Leoni, Matias [Physics Department, FCEyN-UBA & IFIBA-CONICET,Ciudad Universitaria, Pabellón I, 1428, Buenos Aires (Argentina); Mauri, Andrea [Dipartimento di Fisica, Università degli studi di Milano-Bicocca,Piazza della Scienza 3, I-20126 Milano (Italy); Penati, Silvia [Dipartimento di Fisica, Università degli studi di Milano-Bicocca,Piazza della Scienza 3, I-20126 Milano (Italy); INFN, Sezione di Milano-Bicocca,Piazza della Scienza 3, I-20126 Milano (Italy); Seminara, Domenico [Dipartimento di Fisica, Università di Firenze and INFN Sezione di Firenze,via G. Sansone 1, 50019 Sesto Fiorentino (Italy)

    2016-06-22

    Supersymmetric localization provides exact results that should match QFT computations in some regularization scheme. The agreement is particularly subtle in three dimensions where complex answers from localization procedure sometimes arise. We investigate this problem by studying the expectation value of the 1/6 BPS Wilson loop in planar ABJ(M) theory at three loops in perturbation theory. We reproduce the corresponding term in the localization result and argue that it originates entirely from a non-trivial framing of the circular contour. Contrary to pure Chern-Simons theory, we point out that for ABJ(M) the framing phase is a non-trivial function of the couplings and that it potentially receives contributions from vertex-like diagrams. Finally, we briefly discuss the intimate link between the exact framing factor and the Bremsstrahlung function of the 1/2-BPS cusp.

  1. Pearson's correlation coefficient in the theory of networks: A comment

    OpenAIRE

    Ahmed, Zafar; Kumar, Sachin

    2018-01-01

    In statistics, the Pearson correlation coefficient $r_{x,y}$ determines the degree of linear correlation between two variables and it is known that $-1 \\le r_{x,y} \\le 1$. In the theory of networks, a curious expression proposed in [PRL {\\bf 89} 208701 (2002)] for degree-degree correlation coefficient $r_{j_i,k_i}, i\\in [1,M]$ has been in use. We realize that the suggested form is the conventional Pearson's coefficient for $\\{(j_i,k_i), (k_i,j_i)\\}$ for $2M$ data points and hence it is rightl...

  2. Local correlation detection with linearity enhancement in streaming data

    KAUST Repository

    Xie, Qing

    2013-01-01

    This paper addresses the challenges in detecting the potential correlation between numerical data streams, which facilitates the research of data stream mining and pattern discovery. We focus on local correlation with delay, which may occur in burst at different time in different streams, and last for a limited period. The uncertainty on the correlation occurrence and the time delay make it diff cult to monitor the correlation online. Furthermore, the conventional correlation measure lacks the ability of ref ecting visual linearity, which is more desirable in reality. This paper proposes effective methods to continuously detect the correlation between data streams. Our approach is based on the Discrete Fourier Transform to make rapid cross-correlation calculation with time delay allowed. In addition, we introduce a shape-based similarity measure into the framework, which ref nes the results by representative trend patterns to enhance the signif cance of linearity. The similarity of proposed linear representations can quickly estimate the correlation, and the window sliding strategy in segment level improves the eff ciency for online detection. The empirical study demonstrates the accuracy of our detection approach, as well as more than 30% improvement of eff ciency. Copyright 2013 ACM.

  3. Local computations in Dempster-Shafer theory of evidence

    Czech Academy of Sciences Publication Activity Database

    Jiroušek, Radim

    2012-01-01

    Roč. 53, č. 8 (2012), s. 1155-1167 ISSN 0888-613X Grant - others:GA ČR(CZ) GAP403/12/2175 Program:GA Institutional support: RVO:67985556 Keywords : Discrete belief functions * Dempster-Shafer theory * conditional independence * decomposable model Subject RIV: IN - Informatics, Computer Science Impact factor: 1.729, year: 2012 http://library.utia.cas.cz/separaty/2012/MTR/jirousek-local computations in dempster–shafer theory of evidence. pdf

  4. The generally covariant locality principle - a new paradigm for local quantum field theory

    International Nuclear Information System (INIS)

    Brunetti, R.; Fredenhagen, K.; Verch, R.

    2002-05-01

    A new approach to the model-independent description of quantum field theories will be introduced in the present work. The main feature of this new approach is to incorporate in a local sense the principle of general covariance of general relativity, thus giving rise to the concept of a locally covariant quantum field theory. Such locally covariant quantum field theories will be described mathematically in terms of covariant functors between the categories, on one side, of globally hyperbolic spacetimes with isometric embeddings as morphisms and, on the other side, of *-algebras with unital injective *-endomorphisms as morphisms. Moreover, locally covariant quantum fields can be described in this framework as natural transformations between certain functors. The usual Haag-Kastler framework of nets of operator-algebras over a fixed spacetime background-manifold, together with covariant automorphic actions of the isometry-group of the background spacetime, can be re-gained from this new approach as a special case. Examples of this new approach are also outlined. In case that a locally covariant quantum field theory obeys the time-slice axiom, one can naturally associate to it certain automorphic actions, called ''relative Cauchy-evolutions'', which describe the dynamical reaction of the quantum field theory to a local change of spacetime background metrics. The functional derivative of a relative Cauchy-evolution with respect to the spacetime metric is found to be a divergence-free quantity which has, as will be demonstrated in an example, the significance of an energy-momentum tensor for the locally covariant quantum field theory. Furthermore, we discuss the functorial properties of state spaces of locally covariant quantum field theories that entail the validity of the principle of local definiteness. (orig.)

  5. Einstein locality, EPR locality, and the significance for science of the nonlocal character of quantum theory

    International Nuclear Information System (INIS)

    Stapp, H.P.

    1985-10-01

    The immense difference between Einstein locality and EPR locality is discussed. The latter provides a basis for establishing the nonlocal character of quantum theory, whereas the former does not. A model representing Heisenberg's idea of physical reality is introduced. It is nondeterministic and holistic: the objects, measuring devices, and their environment are treated as an inseparable entity, with, however, macroscopically localizable attributes. The EPR principle that no disturbance can propagate faster than light is imposed without assuming any structure incompatible with orthodox quantum thinking. This locality requirement renders the model incompatible with rudimentary predictions of quantum theory. A more general proof not depending on any model is also given. A recent argument that purports to show that quantum theory is compatible with EPR locality is examined. It illustrates the importance of the crucial one-world assumption. The significance for science of the failure of EPR locality is discussed

  6. Why two local BRS algebras in bosonic string theory

    International Nuclear Information System (INIS)

    Bouda, A.

    1993-01-01

    This paper is the first of a set of two articles in which a local Becchi-Rouet-Stora (BRS) operator for string and superstring theories is constructed by using a new procedure in which the nil potency is automatically guaranteed. In this article, it is shown that in bosonic string theory, there are two different methods of dilating the ghost which give rise to two different local BRS algebras. The first method leads to well-known results, already obtained by another procedure. The second method has been applied previously by the author. (author). 8 refs

  7. On the theory of spatial localization of photons

    International Nuclear Information System (INIS)

    Keller, Ole

    2005-01-01

    In the quantum physics of near-field optics and optical tunneling light-matter interactions are studied on a length scale (much) smaller than the wavelength of light, and questions regarding the possibilities for strong spatial localization of electromagnetic fields are here in focus. Some of these questions relate to the spatial resolution problem in optics, a problem which has gained considerable attention in connection to optical investigations of mesoscopic systems. Optics beyond the classical diffraction limit has renewed our interest in the various theories for spatial localization of single photons. In the present work aspects of these theories of particular importance for light-matter interaction on the microscopic and mesoscopic length scales are reviewed. Photon wave mechanics, i.e. the (rather unknown) first quantized theory of the photon, allows us to address the spatial field localization problem in a flexible manner which links smoothly to classical electromagnetics. The wave mechanics of free photons is discussed both in the momentum-time domain (Part A) and in the space-time domain (Part B). The first-quantized theory of spatial localization of photons subjected to field-matter interaction is described in Part C, paying particular attendance to the so-called photon energy wave function concept. In Part D, the spatial localization of photons are studied on a field theoretic (second-quantized) basis. The coarse-grained photon localization theory and the spatial localization perceived in various representations (gauges) here are core issues. In the two last parts of the review I describe photon fields in near-field optics (Part E), and the optical tunneling phenomenon, here seen as a fingerprint of weak photon localizability (Part F)

  8. Globally conformal invariant gauge field theory with rational correlation functions

    CERN Document Server

    Nikolov, N M; Todorov, I T; CERN. Geneva; Todorov, Ivan T.

    2003-01-01

    Operator product expansions (OPE) for the product of a scalar field with its conjugate are presented as infinite sums of bilocal fields $V_{\\kappa} (x_1, x_2)$ of dimension $(\\kappa, \\kappa)$. For a {\\it globally conformal invariant} (GCI) theory we write down the OPE of $V_{\\kappa}$ into a series of {\\it twist} (dimension minus rank) $2\\kappa$ symmetric traceless tensor fields with coefficients computed from the (rational) 4-point function of the scalar field. We argue that the theory of a GCI hermitian scalar field ${\\cal L} (x)$ of dimension 4 in $D = 4$ Minkowski space such that the 3-point functions of a pair of ${\\cal L}$'s and a scalar field of dimension 2 or 4 vanish can be interpreted as the theory of local observables of a conformally invariant fixed point in a gauge theory with Lagrangian density ${\\cal L} (x)$.

  9. Reducible gauge theories in local superfield Lagrangian BRST quantization

    Energy Technology Data Exchange (ETDEWEB)

    Gitman, D. M. [Universidade de Sao Paulo (USP), SP (Brazil). Inst. de Fisica; Moshin, P.Yu. [Tomsk State Pedagogical University (Russian Federation); Reshetnyak, A.A. [Inst. of Strength Physics and Materials Science, Tomsk (Russian Federation). Lab. of Non-equilibrium State Theory

    2007-12-15

    The construction of {theta}-local superfield Lagrangian BRST quantization in non-Abelian hyper gauges for generic gauge theories based on the action principle is examined in the case of reducible local superfield models (LSM) on the basis of embedding a gauge theory into a special {theta}-local superfield model with anti symplectic constraints and a Grassmann-odd time parameter {theta}. We examine the problem of establishing a new correspondence between the odd-Lagrangian and odd-Hamiltonian formulations of a local LSM in the case of degeneracy of the Lagrangian description with respect to derivatives over {theta} of generalized classical superfields A{sup I}({theta}). We also reveal the role of the nilpotent BRST-BFV charge for a formal dynamical system corresponding to the BV-BFV dual description of an LSM. (author)

  10. The Correlation between Game Theory and International Trade

    Directory of Open Access Journals (Sweden)

    Simona-Valeria TOMA

    2012-08-01

    Full Text Available The Correlation between Game Theory and International TradeAbstract:Game theory, in its most basic form, considers two or more players and analyses the different strategies that they can use and the effect that these strategies will have on each player. International trade allows countries to use better their resources (labor, technology or capital. Since countries have different capital or natural resources, some of them will produce a good more efficiently than others and therefore could sell it cheaper than other countries. By using game theory in international trade we could determine if the Heckscher-Ohlin-Samuelson model is correct and what would be the best specialization for each country. The aim of this paper is to test if game theory could be successfully used in a thorough analysis of international trade specialization.

  11. From the Weyl theory to a theory of locally anisotropic space-time

    International Nuclear Information System (INIS)

    Bogoslovsky, G.Yu.

    1991-01-01

    It is shown that Weyl ideas, pertaining to local conformal invariance, find natural embodiment within the framework of a relativistic theory based on a viable Finslerian model of space-time. This is associated with the peculiar property of the conformal invariant Finslerian metric which describes a locally anisotropic space of events. The local conformal transformations of the Riemannian metric tensor leave invariant rest masses as well as all observables and thus appear as local gauge transformations. The corresponding Finslerian theory of gravitation turns out, as a result, to be an Abelian gauge theory. It satisfies the principle of correspondence with Einstein theory and predicts a number of nontrivial physical effects accessible for experimental test under laboratory conditions. 13 refs

  12. Role of locality in Einstein-Podolsky-Rosen correlations and teleportation

    International Nuclear Information System (INIS)

    Treacy, P.B.

    2003-01-01

    Two-body systems with pure entangled wave functions are known not to satisfy local realism; that is, they display nonlocality. However, it is noted that the well-known conclusion of the EPR paradox that quantum mechanics is an incomplete theory is inconclusive, and that local quantum-mechanical calculations are sufficient to explain two-body correlations. Such correlations are commonly attributed to an instant nonlocal interaction, but that is neither required nor observable in a two-body system. However, nonlocal transmission could be directly detected in sequential three-body processes, and a test for this is proposed by the direct timing of the teleportation of a wave function. The result of this would help towards establishing a dynamical theory of teleportation

  13. Globally and locally supersymmetric effective theories for light fields

    International Nuclear Information System (INIS)

    Brizi, Leonardo; Gomez-Reino, Marta; Scrucca, Claudio A.

    2009-01-01

    We reconsider the general question of how to characterize most efficiently the low-energy effective theory obtained by integrating out heavy modes in globally and locally supersymmetric theories. We consider theories with chiral and vector multiplets and identify the conditions under which an approximately supersymmetric low-energy effective theory can exist. These conditions translate into the requirements that all the derivatives, fermions and auxiliary fields should be small in units of the heavy mass scale. They apply not only to the matter sector, but also to the gravitational one if present, and imply in that case that the gravitino mass should be small. We then show how to determine the unique exactly supersymmetric theory that approximates this effective theory at the lowest order in the counting of derivatives, fermions and auxiliary fields, by working both at the superfield level and with component fields. As a result we give a simple prescription for integrating out heavy superfields in an algebraic and manifestly supersymmetric way, which turns out to hold in the same form both for globally and locally supersymmetric theories, meaning that the process of integrating out heavy modes commutes with the process of switching on gravity. More precisely, for heavy chiral and vector multiplets one has to impose respectively stationarity of the superpotential and the Kaehler potential.

  14. Hanbury Brown and Twiss correlations of Anderson localized waves

    International Nuclear Information System (INIS)

    Lahini, Y.; Bromberg, Y.; Silberberg, Y.; Shechtman, Y.; Szameit, A.; Christodoulides, D. N.; Morandotti, R.

    2011-01-01

    When light waves propagate through disordered photonic lattices, they can eventually become localized due to multiple scattering effects. Here we show experimentally that while the evolution and localization of the photon density distribution is similar in the two cases of diagonal and off-diagonal disorder, the density-density correlation carries a distinct signature of the type of disorder. We show that these differences reflect a symmetry in the spectrum and eigenmodes that exists in off-diagonally disordered lattices but is absent in lattices with diagonal disorder.

  15. A local dynamic correlation function from inelastic neutron scattering

    International Nuclear Information System (INIS)

    McQueeney, R.J.

    1997-01-01

    Information about local and dynamic atomic correlations can be obtained from inelastic neutron scattering measurements by Fourier transform of the Q-dependent intensity oscillations at a particular frequency. A local dynamic structure function, S(r,ω), is defined from the dynamic scattering function, S(Q,ω), such that the elastic and frequency-integrated limits correspond to the average and instantaneous pair-distribution functions, respectively. As an example, S(r,ω) is calculated for polycrystalline aluminum in a model where atomic motions are entirely due to harmonic phonons

  16. Time-localized wavelet multiple regression and correlation

    Science.gov (United States)

    Fernández-Macho, Javier

    2018-02-01

    This paper extends wavelet methodology to handle comovement dynamics of multivariate time series via moving weighted regression on wavelet coefficients. The concept of wavelet local multiple correlation is used to produce one single set of multiscale correlations along time, in contrast with the large number of wavelet correlation maps that need to be compared when using standard pairwise wavelet correlations with rolling windows. Also, the spectral properties of weight functions are investigated and it is argued that some common time windows, such as the usual rectangular rolling window, are not satisfactory on these grounds. The method is illustrated with a multiscale analysis of the comovements of Eurozone stock markets during this century. It is shown how the evolution of the correlation structure in these markets has been far from homogeneous both along time and across timescales featuring an acute divide across timescales at about the quarterly scale. At longer scales, evidence from the long-term correlation structure can be interpreted as stable perfect integration among Euro stock markets. On the other hand, at intramonth and intraweek scales, the short-term correlation structure has been clearly evolving along time, experiencing a sharp increase during financial crises which may be interpreted as evidence of financial 'contagion'.

  17. Mermin Non-Locality in Abstract Process Theories

    Directory of Open Access Journals (Sweden)

    Stefano Gogioso

    2015-11-01

    Full Text Available The study of non-locality is fundamental to the understanding of quantum mechanics. The past 50 years have seen a number of non-locality proofs, but its fundamental building blocks, and the exact role it plays in quantum protocols, has remained elusive. In this paper, we focus on a particular flavour of non-locality, generalising Mermin's argument on the GHZ state. Using strongly complementary observables, we provide necessary and sufficient conditions for Mermin non-locality in abstract process theories. We show that the existence of more phases than classical points (aka eigenstates is not sufficient, and that the key to Mermin non-locality lies in the presence of certain algebraically non-trivial phases. This allows us to show that fRel, a favourite toy model for categorical quantum mechanics, is Mermin local. We show Mermin non-locality to be the key resource ensuring the device-independent security of the HBB CQ (N,N family of Quantum Secret Sharing protocols. Finally, we challenge the unspoken assumption that the measurements involved in Mermin-type scenarios should be complementary (like the pair X,Y, opening the doors to a much wider class of potential experimental setups than currently employed. In short, we give conditions for Mermin non-locality tests on any number of systems, where each party has an arbitrary number of measurement choices, where each measurement has an arbitrary number of outcomes and further, that works in any abstract process theory.

  18. Quantum objects. Non-local correlation, causality and objective indefiniteness in the quantum world

    International Nuclear Information System (INIS)

    Jaeger, Gregg

    2014-01-01

    Presents interpretation of quantum mechanics, advances in quantum foundations and philosophy of quantum mechanics. Explains non-locality and its relationship to causality and probability in quantum theory. Displays foundational characteristics of quantum physic to understand conceptual origins of the unusual nature of quantum phenomena. Describes relationship of subsystems and space-time. Gives a careful review of existing views. Confronts the old approaches with recent results and approaches from quantum information theory. Delivers a clear and thorough analysis of the quantum events in the context of relativistic space-time, which impacts the problem of creating a theory of quantum gravity. Supplies a detailed discussion of non-local correlation within and beyond the bounds set by standard quantum mechanics, which impacts the foundations of information theory. Gives a detailed discussion of probabilistic causation (central to contemporary accounts of causation) in quantum mechanics and relativity. Leads a thorough discussion of the nature of ''quantum potentiality,'' the novel form of existence arising for the first time in quantum mechanics. This monograph identifies the essential characteristics of the objects described by current quantum theory and considers their relationship to space-time. In the process, it explicates the senses in which quantum objects may be consistently considered to have parts of which they may be composed or into which they may be decomposed. The book also demonstrates the degree to which reduction is possible in quantum mechanics, showing it to be related to the objective indefiniteness of quantum properties and the strong non-local correlations that can occur between the physical quantities of quantum subsystems. Careful attention is paid to the relationships among such property correlations, physical causation, probability, and symmetry in quantum theory. In this way, the text identifies and clarifies the conceptual grounds

  19. Quantum objects. Non-local correlation, causality and objective indefiniteness in the quantum world

    Energy Technology Data Exchange (ETDEWEB)

    Jaeger, Gregg [Boston Univ., MA (United States). Natural Sciences and Mathematics

    2014-07-01

    Presents interpretation of quantum mechanics, advances in quantum foundations and philosophy of quantum mechanics. Explains non-locality and its relationship to causality and probability in quantum theory. Displays foundational characteristics of quantum physic to understand conceptual origins of the unusual nature of quantum phenomena. Describes relationship of subsystems and space-time. Gives a careful review of existing views. Confronts the old approaches with recent results and approaches from quantum information theory. Delivers a clear and thorough analysis of the quantum events in the context of relativistic space-time, which impacts the problem of creating a theory of quantum gravity. Supplies a detailed discussion of non-local correlation within and beyond the bounds set by standard quantum mechanics, which impacts the foundations of information theory. Gives a detailed discussion of probabilistic causation (central to contemporary accounts of causation) in quantum mechanics and relativity. Leads a thorough discussion of the nature of ''quantum potentiality,'' the novel form of existence arising for the first time in quantum mechanics. This monograph identifies the essential characteristics of the objects described by current quantum theory and considers their relationship to space-time. In the process, it explicates the senses in which quantum objects may be consistently considered to have parts of which they may be composed or into which they may be decomposed. The book also demonstrates the degree to which reduction is possible in quantum mechanics, showing it to be related to the objective indefiniteness of quantum properties and the strong non-local correlations that can occur between the physical quantities of quantum subsystems. Careful attention is paid to the relationships among such property correlations, physical causation, probability, and symmetry in quantum theory. In this way, the text identifies and clarifies the

  20. Measuring capital market efficiency: Global and local correlations structure

    Czech Academy of Sciences Publication Activity Database

    Krištoufek, Ladislav; Vošvrda, Miloslav

    2013-01-01

    Roč. 392, č. 1 (2013), s. 184-193 ISSN 0378-4371 R&D Projects: GA ČR(CZ) GBP402/12/G097 Institutional support: RVO:67985556 Keywords : Capital market efficiency * Fractal dimension * Long-range dependence * Short-range dependence Subject RIV: AH - Economics Impact factor: 1.722, year: 2013 http://library.utia.cas.cz/separaty/2012/E/kristoufek-measuring capital market efficiency global and local correlations structure.pdf

  1. Rate Theory for Correlated Processes: Double Jumps in Adatom Diffusion

    DEFF Research Database (Denmark)

    Jacobsen, J.; Jacobsen, Karsten Wedel; Sethna, J.

    1997-01-01

    We study the rate of activated motion over multiple barriers, in particular the correlated double jump of an adatom diffusing on a missing-row reconstructed platinum (110) surface. We develop a transition path theory, showing that the activation energy is given by the minimum-energy trajectory...... which succeeds in the double jump. We explicitly calculate this trajectory within an effective-medium molecular dynamics simulation. A cusp in the acceptance region leads to a root T prefactor for the activated rate of double jumps. Theory and numerical results agree....

  2. Non-static local string in Brans–Dicke theory

    Indian Academy of Sciences (India)

    Abstract. A recent investigation showed that a local gauge string with a phenomenological energy momentum tensor, as prescribed by Vilenkin, is inconsistent in Brans–Dicke theory. In this work it has been shown that such a string is indeed consistent if one introduces time dependences in the metric. A set of solutions of full ...

  3. Locally semisimple algebras. Combinatorial theory and the K0-functor

    International Nuclear Information System (INIS)

    Vershik, A.M.; Kerov, S.V.

    1987-01-01

    Survey is devoted to theory of locally finite algebras and approximately finite-dimensional absolute value of AF- C*-algebras which has been developed intensively in recent years. It can serve as an introduction to the subject. Both known and new results are contained in it

  4. The correlation of local deformation and stress-assisted local phase transformations in MMC foams

    Energy Technology Data Exchange (ETDEWEB)

    Berek, H., E-mail: harry.berek@ikgb.tu-freiberg.de [TU Bergakademie Freiberg, Agricolastraße 17, D-09599 Freiberg (Germany); Ballaschk, U.; Aneziris, C.G. [TU Bergakademie Freiberg, Agricolastraße 17, D-09599 Freiberg (Germany); Losch, K.; Schladitz, K. [Fraunhofer ITWM, Fraunhoferplatz 1, D-67663 Kaiserslautern (Germany)

    2015-09-15

    Cellular structures are of growing interest for industry, and are of particular importance for lightweight applications. In this paper, a special case of metal matrix composite foams (MMCs) is investigated. The investigated foams are composed of austenitic steel exhibiting transformation induced plasticity (TRIP) and magnesia partially stabilized zirconia (Mg-PSZ). Both components exhibit martensitic phase transformation during deformation, thus generating the potential for improved mechanical properties such as strength, ductility, and energy absorption capability. The aim of these investigations was to show that stress-assisted phase transformations within the ceramic reinforcement correspond to strong local deformation, and to determine whether they can trigger martensitic phase transformations in the steel matrix. To this end, in situ interrupted compression experiments were performed in an X-ray computed tomography device (XCT). By using a recently developed registration algorithm, local deformation could be calculated and regions of interest could be defined. Corresponding cross sections were prepared and used to analyze the local phase composition by electron backscatter diffraction (EBSD). The results show a strong correlation between local deformation and phase transformation. - Graphical abstract: Display Omitted - Highlights: • In situ compressive deformation on MMC foams was performed in an XCT. • Local deformation fields and their gradient amplitudes were estimated. • Cross sections were manufactured containing defined regions of interest. • Local EBSD phase analysis was performed. • Local deformation and local phase transformation are correlated.

  5. The correlation of local deformation and stress-assisted local phase transformations in MMC foams

    International Nuclear Information System (INIS)

    Berek, H.; Ballaschk, U.; Aneziris, C.G.; Losch, K.; Schladitz, K.

    2015-01-01

    Cellular structures are of growing interest for industry, and are of particular importance for lightweight applications. In this paper, a special case of metal matrix composite foams (MMCs) is investigated. The investigated foams are composed of austenitic steel exhibiting transformation induced plasticity (TRIP) and magnesia partially stabilized zirconia (Mg-PSZ). Both components exhibit martensitic phase transformation during deformation, thus generating the potential for improved mechanical properties such as strength, ductility, and energy absorption capability. The aim of these investigations was to show that stress-assisted phase transformations within the ceramic reinforcement correspond to strong local deformation, and to determine whether they can trigger martensitic phase transformations in the steel matrix. To this end, in situ interrupted compression experiments were performed in an X-ray computed tomography device (XCT). By using a recently developed registration algorithm, local deformation could be calculated and regions of interest could be defined. Corresponding cross sections were prepared and used to analyze the local phase composition by electron backscatter diffraction (EBSD). The results show a strong correlation between local deformation and phase transformation. - Graphical abstract: Display Omitted - Highlights: • In situ compressive deformation on MMC foams was performed in an XCT. • Local deformation fields and their gradient amplitudes were estimated. • Cross sections were manufactured containing defined regions of interest. • Local EBSD phase analysis was performed. • Local deformation and local phase transformation are correlated

  6. Correlators of Ramond-Neveu-Schwarz fields in string theory

    Energy Technology Data Exchange (ETDEWEB)

    Haertl, Daniel

    2011-07-15

    In this thesis we provide calculational tools in order to calculate scattering amplitudes in string theory at tree- and loop-level. In particular, we discuss the calculation of correlation functions consisting of Ramond-Neveu-Schwarz fields in four, six, eight and ten space-time dimensions and calculate the amplitude involving two gauge fields and four gauginos at tree-level. Multi-parton superstring amplitudes are of considerable theoretical interest in the frame-work of a full-fledged superstring theory and of phenomenological interest in describing corrections to four-dimensional scattering processes. The Neveu-Schwarz fermions and Ramond spin fields enter the scattering amplitudes through vertex operators of bosonic and fermionic string states and determine the Lorentz structure of the total amplitude. Due to their interacting nature their correlators cannot be evaluated using Wick's theorem but must be calculated from first principles. At tree-level such correlation functions can be determined by analyzing their Lorentz and singularity structure. In four space-time dimensions we show how to calculate Ramond- Neveu-Schwarz correlators with any number of fields. This method is based on factorizing the expressions into correlators involving only left- or right-handed spin fields and calculating these functions. This factorization property does not hold in higher dimensions. Nevertheless, we are able to calculate certain classes of correlators with arbitrary many fields. Additionally, in eight dimensions we can profit from SO(8) triality to derive further tree-level correlation functions. Ramond-Neveu-Schwarz correlators at loop-level can be evaluated by re-expressing the fermions and spin fields in terms of SO(2) spin system operators. Using this method we present expressions for all correlators up to six-point level and show in addition results for certain classes of correlators with any number of fields. Our findings hold for string scattering at arbitrary

  7. Correlators of Ramond-Neveu-Schwarz fields in string theory

    International Nuclear Information System (INIS)

    Haertl, Daniel

    2011-01-01

    In this thesis we provide calculational tools in order to calculate scattering amplitudes in string theory at tree- and loop-level. In particular, we discuss the calculation of correlation functions consisting of Ramond-Neveu-Schwarz fields in four, six, eight and ten space-time dimensions and calculate the amplitude involving two gauge fields and four gauginos at tree-level. Multi-parton superstring amplitudes are of considerable theoretical interest in the frame-work of a full-fledged superstring theory and of phenomenological interest in describing corrections to four-dimensional scattering processes. The Neveu-Schwarz fermions and Ramond spin fields enter the scattering amplitudes through vertex operators of bosonic and fermionic string states and determine the Lorentz structure of the total amplitude. Due to their interacting nature their correlators cannot be evaluated using Wick's theorem but must be calculated from first principles. At tree-level such correlation functions can be determined by analyzing their Lorentz and singularity structure. In four space-time dimensions we show how to calculate Ramond- Neveu-Schwarz correlators with any number of fields. This method is based on factorizing the expressions into correlators involving only left- or right-handed spin fields and calculating these functions. This factorization property does not hold in higher dimensions. Nevertheless, we are able to calculate certain classes of correlators with arbitrary many fields. Additionally, in eight dimensions we can profit from SO(8) triality to derive further tree-level correlation functions. Ramond-Neveu-Schwarz correlators at loop-level can be evaluated by re-expressing the fermions and spin fields in terms of SO(2) spin system operators. Using this method we present expressions for all correlators up to six-point level and show in addition results for certain classes of correlators with any number of fields. Our findings hold for string scattering at arbitrary loop

  8. Probing N=2 superconformal field theories with localization

    Energy Technology Data Exchange (ETDEWEB)

    Fiol, Bartomeu [Departament de Física Fonamental i Institut de Ciències del Cosmos,Universitat de Barcelona,Martí i Franquès 1, 08028 Barcelona, Catalonia (Spain); Garolera, Blai [Escuela de Física, Universidad de Costa Rica,11501-2060 San José (Costa Rica); Torrents, Genís [Departament de Física Fonamental i Institut de Ciències del Cosmos,Universitat de Barcelona,Martí i Franquès 1, 08028 Barcelona, Catalonia (Spain)

    2016-01-27

    We use supersymmetric localization to study probes of four dimensional Lagrangian N=2 superconformal field theories. We first derive a unique equation for the eigenvalue density of these theories. We observe that these theories have a Wigner eigenvalue density precisely when they satisfy a necessary condition for having a holographic dual with a sensible higher-derivative expansion. We then compute in the saddle-point approximation the vacuum expectation value of 1/2-BPS circular Wilson loops, and the two-point functions of these Wilson loops with the Lagrangian density and with the stress-energy tensor. This last computation also provides the corresponding Bremsstrahlung functions and entanglement entropies. As expected, whenever a finite fraction of the matter is in the fundamental representation, the results are drastically different from those of N=4 supersymmetric Yang-Mills theory.

  9. String theory considered as a local gauge theory of an extended object

    International Nuclear Information System (INIS)

    Chan Hongmo; Tsou Sheungtsun.

    1986-11-01

    In attempting to understand more about the physical origin of the so-called 'chordal gauge symmetry' in string field theory it is found that one can, at least formally, consider the theory as a generalised local gauge theory. However, the fundamental object is no longer a point, as in ordinary gauge theory, but a point with a tail, and it is the motion of this tail which represents the internal gauge degree of freedom. Moreover, the differential geometry is based on the non-abelian conformal group instead of the usual translation group. (author)

  10. Do EPR-Bell correlations require a non-local interpretation of quantum mechanics? I: Wigner approach

    International Nuclear Information System (INIS)

    Scully, Marlan O.; Erez, Noam; Fry, Edward S.

    2005-01-01

    Bell inequality experiments teach us that, to explain the data, a hidden variable theory must be non-local. But, to also apply this conclusion to quantum mechanics is unjustified. The key assumptions required to obtain a Bell inequality are (1) locality and (2) the assignment of meaningful (non-negative) probabilities to seemingly physical correlations (Bell expresses these correlations via 'hidden variables'). Since the Bell inequality is violated by experiment, at least one of these assumptions is wrong. The widespread conclusion that locality must be relinquished is unwarranted; rather, the previously mentioned correlations are not physical observables-they are not elements of physical reality

  11. Correlated density matrix theory of spatially inhomogeneous Bose fluids

    International Nuclear Information System (INIS)

    Gernoth, K.A.; Clark, J.W.; Ristig, M.L.

    1994-06-01

    In this paper, the variational Hartree-Jastrow theory of the ground state of spatially inhomogeneous Bose systems is extended to finite temperatures. The theory presented here is a generalization also in the sense that it extends the correlated density matrix approach, formulated previously for uniform Bose fluids, to systems with nonuniform density profiles. The method provides a framework in which the effects of thermal excitations on the spatial structure of a Bose fluid, as represented by the density profile and the two-body distribution functions, may be discussed on the basis on an ab initio microscopic description of the system. Thermal excitations make their appearance through self-consistently determined one-body and two-body potentials which enter the nonlinear, coupled Euler-Lagrange equations for the one-body density and for the pair distribution function. Since back-flow correlations are neglected, the excitations are described by a Feynman eigenvalue equation, suitably generalized to nonzero temperatures. The only external quantities entering the correlated density matrix theory elaborated here are the bare two-body interaction potential and, in actual applications, the boundary conditions to be imposed on the one-body density. 30 refs

  12. Mott-Hubbard transition and Anderson localization: A generalized dynamical mean-field theory approach

    International Nuclear Information System (INIS)

    Kuchinskii, E. Z.; Nekrasov, I. A.; Sadovskii, M. V.

    2008-01-01

    The DOS, the dynamic (optical) conductivity, and the phase diagram of a strongly correlated and strongly disordered paramagnetic Anderson-Hubbard model are analyzed within the generalized dynamical mean field theory (DMFT + Σ approximation). Strong correlations are taken into account by the DMFT, and disorder is taken into account via an appropriate generalization of the self-consistent theory of localization. The DMFT effective single-impurity problem is solved by a numerical renormalization group (NRG); we consider the three-dimensional system with a semielliptic DOS. The correlated metal, Mott insulator, and correlated Anderson insulator phases are identified via the evolution of the DOS and dynamic conductivity, demonstrating both the Mott-Hubbard and Anderson metal-insulator transition and allowing the construction of the complete zero-temperature phase diagram of the Anderson-Hubbard model. Rather unusual is the possibility of a disorder-induced Mott insulator-to-metal transition

  13. A limit for large R-charge correlators in N = 2 theories

    Science.gov (United States)

    Bourget, Antoine; Rodriguez-Gomez, Diego; Russo, Jorge G.

    2018-05-01

    Using supersymmetric localization, we study the sector of chiral primary operators (Tr ϕ 2) n with large R-charge 4 n in N = 2 four-dimensional superconformal theories in the weak coupling regime g → 0, where λ ≡ g 2 n is kept fixed as n → ∞, g representing the gauge theory coupling(s). In this limit, correlation functions G 2 n of these operators behave in a simple way, with an asymptotic behavior of the form {G}_{2n}≈ {F}_{∞}(λ){(λ/2π e)}^{2n} n α , modulo O(1 /n) corrections, with α =1/2 \\dim (g) for a gauge algebra g and a universal function F ∞(λ). As a by-product we find several new formulas both for the partition function as well as for perturbative correlators in N=2 su(N) gauge theory with 2 N fundamental hypermultiplets.

  14. Improved distorted wave theory with the localized virial conditions

    Science.gov (United States)

    Hahn, Y. K.; Zerrad, E.

    2009-12-01

    The distorted wave theory is operationally improved to treat the full collision amplitude, such that the corrections to the distorted wave Born amplitude can be systematically calculated. The localized virial conditions provide the tools necessary to test the quality of successive approximations at each stage and to optimize the solution. The details of the theoretical procedure are explained in concrete terms using a collisional ionization model and variational trial functions. For the first time, adjustable parameters associated with an approximate scattering solution can be fully determined by the theory. A small number of linear parameters are introduced to examine the convergence property and the effectiveness of the new approach.

  15. VEHICLE LOCALIZATION BY LIDAR POINT CORRELATION IMPROVED BY CHANGE DETECTION

    Directory of Open Access Journals (Sweden)

    A. Schlichting

    2016-06-01

    Full Text Available LiDAR sensors are proven sensors for accurate vehicle localization. Instead of detecting and matching features in the LiDAR data, we want to use the entire information provided by the scanners. As dynamic objects, like cars, pedestrians or even construction sites could lead to wrong localization results, we use a change detection algorithm to detect these objects in the reference data. If an object occurs in a certain number of measurements at the same position, we mark it and every containing point as static. In the next step, we merge the data of the single measurement epochs to one reference dataset, whereby we only use static points. Further, we also use a classification algorithm to detect trees. For the online localization of the vehicle, we use simulated data of a vertical aligned automotive LiDAR sensor. As we only want to use static objects in this case as well, we use a random forest classifier to detect dynamic scan points online. Since the automotive data is derived from the LiDAR Mobile Mapping System, we are able to use the labelled objects from the reference data generation step to create the training data and further to detect dynamic objects online. The localization then can be done by a point to image correlation method using only static objects. We achieved a localization standard deviation of about 5 cm (position and 0.06° (heading, and were able to successfully localize the vehicle in about 93 % of the cases along a trajectory of 13 km in Hannover, Germany.

  16. Vehicle Localization by LIDAR Point Correlation Improved by Change Detection

    Science.gov (United States)

    Schlichting, A.; Brenner, C.

    2016-06-01

    LiDAR sensors are proven sensors for accurate vehicle localization. Instead of detecting and matching features in the LiDAR data, we want to use the entire information provided by the scanners. As dynamic objects, like cars, pedestrians or even construction sites could lead to wrong localization results, we use a change detection algorithm to detect these objects in the reference data. If an object occurs in a certain number of measurements at the same position, we mark it and every containing point as static. In the next step, we merge the data of the single measurement epochs to one reference dataset, whereby we only use static points. Further, we also use a classification algorithm to detect trees. For the online localization of the vehicle, we use simulated data of a vertical aligned automotive LiDAR sensor. As we only want to use static objects in this case as well, we use a random forest classifier to detect dynamic scan points online. Since the automotive data is derived from the LiDAR Mobile Mapping System, we are able to use the labelled objects from the reference data generation step to create the training data and further to detect dynamic objects online. The localization then can be done by a point to image correlation method using only static objects. We achieved a localization standard deviation of about 5 cm (position) and 0.06° (heading), and were able to successfully localize the vehicle in about 93 % of the cases along a trajectory of 13 km in Hannover, Germany.

  17. Local Field Response Method Phenomenologically Introducing Spin Correlations

    Science.gov (United States)

    Tomaru, Tatsuya

    2018-03-01

    The local field response (LFR) method is a way of searching for the ground state in a similar manner to quantum annealing. However, the LFR method operates on a classical machine, and quantum effects are introduced through a priori information and through phenomenological means reflecting the states during the computations. The LFR method has been treated with a one-body approximation, and therefore, the effect of entanglement has not been sufficiently taken into account. In this report, spin correlations are phenomenologically introduced as one of the effects of entanglement, by which multiple tunneling at anticrossing points is taken into account. As a result, the accuracy of solutions for a 128-bit system increases by 31% compared with that without spin correlations.

  18. Correlation Dimension Estimates of Global and Local Temperature Data.

    Science.gov (United States)

    Wang, Qiang

    1995-11-01

    The author has attempted to detect the presence of low-dimensional deterministic chaos in temperature data by estimating the correlation dimension with the Hill estimate that has been recently developed by Mikosch and Wang. There is no convincing evidence of low dimensionality with either global dataset (Southern Hemisphere monthly average temperatures from 1858 to 1984) or local temperature dataset (daily minimums at Auckland, New Zealand). Any apparent reduction in the dimension estimates appears to be due large1y, if not entirely, to effects of statistical bias, but neither is it a purely random stochastic process. The dimension of the climatic attractor may be significantly larger than 10.

  19. Boson spectra and correlations for thermal locally equilibrium systems

    International Nuclear Information System (INIS)

    Sinyukov, Y.M.

    1999-01-01

    The single- and multi-particle inclusive spectra for strongly inhomogeneous thermal boson systems are studied using the method of statistical operator. The thermal Wick's theorem is generalized and the analytical solution of the problem for a boost-invariant expanding boson gas is found. The results demonstrate the effects of inhomogeneity for such a system: the spectra and correlations for particles with wavelengths larger than the system's homogeneity lengths change essentially as compared with the results based on the local Bose-Einstein thermal distributions. The effects noticeably grow for overpopulated media, where the chemical potential associated with violation of chemical equilibrium is large enough. (author)

  20. Localization for random Schroedinger operators with correlated potentials

    Energy Technology Data Exchange (ETDEWEB)

    Von Dreifus, H [Princeton Univ., NJ (USA). Dept. of Physics; Klein, A [California Univ., Irvine (USA). Dept. of Mathematics

    1991-08-01

    We prove localization at high disorder or low energy for lattice Schroedinger operators with random potentials whose values at different lattice sites are correlated over large distances. The class of admissible random potentials for our multiscale analysis includes potentials with a stationary Gaussian distribution whose covariance function C(x,y) decays as vertical strokex-yvertical stroke{sup -{theta}}, where {theta}>0 can be arbitrarily small, and potentials whose probability distribution is a completely analytical Gibbs measure. The result for Gaussian potentials depends on a multivariable form of Nelson's best possible hypercontractive estimate. (orig.).

  1. Quantumness and the role of locality on quantum correlations

    Science.gov (United States)

    Bellomo, G.; Plastino, A.; Plastino, A. R.

    2016-06-01

    Quantum correlations in a physical system are usually studied with respect to a unique and fixed decomposition of the system into subsystems, without fully exploiting the rich structure of the state space. Here, we show several examples in which the consideration of different ways to decompose a physical system enhances the quantum resources and accounts for a more flexible definition of quantumness measures. Furthermore, we give a different perspective regarding how to reassess the fact that local operations play a key role in general quantumness measures that go beyond entanglement—as discordlike ones. We propose a family of measures to quantify the maximum quantumness of a given state. For the discord-based case, we present some analytical results for 2 ×d -dimensional states. Applying our definition to low-dimensional bipartite states, we show that different behaviors can be reported for separable and entangled states vis-à-vis those corresponding to the usual measures of quantum correlations. We show that there is a close link between our proposal and the criterion to witness quantum correlations based on the rank of the correlation matrix, proposed by Dakić, Vedral, and Brukner [Phys. Rev. Lett. 105, 190502 (2010), 10.1103/PhysRevLett.105.190502].

  2. Relativistic local quantum field theory for m=0 particles

    International Nuclear Information System (INIS)

    Morales Villasevil, A.

    1965-01-01

    A method is introduced ta deal with relativistic quantum field theory for particles with m=0. Two mappings I and J, giving rise respectively to particle and anti particle states, are defined between a test space and the physical Hilbert space. The intrinsic field operator is then defined as the minimal causal linear combinations of operators belonging to the annihilation-creation algebra associated to the germ and antigerm parts of the element. Local elements are introduced as improper test elements and local field operators are constructed in the same way as the intrinsic ones. Commutation rules are given. (Author) 17 refs

  3. To the non-local theory of cold nuclear fusion.

    Science.gov (United States)

    Alexeev, Boris V

    2014-10-01

    In this paper, we revisit the cold fusion (CF) phenomenon using the generalized Bolzmann kinetics theory which can represent the non-local physics of this CF phenomenon. This approach can identify the conditions when the CF can take place as the soliton creation under the influence of the intensive sound waves. The vast mathematical modelling leads to affirmation that all parts of soliton move with the same velocity and with the small internal change of the pressure. The zone of the high density is shaped on the soliton's front. It means that the regime of the 'acoustic CF' could be realized from the position of the non-local hydrodynamics.

  4. Importance of the local constraint in slave-boson theories

    International Nuclear Information System (INIS)

    Zhang, L.; Jain, J.K.; Emery, V.J.

    1993-01-01

    Slave bosons are commonly introduced in order to implement an infinite Hubbard U by means of a local constraint. The usual starting point for investigations within this scheme is a mean-field theory in which the constraint is taken to be global. This approximate treatment of the constraint is studied in the context of a two-band Hubbard model, and it is shown that (i) the ground state has a significant number of doubly occupied sites, despite the infinite on-site repulsion in the original model, and (ii) there is an unphysical tendency for pairing. However, it is found that if the local constraint is retained for the insulator at half filling, then mean-field theory gives the correct result that the double occupancy is zero

  5. Theory of many-body localization in periodically driven systems

    International Nuclear Information System (INIS)

    Abanin, Dmitry A.; De Roeck, Wojciech; Huveneers, François

    2016-01-01

    We present a theory of periodically driven, many-body localized (MBL) systems. We argue that MBL persists under periodic driving at high enough driving frequency: The Floquet operator (evolution operator over one driving period) can be represented as an exponential of an effective time-independent Hamiltonian, which is a sum of quasi-local terms and is itself fully MBL. We derive this result by constructing a sequence of canonical transformations to remove the time-dependence from the original Hamiltonian. When the driving evolves smoothly in time, the theory can be sharpened by estimating the probability of adiabatic Landau–Zener transitions at many-body level crossings. In all cases, we argue that there is delocalization at sufficiently low frequency. We propose a phase diagram of driven MBL systems.

  6. A realistic model for quantum theory with a locality property

    International Nuclear Information System (INIS)

    Eberhard, P.H.

    1987-04-01

    A model reproducing the predictions of relativistic quantum theory to any desired degree of accuracy is described in this paper. It involves quantities that are independent of the observer's knowledge, and therefore can be called real, and which are defined at each point in space, and therefore can be called local in a rudimentary sense. It involves faster-than-light, but not instantaneous, action at distance

  7. A course on quantum field theory and local observables

    International Nuclear Information System (INIS)

    Schroer, Bert

    1997-03-01

    A monograph on Quantum Field Theory and Local Observables is presented, aiming to unify two presently largely disconnected branches of QFT, as follows: the standard (canonical, functional) approach which is mainly perturbative in the sense of an infinitesimal 'deformation' of free fields; nonperturbative constructions of low-dimensional models as the form factor-bootstrap approach (which for the time being is limited to factorable models in d=1+1 spacetime dimensions) and the non-Lagrangian constructions of conformal chiral QFT's

  8. Can Single-Reference Coupled Cluster Theory Describe Static Correlation?

    Science.gov (United States)

    Bulik, Ireneusz W; Henderson, Thomas M; Scuseria, Gustavo E

    2015-07-14

    While restricted single-reference coupled cluster theory truncated to singles and doubles (CCSD) provides very accurate results for weakly correlated systems, it usually fails in the presence of static or strong correlation. This failure is generally attributed to the qualitative breakdown of the reference, and can accordingly be corrected by using a multideterminant reference, including higher-body cluster operators in the ansatz, or allowing symmetry breaking in the reference. None of these solutions are ideal; multireference coupled cluster is not black box, including higher-body cluster operators is computationally demanding, and allowing symmetry breaking leads to the loss of good quantum numbers. It has long been recognized that quasidegeneracies can instead be treated by modifying the coupled cluster ansatz. The recently introduced pair coupled cluster doubles (pCCD) approach is one such example which avoids catastrophic failures and accurately models strong correlations in a symmetry-adapted framework. Here, we generalize pCCD to a singlet-paired coupled cluster model (CCD0) intermediate between coupled cluster doubles and pCCD, yielding a method that possesses the invariances of the former and much of the stability of the latter. Moreover, CCD0 retains the full structure of coupled cluster theory, including a fermionic wave function, antisymmetric cluster amplitudes, and well-defined response equations and density matrices.

  9. Non local theory of excitations applied to the Hubbard model

    International Nuclear Information System (INIS)

    Kakehashi, Y; Nakamura, T; Fulde, P

    2010-01-01

    We propose a nonlocal theory of single-particle excitations. It is based on an off-diagonal effective medium and the projection operator method for treating the retarded Green function. The theory determines the nonlocal effective medium matrix elements by requiring that they are consistent with those of the self-energy of the Green function. This arrows for a description of long-range intersite correlations with high resolution in momentum space. Numerical study for the half-filled Hubbard model on the simple cubic lattice demonstrates that the theory is applicable to the strong correlation regime as well as the intermediate regime of Coulomb interaction strength. Furthermore the results show that nonlocal excitations cause sub-bands in the strong Coulomb interaction regime due to strong antiferromagnetic correlations, decrease the quasi-particle peak on the Fermi level with increasing Coulomb interaction, and shift the critical Coulomb interaction U C2 for the divergence of effective mass towards higher energies at least by a factor of two as compared with that in the single-site approximation.

  10. Quantum field theory with infinite component local fields as an alternative to the string theories

    Science.gov (United States)

    Krasnikov, N. V.

    1987-09-01

    We show that the introduction of the infinite component local fields with higher-order derivatives in the interaction makes the theory completely ultraviolet finite. For the γ5-anomalous theories the introduction of the infinite component field makes the theory renormalizable or even superrenormalizable. I am indebted to J. Ambjōrn, P. Di Vecchia, H.B. Nielsen and L. Rozhansky for useful discussions. It is a pleasure to thank the Niels Bohr Institute (Copenhagen) where this work was completed for kind hospitality.

  11. Local electric dipole moments for periodic systems via density functional theory embedding.

    Science.gov (United States)

    Luber, Sandra

    2014-12-21

    We describe a novel approach for the calculation of local electric dipole moments for periodic systems. Since the position operator is ill-defined in periodic systems, maximally localized Wannier functions based on the Berry-phase approach are usually employed for the evaluation of local contributions to the total electric dipole moment of the system. We propose an alternative approach: within a subsystem-density functional theory based embedding scheme, subset electric dipole moments are derived without any additional localization procedure, both for hybrid and non-hybrid exchange-correlation functionals. This opens the way to a computationally efficient evaluation of local electric dipole moments in (molecular) periodic systems as well as their rigorous splitting into atomic electric dipole moments. As examples, Infrared spectra of liquid ethylene carbonate and dimethyl carbonate are presented, which are commonly employed as solvents in Lithium ion batteries.

  12. Local electric dipole moments for periodic systems via density functional theory embedding

    Energy Technology Data Exchange (ETDEWEB)

    Luber, Sandra, E-mail: sandra.luber@chem.uzh.ch [Institut für Chemie, Universität Zürich, Winterthurerstrasse 190, 8057 Zürich (Switzerland)

    2014-12-21

    We describe a novel approach for the calculation of local electric dipole moments for periodic systems. Since the position operator is ill-defined in periodic systems, maximally localized Wannier functions based on the Berry-phase approach are usually employed for the evaluation of local contributions to the total electric dipole moment of the system. We propose an alternative approach: within a subsystem-density functional theory based embedding scheme, subset electric dipole moments are derived without any additional localization procedure, both for hybrid and non-hybrid exchange–correlation functionals. This opens the way to a computationally efficient evaluation of local electric dipole moments in (molecular) periodic systems as well as their rigorous splitting into atomic electric dipole moments. As examples, Infrared spectra of liquid ethylene carbonate and dimethyl carbonate are presented, which are commonly employed as solvents in Lithium ion batteries.

  13. Batalin-Vilkovisky formalism in locally covariant field theory

    International Nuclear Information System (INIS)

    Rejzner, Katarzyna Anna

    2011-12-01

    The present work contains a complete formulation of the Batalin-Vilkovisky (BV) formalism in the framework of locally covariant field theory. In the first part of the thesis the classical theory is investigated with a particular focus on the infinite dimensional character of the underlying structures. It is shown that the use of infinite dimensional differential geometry allows for a conceptually clear and elegant formulation. The construction of the BV complex is performed in a fully covariant way and we also generalize the BV framework to a more abstract level, using functors and natural transformations. In this setting we construct the BV complex for classical gravity. This allows us to give a homological interpretation to the notion of diffeomorphism invariant physical quantities in general relativity. The second part of the thesis concerns the quantum theory. We provide a framework for the BV quantization that doesn't rely on the path integral formalism, but is completely formulated within perturbative algebraic quantum field theory. To make such a formulation possible we first prove that the renormalized time-ordered product can be understood as a binary operation on a suitable domain. Using this result we prove the associativity of this product and provide a consistent framework for the renormalized BV structures. In particular the renormalized quantum master equation and the renormalized quantum BV operator are defined. To give a precise meaning to theses objects we make a use of the master Ward identity, which is an important structure in causal perturbation theory. (orig.)

  14. Batalin-Vilkovisky formalism in locally covariant field theory

    Energy Technology Data Exchange (ETDEWEB)

    Rejzner, Katarzyna Anna

    2011-12-15

    The present work contains a complete formulation of the Batalin-Vilkovisky (BV) formalism in the framework of locally covariant field theory. In the first part of the thesis the classical theory is investigated with a particular focus on the infinite dimensional character of the underlying structures. It is shown that the use of infinite dimensional differential geometry allows for a conceptually clear and elegant formulation. The construction of the BV complex is performed in a fully covariant way and we also generalize the BV framework to a more abstract level, using functors and natural transformations. In this setting we construct the BV complex for classical gravity. This allows us to give a homological interpretation to the notion of diffeomorphism invariant physical quantities in general relativity. The second part of the thesis concerns the quantum theory. We provide a framework for the BV quantization that doesn't rely on the path integral formalism, but is completely formulated within perturbative algebraic quantum field theory. To make such a formulation possible we first prove that the renormalized time-ordered product can be understood as a binary operation on a suitable domain. Using this result we prove the associativity of this product and provide a consistent framework for the renormalized BV structures. In particular the renormalized quantum master equation and the renormalized quantum BV operator are defined. To give a precise meaning to theses objects we make a use of the master Ward identity, which is an important structure in causal perturbation theory. (orig.)

  15. General theory of intensity correlation on light scattering

    International Nuclear Information System (INIS)

    Villaeys, A.A.

    1978-01-01

    A general theory for spatio-temporal intensity correlations measurements for a scattered beam is developed. A completely quantum mechanical description for both excitation and detection set up is used. This description is essentially valid for weak incident light beams and single photon absorption processes. From a unified point of view both, stationary as well as, time resolved experiments are described. The interest for such experiments in the study of processes like resonance raman scattering and resonance fluorescence is emphasized. Also an observable coherent contribution associated to different final levels of the target-atoms or molecules is obtained a result which cannot be reached by intensity measurements

  16. Relativistic mean field theory for deformed nuclei with pairing correlations

    International Nuclear Information System (INIS)

    Geng, Lisheng; Toki, Hiroshi; Sugimoto, Satoru; Meng, Jie

    2003-01-01

    We develop a relativistic mean field (RMF) description of deformed nuclei with pairing correlations in the BCS approximation. The treatment of the pairing correlations for nuclei whose Fermi surfaces are close to the threshold of unbound states needs special attention. With this in mind, we use a delta function interaction for the pairing interaction to pick up those states whose wave functions are concentrated in the nuclear region and employ the standard BCS approximation for the single-particle states obtained from the BMF theory with deformation. We apply the RMF + BCS method to the Zr isotopes and obtain a good description of the binding energies and the nuclear radii of nuclei from the proton drip line to the neutron drip line. (author)

  17. Correlation dimension and phase space contraction via extreme value theory

    Science.gov (United States)

    Faranda, Davide; Vaienti, Sandro

    2018-04-01

    We show how to obtain theoretical and numerical estimates of correlation dimension and phase space contraction by using the extreme value theory. The maxima of suitable observables sampled along the trajectory of a chaotic dynamical system converge asymptotically to classical extreme value laws where: (i) the inverse of the scale parameter gives the correlation dimension and (ii) the extremal index is associated with the rate of phase space contraction for backward iteration, which in dimension 1 and 2, is closely related to the positive Lyapunov exponent and in higher dimensions is related to the metric entropy. We call it the Dynamical Extremal Index. Numerical estimates are straightforward to obtain as they imply just a simple fit to a univariate distribution. Numerical tests range from low dimensional maps, to generalized Henon maps and climate data. The estimates of the indicators are particularly robust even with relatively short time series.

  18. Conductance of finite systems and scaling in localization theory

    Science.gov (United States)

    Suslov, I. M.

    2012-11-01

    The conductance of finite systems plays a central role in the scaling theory of localization (Abrahams et al., Phys. Rev. Lett. 42, 673 (1979)). Usually it is defined by the Landauer-type formulas, which remain open the following questions: (a) exclusion of the contact resistance in the many-channel case; (b) correspondence of the Landauer conductance with internal properties of the system; (c) relation with the diffusion coefficient D(ω, q) of an infinite system. The answers to these questions are obtained below in the framework of two approaches: (1) self-consistent theory of localization by Vollhardt and Wölfle, and (2) quantum mechanical analysis based on the shell model. Both approaches lead to the same definition for the conductance of a finite system, closely related to the Thouless definition. In the framework of the self-consistent theory, the relations of finite-size scaling are derived and the Gell-Mann-Low functions β( g) for space dimensions d = 1, 2, 3 are calculated. In contrast to the previous attempt by Vollhardt and Wölfle (1982), the metallic and localized phase are considered from the same standpoint, and the conductance of a finite system has no singularity at the critical point. In the 2D case, the expansion of β( g) in 1/ g coincides with results of the σ-model approach on the two-loop level and depends on the renormalization scheme in higher loops; the use of dimensional regularization for transition to dimension d = 2 + ɛ looks incompatible with the physical essence of the problem. The results are compared with numerical and physical experiments. A situation in higher dimensions and the conditions for observation of the localization law σ(ω) ∝ - iω for conductivity are discussed.

  19. Conductance of finite systems and scaling in localization theory

    International Nuclear Information System (INIS)

    Suslov, I. M.

    2012-01-01

    The conductance of finite systems plays a central role in the scaling theory of localization (Abrahams et al., Phys. Rev. Lett. 42, 673 (1979)). Usually it is defined by the Landauer-type formulas, which remain open the following questions: (a) exclusion of the contact resistance in the many-channel case; (b) correspondence of the Landauer conductance with internal properties of the system; (c) relation with the diffusion coefficient D(ω, q) of an infinite system. The answers to these questions are obtained below in the framework of two approaches: (1) self-consistent theory of localization by Vollhardt and Wölfle, and (2) quantum mechanical analysis based on the shell model. Both approaches lead to the same definition for the conductance of a finite system, closely related to the Thouless definition. In the framework of the self-consistent theory, the relations of finite-size scaling are derived and the Gell-Mann-Low functions β(g) for space dimensions d = 1, 2, 3 are calculated. In contrast to the previous attempt by Vollhardt and Wölfle (1982), the metallic and localized phase are considered from the same standpoint, and the conductance of a finite system has no singularity at the critical point. In the 2D case, the expansion of β(g) in 1/g coincides with results of the σ-model approach on the two-loop level and depends on the renormalization scheme in higher loops; the use of dimensional regularization for transition to dimension d = 2 + ε looks incompatible with the physical essence of the problem. The results are compared with numerical and physical experiments. A situation in higher dimensions and the conditions for observation of the localization law σ(ω) ∝ −iω for conductivity are discussed.

  20. Cardy formula for 4d SUSY theories and localization

    Energy Technology Data Exchange (ETDEWEB)

    Pietro, Lorenzo Di [Perimeter Institute for Theoretical Physics,Caroline Street N 31, Waterloo (Canada); Department of Particle Physics and Astrophysics, Weizmann Institute of Science,Herzl street 234, Rehovot (Israel); Honda, Masazumi [Department of Particle Physics and Astrophysics, Weizmann Institute of Science,Herzl street 234, Rehovot (Israel)

    2017-04-11

    We study 4d N=1 supersymmetric theories on a compact Euclidean manifold of the form S{sup 1}×M{sub 3}. Partition functions of gauge theories on this background can be computed using localization, and explicit formulas have been derived for different choices of the compact manifold M{sub 3}. Taking the limit of shrinking S{sup 1}, we present a general formula for the limit of the localization integrand, derived by simple effective theory considerations, generalizing the result of https://www.doi.org/10.1007/JHEP07(2016)025. The limit is given in terms of an effective potential for the holonomies around the S{sup 1}, whose minima determine the asymptotic behavior of the partition function. If the potential is minimized in the origin, where it vanishes, the partition function has a Cardy-like behavior fixed by Tr(R), while a nontrivial minimum gives a shift in the coefficient. In all the examples that we consider, the origin is a minimum if Tr(R)≤0.

  1. Quasigroup of local-symmetry transformations in constrained theories

    International Nuclear Information System (INIS)

    Chitaya, N.P.; Gogilidze, S.A.; Surovtsev, Yu.S.

    1996-01-01

    In the framework of the generalized Hamiltonian formalism by Dirac, the local symmetries of dynamical systems with first- and second-class constraints are investigated in the general case without restrictions on the algebra of constraints. The method of constructing the generator of local-symmetry transformations is obtained from the requirement for them to map the solutions of the Hamiltonian equations of motion into the solutions of the same equations. It is proved that second-class constraints do not contribute to the transformation law of the local symmetry entirely stipulated by all the first-class constraints (only by them) of an equivalent set passing to which from the initial constraint set is always possible and is presented. A mechanism of occurrence of higher derivatives of coordinates and group parameters in the symmetry transformation law in the Noether second theorem is elucidated. In the latter case it is shown that the obtained transformations of symmetry are canonical in the extended (by Ostrogradsky) phase space. It is thereby shown in the general case that the degeneracy of theories with the first- and second-class constraints is due to their invariance under local-symmetry transformations. It is also shown in the general case that the action functional and the corresponding Hamiltonian equations of motion are invariant under the same quasigroup of local-symmetry transformations. 29 refs

  2. Bell Operator Method to Classify Local Realistic Theories

    International Nuclear Information System (INIS)

    Nagata, Koji

    2010-01-01

    We review the historical fact of multipartite Bell inequalities with an arbitrary number of settings. An explicit local realistic model for the values of a correlation function, given in a two-setting Bell experiment (two-setting model), works only for the specific set of settings in the given experiment, but cannot construct a local realistic model for the values of a correlation function, given in a continuous-infinite settings Bell experiment (infinite-setting model), even though there exist two-setting models for all directions in space. Hence, the two-setting model does not have the property that the infinite-setting model has. Here, we show that an explicit two-setting model cannot construct a local realistic model for the values of a correlation function, given in an M-setting Bell experiment (M-setting model), even though there exist two-setting models for the M measurement directions chosen in the given M-setting experiment. Hence, the two-setting model does not have the property that the M-setting model has. (general)

  3. Source-Free Exchange-Correlation Magnetic Fields in Density Functional Theory.

    Science.gov (United States)

    Sharma, S; Gross, E K U; Sanna, A; Dewhurst, J K

    2018-03-13

    Spin-dependent exchange-correlation energy functionals in use today depend on the charge density and the magnetization density: E xc [ρ, m]. However, it is also correct to define the functional in terms of the curl of m for physical external fields: E xc [ρ,∇ × m]. The exchange-correlation magnetic field, B xc , then becomes source-free. We study this variation of the theory by uniquely removing the source term from local and generalized gradient approximations to the functional. By doing so, the total Kohn-Sham moments are improved for a wide range of materials for both functionals. Significantly, the moments for the pnictides are now in good agreement with experiment. This source-free method is simple to implement in all existing density functional theory codes.

  4. One-Body Potential Theory of Molecules and Solids Modified Semiempirically for Electron Correlation

    International Nuclear Information System (INIS)

    March, N.H.

    2010-08-01

    The study of Cordero, March and Alonso (CMA) for four spherical atoms, Be,Ne,Mg and Ar, semiempirically fine-tunes the Hartree-Fock (HF) ground-state electron density by inserting the experimentally determined ionization potentials. The present Letter, first of all, relates this approach to the very recent work of Bartlett 'towards an exact correlated orbital theory for electrons'. Both methods relax the requirement of standard DFT that a one-body potential shall generate the exact ground-state density, though both work with high quality approximations. Unlike DFT, the CMA theory uses a modified HF non-local potential. It is finally stressed that this potential generates also an idempotent Dirac density matrix. The CMA approach is thereby demonstrated to relate, albeit approximately, to the DFT exchange-correlation potential. (author)

  5. Local gauge coupling running in supersymmetric gauge theories on orbifolds

    International Nuclear Information System (INIS)

    Hillenbach, M.

    2007-01-01

    By extending Feynman's path integral calculus to fields which respect orbifold boundary conditions we provide a straightforward and convenient framework for loop calculations on orbifolds. We take advantage of this general method to investigate supersymmetric Abelian and non-Abelian gauge theories in five, six and ten dimensions where the extra dimensions are compactified on an orbifold. We consider hyper and gauge multiplets in the bulk and calculate the renormalization of the gauge kinetic term which in particular allows us to determine the gauge coupling running. The renormalization of the higher dimensional theories in orbifold spacetimes exhibits a rich structure with three principal effects: Besides the ordinary renormalization of the bulk gauge kinetic term the loop effects may require the introduction of both localized gauge kinetic terms at the fixed points/planes of the orbifold and higher dimensional operators. (orig.)

  6. Local gauge coupling running in supersymmetric gauge theories on orbifolds

    Energy Technology Data Exchange (ETDEWEB)

    Hillenbach, M.

    2007-11-21

    By extending Feynman's path integral calculus to fields which respect orbifold boundary conditions we provide a straightforward and convenient framework for loop calculations on orbifolds. We take advantage of this general method to investigate supersymmetric Abelian and non-Abelian gauge theories in five, six and ten dimensions where the extra dimensions are compactified on an orbifold. We consider hyper and gauge multiplets in the bulk and calculate the renormalization of the gauge kinetic term which in particular allows us to determine the gauge coupling running. The renormalization of the higher dimensional theories in orbifold spacetimes exhibits a rich structure with three principal effects: Besides the ordinary renormalization of the bulk gauge kinetic term the loop effects may require the introduction of both localized gauge kinetic terms at the fixed points/planes of the orbifold and higher dimensional operators. (orig.)

  7. Local Volume Hi Survey: the far-infrared radio correlation

    Science.gov (United States)

    Shao, Li; Koribalski, Bärbel S.; Wang, Jing; Ho, Luis C.; Staveley-Smith, Lister

    2018-06-01

    In this paper we measure the far-infrared (FIR) and radio flux densities of a sample of 82 local gas-rich galaxies, including 70 "dwarf" galaxies (M* correlation (FRC) over four orders of magnitude (F_1.4GHz ∝ F_FIR^{1.00± 0.08}). However, for detected galaxies only, a trend of larger FIR-to-radio ratio with decreasing flux density is observed. We estimate the star formation rate by combining UV and mid-IR data using empirical calibration. It is confirmed that both FIR and radio emission are strongly connected with star formation but with significant non-linearity. Dwarf galaxies are found radiation deficient in both bands, when normalized by star formation rate. It urges a "conspiracy" to keep the FIR-to-radio ratio generally constant. By using partial correlation coefficient in Pearson definition, we identify the key galaxy properties associated with the FIR and radio deficiency. Some major factors, such as stellar mass surface density, will cancel out when taking the ratio between FIR and radio fluxes. The remaining factors, such as HI-to-stellar mass ratio and galaxy size, are expected to cancel each other due to the distribution of galaxies in the parameter space. Such cancellation is probably responsible for the "conspiracy" to keep the FRC alive.

  8. Loss of locality in gravitational correlators with a large number of insertions

    Science.gov (United States)

    Ghosh, Sudip; Raju, Suvrat

    2017-09-01

    We review lessons from the AdS/CFT correspondence that indicate that the emergence of locality in quantum gravity is contingent upon considering observables with a small number of insertions. Correlation functions, where the number of insertions scales with a power of the central charge of the CFT, are sensitive to nonlocal effects in the bulk theory, which arise from a combination of the effects of the bulk Gauss law and a breakdown of perturbation theory. To examine whether a similar effect occurs in flat space, we consider the scattering of massless particles in the bosonic string and the superstring in the limit, where the number of external particles, n, becomes very large. We use estimates of the volume of the Weil-Petersson moduli space of punctured Riemann surfaces to argue that string amplitudes grow factorially in this limit. We verify this factorial behavior through an extensive numerical analysis of string amplitudes at large n. Our numerical calculations rely on the observation that, in the large n limit, the string scattering amplitude localizes on the Gross-Mende saddle points, even though individual particle energies are small. This factorial growth implies the breakdown of string perturbation theory for n ˜(M/plE ) d -2 in d dimensions, where E is the typical individual particle energy. We explore the implications of this breakdown for the black hole information paradox. We show that the loss of locality suggested by this breakdown is precisely sufficient to resolve the cloning and strong subadditivity paradoxes.

  9. Quantum objects non-local correlation, causality and objective indefiniteness in the quantum world

    CERN Document Server

    Jaeger, Gregg

    2013-01-01

    This monograph identifies the essential characteristics of the objects described by current quantum theory and considers their relationship to space-time. In the process, it explicates the senses in which quantum objects may be consistently considered to have parts of which they may be composed or into which they may be decomposed. The book also demonstrates the degree to which reduction is possible in quantum mechanics, showing it to be related to the objective indefiniteness of quantum properties and the strong non-local correlations that can occur between the physical quantities of quantum

  10. Correlation functional in screened-exchange density functional theory procedures.

    Science.gov (United States)

    Chan, Bun; Kawashima, Yukio; Hirao, Kimihiko

    2017-10-15

    In the present study, we have explored several prospects for the further development of screened-exchange density functional theory (SX-DFT) procedures. Using the performance of HSE06 as our measure, we find that the use of alternative correlation functionals (as oppose to PBEc in HSE06) also yields adequate results for a diverse set of thermochemical properties. We have further examined the performance of new SX-DFT procedures (termed HSEB-type methods) that comprise the HSEx exchange and a (near-optimal) reparametrized B97c (c OS,0  = c SS,0  = 1, c OS,1  = -1.5, c OS,2  = -0.644, c SS,1  = -0.5, and c SS,2  = 1.10) correlation functionals. The different variants of HSEB all perform comparably to or slightly better than the original HSE-type procedures. These results, together with our fundamental analysis of correlation functionals, point toward various directions for advancing SX-DFT methods. © 2017 Wiley Periodicals, Inc. © 2017 Wiley Periodicals, Inc.

  11. Towards a large deviation theory for strongly correlated systems

    International Nuclear Information System (INIS)

    Ruiz, Guiomar; Tsallis, Constantino

    2012-01-01

    A large-deviation connection of statistical mechanics is provided by N independent binary variables, the (N→∞) limit yielding Gaussian distributions. The probability of n≠N/2 out of N throws is governed by e −Nr , r related to the entropy. Large deviations for a strong correlated model characterized by indices (Q,γ) are studied, the (N→∞) limit yielding Q-Gaussians (Q→1 recovers a Gaussian). Its large deviations are governed by e q −Nr q (∝1/N 1/(q−1) , q>1), q=(Q−1)/(γ[3−Q])+1. This illustration opens the door towards a large-deviation foundation of nonextensive statistical mechanics. -- Highlights: ► We introduce the formalism of relative entropy for a single random binary variable and its q-generalization. ► We study a model of N strongly correlated binary random variables and their large-deviation probabilities. ► Large-deviation probability of strongly correlated model exhibits a q-exponential decay whose argument is proportional to N, as extensivity requires. ► Our results point to a q-generalized large deviation theory and suggest a large-deviation foundation of nonextensive statistical mechanics.

  12. Local gauge invariant Lagrangeans in classical field theories

    International Nuclear Information System (INIS)

    Grigore, D.R.

    1982-07-01

    We investigate the most general local gauge invariant Lagrangean in the framework of classical field theory. We rederive esentially Utiyama's result with a slight generalization. Our proof makes clear the importance of the so called current conditions, i.e. the requirement that the Noether currents are different from zero. This condition is of importance both in the general motivation for the introduction of the Yang-Mills fields and for the actual proof. Some comments are made about the basic mathematical structure of the problem - the gauge group. (author)

  13. A course on quantum field theory and local observables

    Energy Technology Data Exchange (ETDEWEB)

    Schroer, Bert [Frankfurt Univ., Berlin (Germany). Inst. fuer Theoretische Physik

    1997-03-01

    A monograph on Quantum Field Theory and Local Observables is presented, aiming to unify two presently largely disconnected branches of QFT, as follows: the standard (canonical, functional) approach which is mainly perturbative in the sense of an infinitesimal `deformation` of free fields; nonperturbative constructions of low-dimensional models as the form factor-bootstrap approach (which for the time being is limited to factorable models in d=1+1 spacetime dimensions) and the non-Lagrangian constructions of conformal chiral QFT`s

  14. Small-angle scattering theory revisited: Photocurrent and spatial localization

    DEFF Research Database (Denmark)

    Basse, N.P.; Zoletnik, S.; Michelsen, Poul

    2005-01-01

    In this paper theory on collective scattering measurements of electron density fluctuations in fusion plasmas is revisited. We present the first full derivation of the expression for the photocurrent beginning at the basic scattering concepts. Thereafter we derive detailed expressions for the auto......- and crosspower spectra obtained from measurements. These are discussed and simple simulations made to elucidate the physical meaning of the findings. In this context, the known methods of obtaining spatial localization are discussed and appraised. Where actual numbers are applied, we utilize quantities from two...

  15. Localization of effective actions in open superstring field theory

    Science.gov (United States)

    Maccaferri, Carlo; Merlano, Alberto

    2018-03-01

    We consider the construction of the algebraic part of D-branes tree-level effective action from Berkovits open superstring field theory. Applying this construction to the quartic potential of massless fields carrying a specific worldsheet charge, we show that the full contribution to the potential localizes at the boundary of moduli space, reducing to elementary two-point functions. As examples of this general mechanism, we show how the Yang-Mills quartic potential and the instanton effective action of a Dp/D( p - 4) system are reproduced.

  16. Reality, measurement and locality in Quantum Field Theory

    International Nuclear Information System (INIS)

    Tommasini, Daniele

    2002-01-01

    It is currently believed that the local causality of Quantum Field Theory (QFT) is destroyed by the measurement process. This belief is also based on the Einstein-Podolsky-Rosen (EPR) paradox and on the so-called Bell's theorem, that are thought to prove the existence of a mysterious, instantaneous action between distant measurements. However, I have shown recently that the EPR argument is removed, in an interpretation-independent way, by taking into account the fact that the Standard Model of Particle Physics prevents the production of entangled states with a definite number of particles. This result is used here to argue in favor of a statistical interpretation of QFT and to show that it allows for a full reconciliation with locality and causality. Within such an interpretation, as Ballentine and Jarret pointed out long ago, Bell's theorem does not demonstrate any nonlocality. (author)

  17. Local models of Gauge Mediated Supersymmetry Breaking in String Theory

    CERN Document Server

    Garcia-Etxebarria, I; Uranga, Angel M; Garcia-Etxebarria, Inaki; Saad, Fouad; Uranga, Angel M.

    2006-01-01

    We describe local Calabi-Yau geometries with two isolated singularities at which systems of D3- and D7-branes are located, leading to chiral sectors corresponding to a semi-realistic visible sector and a hidden sector with dynamical supersymmetry breaking. We provide explicit models with a 3-family MSSM-like visible sector, and a hidden sector breaking supersymmetry at a meta-stable minimum. For singularities separated by a distance smaller than the string scale, this construction leads to a simple realization of gauge mediated supersymmetry breaking in string theory. The models are simple enough to allow the explicit computation of the massive messenger sector, using dimer techniques for branes at singularities. The local character of the configurations makes manifest the UV insensitivity of the supersymmetry breaking mediation.

  18. Structural predictions for Correlated Electron Materials Using the Functional Dynamical Mean Field Theory Approach

    Science.gov (United States)

    Haule, Kristjan

    2018-04-01

    The Dynamical Mean Field Theory (DMFT) in combination with the band structure methods has been able to address reach physics of correlated materials, such as the fluctuating local moments, spin and orbital fluctuations, atomic multiplet physics and band formation on equal footing. Recently it is getting increasingly recognized that more predictive ab-initio theory of correlated systems needs to also address the feedback effect of the correlated electronic structure on the ionic positions, as the metal-insulator transition is almost always accompanied with considerable structural distortions. We will review recently developed extension of merger between the Density Functional Theory (DFT) and DMFT method, dubbed DFT+ embedded DMFT (DFT+eDMFT), whichsuccessfully addresses this challenge. It is based on the stationary Luttinger-Ward functional to minimize the numerical error, it subtracts the exact double-counting of DFT and DMFT, and implements self-consistent forces on all atoms in the unit cell. In a few examples, we will also show how the method elucidated the important feedback effect of correlations on crystal structure in rare earth nickelates to explain the mechanism of the metal-insulator transition. The method showed that such feedback effect is also essential to understand the dynamic stability of the high-temperature body-centered cubic phase of elemental iron, and in particular it predicted strong enhancement of the electron-phonon coupling over DFT values in FeSe, which was very recently verified by pioneering time-domain experiment.

  19. Quasi-particle energy spectra in local reduced density matrix functional theory.

    Science.gov (United States)

    Lathiotakis, Nektarios N; Helbig, Nicole; Rubio, Angel; Gidopoulos, Nikitas I

    2014-10-28

    Recently, we introduced [N. N. Lathiotakis, N. Helbig, A. Rubio, and N. I. Gidopoulos, Phys. Rev. A 90, 032511 (2014)] local reduced density matrix functional theory (local RDMFT), a theoretical scheme capable of incorporating static correlation effects in Kohn-Sham equations. Here, we apply local RDMFT to molecular systems of relatively large size, as a demonstration of its computational efficiency and its accuracy in predicting single-electron properties from the eigenvalue spectrum of the single-particle Hamiltonian with a local effective potential. We present encouraging results on the photoelectron spectrum of molecular systems and the relative stability of C20 isotopes. In addition, we propose a modelling of the fractional occupancies as functions of the orbital energies that further improves the efficiency of the method useful in applications to large systems and solids.

  20. Non-empirical exchange-correlation parameterizations based on exact conditions from correlated orbital theory.

    Science.gov (United States)

    Haiduke, Roberto Luiz A; Bartlett, Rodney J

    2018-05-14

    Some of the exact conditions provided by the correlated orbital theory are employed to propose new non-empirical parameterizations for exchange-correlation functionals from Density Functional Theory (DFT). This reparameterization process is based on range-separated functionals with 100% exact exchange for long-range interelectronic interactions. The functionals developed here, CAM-QTP-02 and LC-QTP, show mitigated self-interaction error, correctly predict vertical ionization potentials as the negative of eigenvalues for occupied orbitals, and provide nice excitation energies, even for challenging charge-transfer excited states. Moreover, some improvements are observed for reaction barrier heights with respect to the other functionals belonging to the quantum theory project (QTP) family. Finally, the most important achievement of these new functionals is an excellent description of vertical electron affinities (EAs) of atoms and molecules as the negative of appropriate virtual orbital eigenvalues. In this case, the mean absolute deviations for EAs in molecules are smaller than 0.10 eV, showing that physical interpretation can indeed be ascribed to some unoccupied orbitals from DFT.

  1. Non-empirical exchange-correlation parameterizations based on exact conditions from correlated orbital theory

    Science.gov (United States)

    Haiduke, Roberto Luiz A.; Bartlett, Rodney J.

    2018-05-01

    Some of the exact conditions provided by the correlated orbital theory are employed to propose new non-empirical parameterizations for exchange-correlation functionals from Density Functional Theory (DFT). This reparameterization process is based on range-separated functionals with 100% exact exchange for long-range interelectronic interactions. The functionals developed here, CAM-QTP-02 and LC-QTP, show mitigated self-interaction error, correctly predict vertical ionization potentials as the negative of eigenvalues for occupied orbitals, and provide nice excitation energies, even for challenging charge-transfer excited states. Moreover, some improvements are observed for reaction barrier heights with respect to the other functionals belonging to the quantum theory project (QTP) family. Finally, the most important achievement of these new functionals is an excellent description of vertical electron affinities (EAs) of atoms and molecules as the negative of appropriate virtual orbital eigenvalues. In this case, the mean absolute deviations for EAs in molecules are smaller than 0.10 eV, showing that physical interpretation can indeed be ascribed to some unoccupied orbitals from DFT.

  2. Spin-density correlations in the dynamic spin-fluctuation theory: Comparison with polarized neutron scattering experiments

    Energy Technology Data Exchange (ETDEWEB)

    Melnikov, N.B., E-mail: melnikov@cs.msu.su [Lomonosov Moscow State University, Moscow 119991 (Russian Federation); Reser, B.I., E-mail: reser@imp.uran.ru [Miheev Institute of Metal Physics, Ural Branch of Russian Academy of Sciences, Ekaterinburg 620990 (Russian Federation); Paradezhenko, G.V., E-mail: gparadezhenko@cs.msu.su [Lomonosov Moscow State University, Moscow 119991 (Russian Federation)

    2016-08-01

    To study the spin-density correlations in the ferromagnetic metals above the Curie temperature, we relate the spin correlator and neutron scattering cross-section. In the dynamic spin-fluctuation theory, we obtain explicit expressions for the effective and local magnetic moments and spatial spin-density correlator. Our theoretical results are demonstrated by the example of bcc Fe. The effective and local moments are found in good agreement with results of polarized neutron scattering experiment over a wide temperature range. The calculated short-range order is small (up to 4 Å) and slowly decreases with temperature.

  3. Geometrical and topological formulation of local gauge and supergauge theories

    International Nuclear Information System (INIS)

    Macrae, K.I.

    1976-01-01

    A geometrical and topological formulation of local gauge and supergauge invariance is presented. Analysis of experiments of the type described by Bohm and Aharanov and in the attempt to understand immersed submanifolds such as the string with internal symmetry, in a geometric setting, are led to the introduction of fiber bundles, superspaces. Many exact classical solutions to the equations of motion were considered for these gauge theories with specific choices of gauge group such as SU 4 . We describe some exact soliton solutions to these theories which have linear Regge trajectories, i.e., their angular momentum is a linear function of their mass squared. Next one discusses the actions and equations of motion for gauge theories whose base manifolds can have arbitrarily dimensioned submanifolds excised from them, manifolds with holes were discussed. These holes can have fractional quark charges when the structure group is, for example, SU 3 or SU 4 . By extending the concept of conservation of energy to include the excised submanifolds, their actions, and their equations of motion were derived showing that they can act as charged particles. Using the fractionality of the quark charges, are led to suggest a topological confinement mechanism for these particles. One also derives the actions and equations of motion for the string from this viewpoint. Some new Lie algebras which have anticommuting elements are introduced. Their gauge theories are described, and the possibility of fermionic actions for the anticommuting pieces is examined. Supersymmetric strings and their supergauge transformations were discussed and an extension was suggested of supersymmetry to immersed minimal submanifolds other than the string. Both quarklike and vectorlike fermions are included. Finally the invariance of both the equations of motion and the gauge conditions under supersymmetry transformations for these submanifolds were described

  4. An Efficient Local Correlation Matrix Decomposition Approach for the Localization Implementation of Ensemble-Based Assimilation Methods

    Science.gov (United States)

    Zhang, Hongqin; Tian, Xiangjun

    2018-04-01

    Ensemble-based data assimilation methods often use the so-called localization scheme to improve the representation of the ensemble background error covariance (Be). Extensive research has been undertaken to reduce the computational cost of these methods by using the localized ensemble samples to localize Be by means of a direct decomposition of the local correlation matrix C. However, the computational costs of the direct decomposition of the local correlation matrix C are still extremely high due to its high dimension. In this paper, we propose an efficient local correlation matrix decomposition approach based on the concept of alternating directions. This approach is intended to avoid direct decomposition of the correlation matrix. Instead, we first decompose the correlation matrix into 1-D correlation matrices in the three coordinate directions, then construct their empirical orthogonal function decomposition at low resolution. This procedure is followed by the 1-D spline interpolation process to transform the above decompositions to the high-resolution grid. Finally, an efficient correlation matrix decomposition is achieved by computing the very similar Kronecker product. We conducted a series of comparison experiments to illustrate the validity and accuracy of the proposed local correlation matrix decomposition approach. The effectiveness of the proposed correlation matrix decomposition approach and its efficient localization implementation of the nonlinear least-squares four-dimensional variational assimilation are further demonstrated by several groups of numerical experiments based on the Advanced Research Weather Research and Forecasting model.

  5. Linear-scaling explicitly correlated treatment of solids: Periodic local MP2-F12 method

    Energy Technology Data Exchange (ETDEWEB)

    Usvyat, Denis, E-mail: denis.usvyat@chemie.uni-regensburg.de [Institute of Physical and Theoretical Chemistry, University of Regensburg, Universitätsstraße 31, D-93040 Regensburg (Germany)

    2013-11-21

    Theory and implementation of the periodic local MP2-F12 method in the 3*A fixed-amplitude ansatz is presented. The method is formulated in the direct space, employing local representation for the occupied, virtual, and auxiliary orbitals in the form of Wannier functions (WFs), projected atomic orbitals (PAOs), and atom-centered Gaussian-type orbitals, respectively. Local approximations are introduced, restricting the list of the explicitly correlated pairs, as well as occupied, virtual, and auxiliary spaces in the strong orthogonality projector to the pair-specific domains on the basis of spatial proximity of respective orbitals. The 4-index two-electron integrals appearing in the formalism are approximated via the direct-space density fitting technique. In this procedure, the fitting orbital spaces are also restricted to local fit-domains surrounding the fitted densities. The formulation of the method and its implementation exploits the translational symmetry and the site-group symmetries of the WFs. Test calculations are performed on LiH crystal. The results show that the periodic LMP2-F12 method substantially accelerates basis set convergence of the total correlation energy, and even more so the correlation energy differences. The resulting energies are quite insensitive to the resolution-of-the-identity domain sizes and the quality of the auxiliary basis sets. The convergence with the orbital domain size is somewhat slower, but still acceptable. Moreover, inclusion of slightly more diffuse functions, than those usually used in the periodic calculations, improves the convergence of the LMP2-F12 correlation energy with respect to both the size of the PAO-domains and the quality of the orbital basis set. At the same time, the essentially diffuse atomic orbitals from standard molecular basis sets, commonly utilized in molecular MP2-F12 calculations, but problematic in the periodic context, are not necessary for LMP2-F12 treatment of crystals.

  6. Comments on the locality in density-functional theory

    International Nuclear Information System (INIS)

    Lindgren, Ingvar; Salomonson, Sten

    2003-01-01

    The 'locality hypothesis' in density-functional theory (DFT), implying that the functional derivative is equivalent to a multiplicative local function, forms the basis of models of Kohn-Sham type. This has been generally accepted by the community since the advent of the model, and has later been formally proved for a large class of functionals. The hypothesis has recently been questioned by Nesbet [Phys. Rev. A 58, R12 (1998) and Phys. Rev. A 65, 010502 (2001)], who claims that it fails for the kinetic-energy functional for a system with more than two noninteracting electrons with a nondegenerate ground state. This conclusion has been questioned by Gal [Phys. Rev. A 62, 044501 (2000)] and by Holas and March [Phys. Rev. A 64, 016501 (2001)]. We claim that the arguments of Nesbet are incorrect, since the orbital functional used for the kinetic energy is not a unique functional of the total density in the domain of unnormalized orbitals. We have demonstrated that with a proper definition of the kinetic energy, which is a unique density functional also in the unnormalized region, the derivative can be represented by a single local multiplicative function for all v-representable densities. Therefore, we consider the controversy connected with the issue raised by Nesbet as resolved. We believe that the proof of the differentiability given here can be extended to larger groups of DFT functionals, and works along these lines are in progress

  7. Statistical lamb wave localization based on extreme value theory

    Science.gov (United States)

    Harley, Joel B.

    2018-04-01

    Guided wave localization methods based on delay-and-sum imaging, matched field processing, and other techniques have been designed and researched to create images that locate and describe structural damage. The maximum value of these images typically represent an estimated damage location. Yet, it is often unclear if this maximum value, or any other value in the image, is a statistically significant indicator of damage. Furthermore, there are currently few, if any, approaches to assess the statistical significance of guided wave localization images. As a result, we present statistical delay-and-sum and statistical matched field processing localization methods to create statistically significant images of damage. Our framework uses constant rate of false alarm statistics and extreme value theory to detect damage with little prior information. We demonstrate our methods with in situ guided wave data from an aluminum plate to detect two 0.75 cm diameter holes. Our results show an expected improvement in statistical significance as the number of sensors increase. With seventeen sensors, both methods successfully detect damage with statistical significance.

  8. New correlation potential for the local-spin-density functional formalism. II

    International Nuclear Information System (INIS)

    Kolar, M.; Farkas, L.

    1982-01-01

    Using the new parameterization for the correlation potential which seems to be the best that is at present available within the local-spin-density (LSD) functional formalism, the Fermi contact term in light atoms (up to Ni) is calculated. Although the overall improvement of the previous LSD results is obtained, discrepancy between theory and experiment remains rather large. It seems that the local approximation for exchange and correlation fails to predict such quantities as magnetic-moment density near the nucleus. It is also shown that the self-interaction correction does not remedy this failure. Further, the effect of the nonzero nuclear radius is investigated and found to be most important in the lightest atoms (e.g. a factor of 0.664 appears in the case of Li). This fact was omitted in all previous calculations and throws doubt on the reported excellent agreement of the results of many-body perturbation theory with experiment. It was also verified that the contact approximation of the Fermi contact term is really good enough. (author)

  9. Patching the Exchange-Correlation Potential in Density Functional Theory.

    Science.gov (United States)

    Huang, Chen

    2016-05-10

    A method for directly patching exchange-correlation (XC) potentials in materials is derived. The electron density of a system is partitioned into subsystem densities by dividing its Kohn-Sham (KS) potential among the subsystems. Inside each subsystem, its projected KS potential is required to become the total system's KS potential. This requirement, together with the nearsightedness principle of electronic matters, ensures that the electronic structures inside subsystems can be good approximations to the total system's electronic structure. The nearsightedness principle also ensures that subsystem densities could be well localized in their regions, making it possible to use high-level methods to invert the XC potentials for subsystem densities. Two XC patching methods are developed. In the local XC patching method, the total system's XC potential is improved in the cluster region. We show that the coupling between a cluster and its environment is important for achieving a fast convergence of the electronic structure in the cluster region. In the global XC patching method, we discuss how to patch the subsystem XC potentials to construct the XC potential in the total system, aiming to scale up high-level quantum mechanics simulations of materials. Proof-of-principle examples are given.

  10. A note on local GUT models in F-theory

    International Nuclear Information System (INIS)

    Chen, C.-M.; Chung, Y.-C.

    2010-01-01

    We construct non-minimal GUT local models in the F-theory configuration. The gauge group on the bulk G S is one rank higher than the GUT gauge group. The line bundles on the curves are nontrivial to break G S down to the GUT gauge groups. We demonstrate examples of SU(5) GUT from G S =SU(6) and G S =SO(10), the flipped SU(5) from G S =SO(10), and the SO(10) GUT from G S =SO(12) and G S =E 6 . We obtain complete GUT matter spectra and couplings, with minimum exotic matter contents. GUT gauge group breaking to MSSM is achievable by instanton configurations.

  11. Local chemical potential, local hardness, and dual descriptors in temperature dependent chemical reactivity theory.

    Science.gov (United States)

    Franco-Pérez, Marco; Ayers, Paul W; Gázquez, José L; Vela, Alberto

    2017-05-31

    In this work we establish a new temperature dependent procedure within the grand canonical ensemble, to avoid the Dirac delta function exhibited by some of the second order chemical reactivity descriptors based on density functional theory, at a temperature of 0 K. Through the definition of a local chemical potential designed to integrate to the global temperature dependent electronic chemical potential, the local chemical hardness is expressed in terms of the derivative of this local chemical potential with respect to the average number of electrons. For the three-ground-states ensemble model, this local hardness contains a term that is equal to the one intuitively proposed by Meneses, Tiznado, Contreras and Fuentealba, which integrates to the global hardness given by the difference in the first ionization potential, I, and the electron affinity, A, at any temperature. However, in the present approach one finds an additional temperature-dependent term that introduces changes at the local level and integrates to zero. Additionally, a τ-hard dual descriptor and a τ-soft dual descriptor given in terms of the product of the global hardness and the global softness multiplied by the dual descriptor, respectively, are derived. Since all these reactivity indices are given by expressions composed of terms that correspond to products of the global properties multiplied by the electrophilic or nucleophilic Fukui functions, they may be useful for studying and comparing equivalent sites in different chemical environments.

  12. Communication: Near-locality of exchange and correlation density functionals for 1- and 2-electron systems

    Science.gov (United States)

    Sun, Jianwei; Perdew, John P.; Yang, Zenghui; Peng, Haowei

    2016-05-01

    The uniform electron gas and the hydrogen atom play fundamental roles in condensed matter physics and quantum chemistry. The former has an infinite number of electrons uniformly distributed over the neutralizing positively charged background, and the latter only one electron bound to the proton. The uniform electron gas was used to derive the local spin density approximation to the exchange-correlation functional that undergirds the development of the Kohn-Sham density functional theory. We show here that the ground-state exchange-correlation energies of the hydrogen atom and many other 1- and 2-electron systems are modeled surprisingly well by a different local spin density approximation (LSDA0). LSDA0 is constructed to satisfy exact constraints but agrees surprisingly well with the exact results for a uniform two-electron density in a finite, curved three-dimensional space. We also apply LSDA0 to excited or noded 1-electron densities, where it works less well. Furthermore, we show that the localization of the exact exchange hole for a 1- or 2-electron ground state can be measured by the ratio of the exact exchange energy to its optimal lower bound.

  13. Communication: Near-locality of exchange and correlation density functionals for 1- and 2-electron systems

    Energy Technology Data Exchange (ETDEWEB)

    Sun, Jianwei; Yang, Zenghui; Peng, Haowei [Department of Physics, Temple University, Philadelphia, Pennsylvania 19122 (United States); Perdew, John P. [Department of Physics, Temple University, Philadelphia, Pennsylvania 19122 (United States); Department of Chemistry, Temple University, Philadelphia, Pennsylvania 19122 (United States)

    2016-05-21

    The uniform electron gas and the hydrogen atom play fundamental roles in condensed matter physics and quantum chemistry. The former has an infinite number of electrons uniformly distributed over the neutralizing positively charged background, and the latter only one electron bound to the proton. The uniform electron gas was used to derive the local spin density approximation to the exchange-correlation functional that undergirds the development of the Kohn-Sham density functional theory. We show here that the ground-state exchange-correlation energies of the hydrogen atom and many other 1- and 2-electron systems are modeled surprisingly well by a different local spin density approximation (LSDA0). LSDA0 is constructed to satisfy exact constraints but agrees surprisingly well with the exact results for a uniform two-electron density in a finite, curved three-dimensional space. We also apply LSDA0 to excited or noded 1-electron densities, where it works less well. Furthermore, we show that the localization of the exact exchange hole for a 1- or 2-electron ground state can be measured by the ratio of the exact exchange energy to its optimal lower bound.

  14. Communication: Near-locality of exchange and correlation density functionals for 1- and 2-electron systems

    International Nuclear Information System (INIS)

    Sun, Jianwei; Yang, Zenghui; Peng, Haowei; Perdew, John P.

    2016-01-01

    The uniform electron gas and the hydrogen atom play fundamental roles in condensed matter physics and quantum chemistry. The former has an infinite number of electrons uniformly distributed over the neutralizing positively charged background, and the latter only one electron bound to the proton. The uniform electron gas was used to derive the local spin density approximation to the exchange-correlation functional that undergirds the development of the Kohn-Sham density functional theory. We show here that the ground-state exchange-correlation energies of the hydrogen atom and many other 1- and 2-electron systems are modeled surprisingly well by a different local spin density approximation (LSDA0). LSDA0 is constructed to satisfy exact constraints but agrees surprisingly well with the exact results for a uniform two-electron density in a finite, curved three-dimensional space. We also apply LSDA0 to excited or noded 1-electron densities, where it works less well. Furthermore, we show that the localization of the exact exchange hole for a 1- or 2-electron ground state can be measured by the ratio of the exact exchange energy to its optimal lower bound.

  15. Exact correlators on the Wilson loop in N=4 SYM: localization, defect CFT, and integrability

    Science.gov (United States)

    Giombi, Simone; Komatsu, Shota

    2018-05-01

    We compute a set of correlation functions of operator insertions on the 1 /8 BPS Wilson loop in N=4 SYM by employing supersymmetric localization, OPE and the Gram-Schmidt orthogonalization. These correlators exhibit a simple determinant structure, are position-independent and form a topological subsector, but depend nontrivially on the 't Hooft coupling and the rank of the gauge group. When applied to the 1 /2 BPS circular (or straight) Wilson loop, our results provide an infinite family of exact defect CFT data, including the structure constants of protected defect primaries of arbitrary length inserted on the loop. At strong coupling, we show precise agreement with a direct calculation using perturbation theory around the AdS2 string worldsheet. We also explain the connection of our results to the "generalized Bremsstrahlung functions" previously computed from integrability techniques, reproducing the known results in the planar limit as well as obtaining their finite N generalization. Furthermore, we show that the correlators at large N can be recast as simple integrals of products of polynomials (known as Q-functions) that appear in the Quantum Spectral Curve approach. This suggests an interesting interplay between localization, defect CFT and integrability.

  16. Local economic development in theories of regional economies and rural studies

    Directory of Open Access Journals (Sweden)

    Kačar Bahrija

    2016-01-01

    Full Text Available In this paper is a detailed analysis of the basics in the theory of economic development during the period from mid last century until today. It states the most significant theories, points out their ranges, offers a critical review regarding their treatment of development, especially regional, rural and local one. It observes those theories according to different classifications existing in scientific literature, primarily the ascend theory, stagnation theory, balanced economic growth theory; then, short-term and long-term development and growth theories; traditional and endogenous theories; economic growth stages theory emphasized after the WWII; structural changes theory; dependency theory, neo-classic counter-revolution theory and endogenous theory as a new growth theory. The analysis becomes wider with a study on development in regional economy theories and rural studies and it systematizes the classification of those theories according to regional economy academics. Distancing ourselves from any particular division as the most suitable and acceptable one, the theories are treated separately and in an historic context, in order to encircle the time framework which from modern theories, dealing with local level development difficulties, resulted. It asserts The Community-led Rural Development Theory, often referred to as the Community Development Theory, or marked as Bottom-up Partnership Approach. The analysis of development theories asserts that mixed exogenous - endogenous approach to development links the rural/local development to the globalization process mostly due to fast technology changes of the IT and communication sectors.

  17. Observer efficiency in free-localization tasks with correlated noise

    Directory of Open Access Journals (Sweden)

    Craig eAbbey

    2014-05-01

    Full Text Available The efficiency of visual tasks involving localization has traditionally been evaluated using forced choice experiments that capitalize on independence across locations to simplify the performance of the ideal observer. However, developments in ideal observer analysis have shown how an ideal observer can be defined for free-localization tasks, where a target can appear anywhere in a defined search region and subjects respond by localizing the target. Since these tasks are representative of many real-world search tasks, it is of interest to evaluate the efficiency of observer performance in them. The central question of this work is whether humans are able to effectively use the information in a free-localization task relative to a similar task where target location is fixed. We use a yes-no detection task at a cued location as the reference for this comparison. Each of the tasks is evaluated using a Gaussian target profile embedded in four different Gaussian noise backgrounds having power-law noise power spectra with exponents ranging from 0 to 3. The free localization task had a square 6.7° search region. We report on two follow-up studies investigating efficiency in a detect-and-localize task, and the effect of processing the white-noise backgrounds. In the fixed-location detection task, we find average observer efficiency ranges from 35% to 59% for the different noise backgrounds. Observer efficiency improves dramatically in the tasks involving localization, ranging from 63% to 82% in the forced localization tasks and from 78% to 92% in the detect-and- localize tasks. Performance in white noise, the lowest efficiency condition, was improved by filtering to give them a power-law exponent of 2. Classification images, used to examine spatial frequency weights for the tasks, show better tuning to ideal weights in the free-localization tasks. The high absolute levels of efficiency suggest that observers are well-adapted to free-localization tasks.

  18. The theory of magnetohydrodynamic wave generation by localized sources. I - General asymptotic theory

    Science.gov (United States)

    Collins, William

    1989-01-01

    The magnetohydrodynamic wave emission from several localized, periodic, kinematically specified fluid velocity fields are calculated using Lighthill's method for finding the far-field wave forms. The waves propagate through an isothermal and uniform plasma with a constant B field. General properties of the energy flux are illustrated with models of pulsating flux tubes and convective rolls. Interference theory from geometrical optics is used to find the direction of minimum fast-wave emission from multipole sources and slow-wave emission from discontinuous sources. The distribution of total flux in fast and slow waves varies with the ratios of the source dimensions l to the acoustic and Alfven wavelengths.

  19. Three-qutrit correlations violate local realism more strongly than those of three qubits

    International Nuclear Information System (INIS)

    Kaszlikowski, Dagomir; Gosal, Darwin; Ling, E.J.; Oh, C.H.; Kwek, L.C.; Zukowski, Marek

    2002-01-01

    We present numerical data showing that three-qutrit correlations for a pure state, which is not maximally entangled, violate local realism more strongly than three-qubit correlations. The strength of violation is measured by the minimal amount of noise that must be admixed to the system so that the noisy correlations have a local and realistic model

  20. Relations between correlation functions in gauge field theory

    International Nuclear Information System (INIS)

    Simonov, Yu. A.; Shevchenko, V. I.

    1997-01-01

    Exact relations between vacuum correlations of non-Abelian field strengths are obtained. With the aid of exterior differentiation, the invariant parts of a given correlation function are expressed in terms of higher order correlation functions. The corollaries of these relations for the behavior of nonperturbative correlation functions at small and large distances are deduced

  1. Nonlinear theory of scattering by localized potentials in metals

    Energy Technology Data Exchange (ETDEWEB)

    Howard, I A [Department of Physics, University of Antwerp, Groenenborgerlaan 171, B-2020 Antwerp (Belgium); March, N H [Department of Physics, University of Antwerp, Groenenborgerlaan 171, B-2020 Antwerp (Belgium); Oxford University, Oxford (United Kingdom); Echenique, P M [Donostia International Physics Center (DIPC), 20018 San Sebastian, Basque Country (Spain); Departamento de Fisica de Materiales and Centro Mixto CSIC-UPV/EHU, Facultad de Quimicas, UPV/EHU, Apartado 1072, 20080, San Sebastian (Spain)

    2003-11-14

    In early work, March and Murray gave a perturbation theory of the Dirac density matrix {gamma}(r, r') generated by a localized potential V(r) embedded in an initially uniform Fermi gas to all orders in V(r). For potentials sufficiently slowly varying in space, they summed the resulting series for r' = r to regain the Thomas-Fermi density {rho}(r) {proportional_to} [{mu} - V(r)]{sup 3/2}, with {mu} the chemical potential of the Fermi gas. For an admittedly simplistic repulsive central potential V(r) = vertical bar A vertical bar exp(-cr), it is first shown here that what amounts to the sum of the March-Murray series for the s-wave (only) contribution to the density, namely {rho}{sub s}(r, {mu}), can be obtained in closed form. Furthermore, for specific numerical values of A and c in this exponential potential, the long-range behaviour of {rho}{sub s}(r, {mu}) is related to the zero-potential form of March and Murray, which merely suffers a {mu}-dependent phase shift. This result is interpreted in relation to the recent high density screening theorem of Zaremba, Nagy and Echenique. A brief discussion of excess electrical resistivity caused by nonlinear scattering in a Fermi gas is added; this now involves an off-diagonal local density of states. Finally, for periodic lattices, contact is made with the quantum-mechanical defect centre models of Koster and Slater (1954 Phys. Rev. 96 1208) and of Beeby (1967 Proc. R. Soc. A 302 113), and also with the semiclassical approximation of Friedel (1954 Adv. Phys. 3 446). In appendices, solvable low-dimensional models are briefly summarized.

  2. Local correlations of mixed two-qubit states

    International Nuclear Information System (INIS)

    Zhang Fulin; Chen Jingling; Ren Changliang; Shi Mingjun

    2010-01-01

    The quantum probability distribution arising from single-copy von Neumann measurements on an arbitrary two-qubit state is decomposed into the local and nonlocal parts, in the approach of Elitzur, Popescu and Rohrlich [A. Elitzur, S. Popescu, D. Rohrlich, Phys. Lett. A 162 (1992) 25]. A lower bound of the local weight is proved being connected with the concurrence of the state p L max =1-C(ρ). The local probability distributions for two families of mixed states are constructed independently, which accord with the lower bound.

  3. Accurate and systematically improvable density functional theory embedding for correlated wavefunctions

    International Nuclear Information System (INIS)

    Goodpaster, Jason D.; Barnes, Taylor A.; Miller, Thomas F.; Manby, Frederick R.

    2014-01-01

    We analyze the sources of error in quantum embedding calculations in which an active subsystem is treated using wavefunction methods, and the remainder using density functional theory. We show that the embedding potential felt by the electrons in the active subsystem makes only a small contribution to the error of the method, whereas the error in the nonadditive exchange-correlation energy dominates. We test an MP2 correction for this term and demonstrate that the corrected embedding scheme accurately reproduces wavefunction calculations for a series of chemical reactions. Our projector-based embedding method uses localized occupied orbitals to partition the system; as with other local correlation methods, abrupt changes in the character of the localized orbitals along a reaction coordinate can lead to discontinuities in the embedded energy, but we show that these discontinuities are small and can be systematically reduced by increasing the size of the active region. Convergence of reaction energies with respect to the size of the active subsystem is shown to be rapid for all cases where the density functional treatment is able to capture the polarization of the environment, even in conjugated systems, and even when the partition cuts across a double bond

  4. Local correlation detection with linearity enhancement in streaming data

    KAUST Repository

    Xie, Qing; Shang, Shuo; Yuan, Bo; Pang, Chaoyi; Zhang, Xiangliang

    2013-01-01

    -correlation calculation with time delay allowed. In addition, we introduce a shape-based similarity measure into the framework, which ref nes the results by representative trend patterns to enhance the signif cance of linearity. The similarity of proposed linear

  5. Nuclear collision theory with many-body correlations, 1

    International Nuclear Information System (INIS)

    Kurihara, Yukio.

    1984-11-01

    A generalized many-body correlation operator is introduced, following the Feshbach's formalism. Especially, the many-body correlation induced by the strong repulsion and attraction of the realistic NN interaction is concerned and the Feshbach's formalism is reformulated to describe such a many-body correlation well. And a method to estimate the many-body correlation operator is given from the multiple-scattering picture. The present formalism is compared with the resonating-group method. (author)

  6. Generalized correlation of indefiniteness coordinate-impulse in quantum mechanics and theory of brownian movement

    International Nuclear Information System (INIS)

    Sukhanov, A.D.

    2004-01-01

    Generalized correlations of the Schroedinger indefinitenesses are shown to have the meaning of the fundamental restrictions as to characteristics of space of states in any probability-like theory. Quantum mechanics, as well as, theory of the brownian movement at arbitrary space of time fall in the category of the mentioned theories. One compared correlations of coordinates-pulse indefinitenesses within the mentioned theory with the similar correlation of indefinitenesses for microparticle under the Gaussian wave packet state. One determined that in case of profound distinction in mathematical tools of two theories one observes their conceptual resemblance. It manifests itself under the alternative conditions - short times in one theory correspond to long ones in another theory and vice versa, while in any of the mentioned theories uncontrollable effect of either quantum or thermal type is of crucial importance [ru

  7. Quantum correlations and light localization in disordered nanophotonic structures

    DEFF Research Database (Denmark)

    Smolka, Stephan

    This thesis reports results on quantum properties of light in multiple-scattering nano-structured materials. Spatial quantum correlations of photons are demonstrated experimentally that are induced by multiple scattering of squeezed light and of purely quantum origin. By varying the quantum state...

  8. Local causal structures, Hadamard states and the principle of local covariance in quantum field theory

    Energy Technology Data Exchange (ETDEWEB)

    Dappiaggi, Claudio [Erwin Schroedinger Institut fuer Mathematische Physik, Wien (Austria); Pinamonti, Nicola [Hamburg Univ. (Germany). 2. Inst. fuer Theoretische Physik; Porrmann, Martin [KwaZulu-Natal Univ. (South Africa). Quantum Research Group, School of Physics; National Institute for Theoretical Physics, Durban (South Africa)

    2010-01-15

    In the framework of the algebraic formulation, we discuss and analyse some new features of the local structure of a real scalar quantum field theory in a strongly causal spacetime. In particular we use the properties of the exponential map to set up a local version of a bulk-to-boundary correspondence. The bulk is a suitable subset of a geodesic neighbourhood of any but fixed point p of the underlying background, while the boundary is a part of the future light cone having p as its own tip. In this regime, we provide a novel notion for the extended *-algebra of Wick polynomials on the said cone and, on the one hand, we prove that it contains the information of the bulk counterpart via an injective *-homomorphism while, on the other hand, we associate to it a distinguished state whose pull-back in the bulk is of Hadamard form. The main advantage of this point of view arises if one uses the universal properties of the exponential map and of the light cone in order to show that, for any two given backgrounds M and M{sup '} and for any two subsets of geodesic neighbourhoods of two arbitrary points, it is possible to engineer the above procedure such that the boundary extended algebras are related via a restriction homomorphism. This allows for the pull-back of boundary states in both spacetimes and, thus, to set up a machinery which permits the comparison of expectation values of local field observables in M and M{sup '}. (orig.)

  9. Local causal structures, Hadamard states and the principle of local covariance in quantum field theory

    International Nuclear Information System (INIS)

    Dappiaggi, Claudio; Pinamonti, Nicola

    2010-01-01

    In the framework of the algebraic formulation, we discuss and analyse some new features of the local structure of a real scalar quantum field theory in a strongly causal spacetime. In particular we use the properties of the exponential map to set up a local version of a bulk-to-boundary correspondence. The bulk is a suitable subset of a geodesic neighbourhood of any but fixed point p of the underlying background, while the boundary is a part of the future light cone having p as its own tip. In this regime, we provide a novel notion for the extended *-algebra of Wick polynomials on the said cone and, on the one hand, we prove that it contains the information of the bulk counterpart via an injective *-homomorphism while, on the other hand, we associate to it a distinguished state whose pull-back in the bulk is of Hadamard form. The main advantage of this point of view arises if one uses the universal properties of the exponential map and of the light cone in order to show that, for any two given backgrounds M and M ' and for any two subsets of geodesic neighbourhoods of two arbitrary points, it is possible to engineer the above procedure such that the boundary extended algebras are related via a restriction homomorphism. This allows for the pull-back of boundary states in both spacetimes and, thus, to set up a machinery which permits the comparison of expectation values of local field observables in M and M ' . (orig.)

  10. Quantum correlations, non-locality and the EPR paradox

    Energy Technology Data Exchange (ETDEWEB)

    Paramananda, V.; Butt, D.K.

    1987-04-01

    An experiment measuring the relative polarisations of paired 511 keV photons from s-state e/sup +/e/sup -/ annihilation has shown that within the errors of measurement quantum correlations do not fall off with increasing detector-detector separation up to a separation of 24 m. An important aspect of the measurement has been that the resolving time of the electronic equipment could be made as small as 100 ps. This gave the largest spacelike geometry of any such measurement so far. An attempt has been made to explain any possible fall-off of the correlation within the error of the measurement in terms of scattering produced by hypothetical virtual quantum black holes.

  11. A novel iris localization algorithm using correlation filtering

    Science.gov (United States)

    Pohit, Mausumi; Sharma, Jitu

    2015-06-01

    Fast and efficient segmentation of iris from the eye images is a primary requirement for robust database independent iris recognition. In this paper we have presented a new algorithm for computing the inner and outer boundaries of the iris and locating the pupil centre. Pupil-iris boundary computation is based on correlation filtering approach, whereas iris-sclera boundary is determined through one dimensional intensity mapping. The proposed approach is computationally less extensive when compared with the existing algorithms like Hough transform.

  12. A pair density functional theory utilizing the correlated wave function

    International Nuclear Information System (INIS)

    Higuchi, M; Higuchi, K

    2009-01-01

    We propose a practical scheme for calculating the ground-state pair density (PD) by utilizing the correlated wave function. As the correlated wave function, we adopt a linear combination of the single Slater determinants that are constructed from the solutions of the initial scheme [Higuchi M and Higuchi K 2007 Physica B 387, 117]. The single-particle equation is derived by performing the variational principle within the set of PDs that are constructed from such correlated wave functions. Since the search region of the PD is substantially extended as compared with the initial scheme, it is expected that the present scheme can cover more correlation effects. The single-particle equation is practical, and may be easily applied to actual calculations.

  13. A generalized non-local optical response theory for plasmonic nanostructures

    DEFF Research Database (Denmark)

    Mortensen, N. Asger; Raza, Søren; Wubs, Martijn

    2014-01-01

    for their description. Here instead we present a comparatively simple semiclassical generalized non-local optical response theory that unifies quantum pressure convection effects and induced charge diffusion kinetics, with a concomitant complex-valued generalized non-local optical response parameter. Our theory...

  14. Neurodevelopmental Correlates of Theory of Mind in Preschool Children

    Science.gov (United States)

    Sabbagh, Mark A.; Bowman, Lindsay C.; Evraire, Lyndsay E.; Ito, Jennie M. B.

    2009-01-01

    Baseline electroencephalogram (EEG) data were collected from twenty-nine 4-year-old children who also completed batteries of representational theory-of-mind (RTM) tasks and executive functioning (EF) tasks. Neural sources of children's EEG alpha (6-9 Hz) were estimated and analyzed to determine whether individual differences in regional EEG alpha…

  15. Neurobiological correlates of theory of mind in psychosis proneness

    NARCIS (Netherlands)

    Modinos, Gemma; Renken, Remco; Shamay-Tsoory, Simone G.; Ormel, Johan; Aleman, Andre

    2010-01-01

    Theory of mind (TOM) refers to the capacity to infer one's own and other persons' mental states. ToM abilities are compromised in schizophrenia, in association with dysfunctional activity in predominantly prefrontal brain regions. Prior behavioral studies have also suggested ToM deficits in healthy

  16. Importance of the correlation contribution for local hybrid functionals: range separation and self-interaction corrections.

    Science.gov (United States)

    Arbuznikov, Alexei V; Kaupp, Martin

    2012-01-07

    Local hybrid functionals with their position-dependent exact-exchange admixture are a conceptually simple and promising extension of the concept of a hybrid functional. Local hybrids based on a simple mixing of the local spin density approximation (LSDA) with exact exchange have been shown to be successful for thermochemistry, reaction barriers, and a range of other properties. So far, the combination of this generation of local hybrids with an LSDA correlation functional has been found to give the most favorable results for atomization energies, for a range of local mixing functions (LMFs) governing the exact-exchange admixture. Here, we show that the choice of correlation functional to be used with local hybrid exchange crucially influences the parameterization also of the exchange part as well as the overall performance. A novel ansatz for the correlation part of local hybrids is suggested based on (i) range-separation of LSDA correlation into short-range (SR) and long-range (LR) parts, and (ii) partial or full elimination of the one-electron self-correlation from the SR part. It is shown that such modified correlation functionals allow overall larger exact exchange admixture in thermochemically competitive local hybrids than before. This results in improvements for reaction barriers and for other properties crucially influenced by self-interaction errors, as demonstrated by a number of examples. Based on the range-separation approach, a fresh view on the breakdown of the correlation energy into dynamical and non-dynamical parts is suggested.

  17. On topological approach to local theory of surfaces in Calabi-Yau threefolds

    DEFF Research Database (Denmark)

    Gukov, Sergei; Liu, Chiu-Chu Melissa; Sheshmani, Artan

    2017-01-01

    We study the web of dualities relating various enumerative invariants, notably Gromov-Witten invariants and invariants that arise in topological gauge theory. In particular, we study Donaldson-Thomas gauge theory and its reductions to D=4 and D=2 which are relevant to the local theory of surfaces...

  18. Matrix models from localization of five-dimensional supersymmetric noncommutative U(1) gauge theory

    International Nuclear Information System (INIS)

    Lee, Bum-Hoon; Ro, Daeho; Yang, Hyun Seok

    2017-01-01

    We study localization of five-dimensional supersymmetric U(1) gauge theory on S 3 ×ℝ θ 2 where ℝ θ 2 is a noncommutative (NC) plane. The theory can be isomorphically mapped to three-dimensional supersymmetric U(N→∞) gauge theory on S 3 using the matrix representation on a separable Hilbert space on which NC fields linearly act. Therefore the NC space ℝ θ 2 allows for a flexible path to derive matrix models via localization from a higher-dimensional supersymmetric NC U(1) gauge theory. The result shows a rich duality between NC U(1) gauge theories and large N matrix models in various dimensions.

  19. Local anisotropy effects in the hydrodynamical theory of multiparticle production

    International Nuclear Information System (INIS)

    Gorenstein, M.I.; Sinyukov, Yu.M.

    1984-01-01

    The stage of secondary particle formation in the hydrodynamic theory of multiparticle production is analysed. We find out that the secondary particle spectrum of the fluid element decay is anisotropic in the rest frame system of this element. (orig.)

  20. Local anisotropy effects in the hydrodynamical theory of multiparticle production

    International Nuclear Information System (INIS)

    Gorenshtejn, M.I.; Sinyukov, Yu.M.

    1983-01-01

    The stage of final particle formation in the hydrodynamic theory of multiparticle production is analysed. It is shown, that secondary particle spectrum of the fluid element decay to be anisotropic in the rest frame system of this element

  1. Quantum entanglement in non-local games, graph parameters and zero-error information theory

    NARCIS (Netherlands)

    Scarpa, G.

    2013-01-01

    We study quantum entanglement and some of its applications in graph theory and zero-error information theory. In Chapter 1 we introduce entanglement and other fundamental concepts of quantum theory. In Chapter 2 we address the question of how much quantum correlations generated by entanglement can

  2. The physics of flocking: Correlation as a compass from experiments to theory

    Science.gov (United States)

    Cavagna, Andrea; Giardina, Irene; Grigera, Tomás S.

    2018-01-01

    Collective behavior in biological systems is a complex topic, to say the least. It runs wildly across scales in both space and time, involving taxonomically vastly different organisms, from bacteria and cell clusters, to insect swarms and up to vertebrate groups. It entails concepts as diverse as coordination, emergence, interaction, information, cooperation, decision-making, and synchronization. Amid this jumble, however, we cannot help noting many similarities between collective behavior in biological systems and collective behavior in statistical physics, even though none of these organisms remotely looks like an Ising spin. Such similarities, though somewhat qualitative, are startling, and regard mostly the emergence of global dynamical patterns qualitatively different from individual behavior, and the development of system-level order from local interactions. It is therefore tempting to describe collective behavior in biology within the conceptual framework of statistical physics, in the hope to extend to this new fascinating field at least part of the great predictive power of theoretical physics. In this review we propose that the conceptual cornerstone of this ambitious program be that of correlation. To illustrate this idea we address the case of collective behavior in bird flocks. Two key threads emerge, as two sides of one single story: the presence of scale-free correlations and the dynamical mechanism of information transfer. We discuss first static correlations in starling flocks, in particular the experimental finding of their scale-free nature, the formulation of models that account for this fact using maximum entropy, and the relation of scale-free correlations to information transfer. This is followed by a dynamic treatment of information propagation (propagation of turns across a flock), starting with a discussion of experimental results and following with possible theoretical explanations of those, which require the addition of behavioral

  3. THEORY OF CORRELATIONS AND FLUCTUATIONS IN NEUTRON DISTRIBUTIONS

    Energy Technology Data Exchange (ETDEWEB)

    Osborn, R. K.; Yip, S.

    1963-06-15

    Equations are derived for the first and second order densities for neutrons and alpha particles. The implications of the equations are examined by reducing them to their diffusion theory equivalents, and the one-speed equations are obtained. Results show that in cases where the singlet density can be approximated as spatially uniform, the same approximation may not apply to the doublet density. (D.C.W.)

  4. Modified perturbation theory for strongly correlated electron systems

    International Nuclear Information System (INIS)

    Takagi, Osamu; Saso, Tetsuro

    1999-01-01

    We propose a modified scheme for calculating the single-particle excitation spectrum of the impurity Anderson model. It is based on the second order perturbation theory, but modifies the self-energy so as to reproduce the correct atomic limit and to fulfill the Friedel sum rule. Therefore, it offers a simple scheme valid over wide range of excitation energy and parameters, and would be useful also for potential application to the lattice problems. (author)

  5. Tetragonal fcc-Fe induced by κ -carbide precipitates: Atomic scale insights from correlative electron microscopy, atom probe tomography, and density functional theory

    Science.gov (United States)

    Liebscher, Christian H.; Yao, Mengji; Dey, Poulumi; Lipińska-Chwalek, Marta; Berkels, Benjamin; Gault, Baptiste; Hickel, Tilmann; Herbig, Michael; Mayer, Joachim; Neugebauer, Jörg; Raabe, Dierk; Dehm, Gerhard; Scheu, Christina

    2018-02-01

    Correlative scanning transmission electron microscopy, atom probe tomography, and density functional theory calculations resolve the correlation between elastic strain fields and local impurity concentrations on the atomic scale. The correlative approach is applied to coherent interfaces in a κ -carbide strengthened low-density steel and establishes a tetragonal distortion of fcc-Fe. An interfacial roughness of ˜1 nm and a localized carbon concentration gradient extending over ˜2 -3 nm is revealed, which originates from the mechano-chemical coupling between local strain and composition.

  6. Multiattribute Utility Theory, Intertemporal Utility and Correlation Aversion

    DEFF Research Database (Denmark)

    Andersen, Steffen; Harrison, Glenn W.; Lau, Morten

    2018-01-01

    Convenient assumptions about qualitative properties of the intertemporal utility function have generated counterintuitive implications for the relationship between atemporal risk aversion and the intertemporal elasticity of substitution. If the intertemporal utility function is additively separable...... aversion. Our results show that subjects are correlation averse over lotteries with intertemporal income profiles....

  7. Strong Correlation in Kohn-Sham Density Functional Theory

    NARCIS (Netherlands)

    Malet, F.; Gori Giorgi, P.

    2012-01-01

    We use the exact strong-interaction limit of the Hohenberg-Kohn energy density functional to approximate the exchange-correlation energy of the restricted Kohn-Sham scheme. Our approximation corresponds to a highly nonlocal density functional whose functional derivative can be easily constructed,

  8. Locally excitatory, globally inhibitory oscillator networks: theory and application to scene segmentation

    Science.gov (United States)

    Wang, DeLiang; Terman, David

    1995-01-01

    A novel class of locally excitatory, globally inhibitory oscillator networks (LEGION) is proposed and investigated analytically and by computer simulation. The model of each oscillator corresponds to a standard relaxation oscillator with two time scales. The network exhibits a mechanism of selective gating, whereby an oscillator jumping up to its active phase rapidly recruits the oscillators stimulated by the same pattern, while preventing other oscillators from jumping up. We show analytically that with the selective gating mechanism the network rapidly achieves both synchronization within blocks of oscillators that are stimulated by connected regions and desynchronization between different blocks. Computer simulations demonstrate LEGION's promising ability for segmenting multiple input patterns in real time. This model lays a physical foundation for the oscillatory correlation theory of feature binding, and may provide an effective computational framework for scene segmentation and figure/ground segregation.

  9. Effect of Ionic Correlations on the Surface Forces in Thin Liquid Films: Influence of Multivalent Coions and Extended Theory

    Directory of Open Access Journals (Sweden)

    Krassimir D. Danov

    2016-03-01

    Full Text Available Experimental data for the disjoining pressure of foam films stabilized by anionic surfactant in the presence of 1:1, 1:2, 1:3, and 2:2 electrolytes: NaCl, Na2SO4, Na3Citrate, and MgSO4 are reported. The disjoining pressure predicted by the Derjaguin-Landau-Verwey-Overbeek (DLVO theory coincides with the experimental data in the case of a 1:1 electrolyte, but it is considerably greater than the measured pressure in all other cases. The theory is extended to account for the effects of ionic correlations and finite ionic radii. Original analytical expressions are derived for the local activity coefficient, electrostatic disjoining pressure, and asymptotic screening parameter. With the same parameter of counterion binding as for a 1:1 electrolyte, the curves predicted by the extended theory are in perfect agreement with the experimental data for 1:2 and 1:3 electrolytes. In comparison with the DLVO theory, the effect of ionic correlations leads to more effective screening of electrostatic interactions, and lower electric potential and counterion concentrations in the film’s midplane, resulting in lower disjoining pressure, as experimentally observed. The developed theory is applicable to both multivalent coions and multivalent counterions. Its application could remove some discrepancies between theory and experiment observed in studies with liquid films from electrolyte solutions.

  10. Importance of non-local electron-positron correlations for positron annihilation characteristics in solids

    International Nuclear Information System (INIS)

    Rubaszek, A.

    2001-01-01

    Several methods to describe the electron-positron (e-p) correlation effects are used in calculations of positron annihilation characteristics in solids. The weighted density approximation (WDA), giving rise to the non-local, state-selective e-p correlation functions, is applied to calculate positron annihilation rates and e-p momentum densities in a variety of metals and silicon. The WDA results are compared to the results of other methods such as the independent particle model, local density approximation, generalised gradient approximation, and also to experiments. The importance of non-locality and state-dependence of the e-p correlation functions is discussed. (orig.)

  11. Current algebra and the local nature of symmetries in local quantum theory

    International Nuclear Information System (INIS)

    Doplicher, S.

    In this report we mainly discuss the problem of finding local observables which measure the charges in a volume smaller than their localization region, in particular providing the existence of local observables with a specific physical interpretation. In the same way we can also establish the existence of a version of the current algebra structure. Similar local observables can be constructed for the energy-momentum; we also comment on the local implementation of supersymmetries. (orig./HSI)

  12. A technical basis for the flux corrected local conditions critical heat flux correlation

    International Nuclear Information System (INIS)

    Luxat, J.C.

    2008-01-01

    The so-called 'flux-corrected' local conditions CHF correlation was developed at Ontario Hydro in the 1980's and was demonstrated to successfully correlate the Onset of Intermittent Dryout (OID) CHF data for 37-element fuel with a downstream-skewed axial heat flux distribution. However, because the heat flux correction factor appeared to be an ad-hoc, albeit a successful modifying factor in the correlation, there was reluctance to accept the correlation more generally. This paper presents a thermalhydraulic basis, derived from two-phase flow considerations, that supports the appropriateness of the heat flux correction as a local effects modifying factor. (author)

  13. Local theory for 2-functors on path 2-groupoids

    Czech Academy of Sciences Publication Activity Database

    Schreiber, Urs; Waldorf, K.

    2017-01-01

    Roč. 12, č. 3 (2017), s. 617-658 ISSN 2193-8407 Institutional support: RVO:67985840 Keywords : smooth paths * fundamental 2-grupoid * descent theory Subject RIV: BA - General Mathematics OBOR OECD: Pure mathematics Impact factor: 0.456, year: 2016 https://link.springer.com/article/10.1007%2Fs40062-016-0140-4

  14. Strongly correlated electron materials. I. Theory of the quasiparticle structure

    International Nuclear Information System (INIS)

    Lopez-Aguilar, F.; Costa-Quintana, J.; Puig-Puig, L.

    1993-01-01

    In this paper we give a method for analyzing the renormalized electronic structure of the Hubbard systems. The first step is the determination of effective interactions from the random-phase approximation (RPA) and from an extended RPA (ERPA) that introduces vertex effects within the bubble polarization. The second step is the determination of the density of states deduced from the spectral functions. Its analysis leads us to conclude that these systems can exhibit three types of resonances in their electronic structures: the lower-, middle-, and upper-energy resonances. Furthermore, we analyze the conditions for which there is only one type of resonance and the causes that lead to the disappearance of the heavy-fermion state. We finally introduce the RPA and ERPA effective interactions within the strong-coupling theory and we give the conditions for obtaining coupling and superconductivity

  15. Similarity-transformed perturbation theory on top of truncated local coupled cluster solutions: Theory and applications to intermolecular interactions

    Energy Technology Data Exchange (ETDEWEB)

    Azar, Richard Julian, E-mail: julianazar2323@berkeley.edu; Head-Gordon, Martin, E-mail: mhg@cchem.berkeley.edu [Kenneth S. Pitzer Center for Theoretical Chemistry, Department of Chemistry, University of California and Chemical Sciences Division, Lawrence Berkeley National Laboratory, Berkeley, California 94720 (United States)

    2015-05-28

    Your correspondents develop and apply fully nonorthogonal, local-reference perturbation theories describing non-covalent interactions. Our formulations are based on a Löwdin partitioning of the similarity-transformed Hamiltonian into a zeroth-order intramonomer piece (taking local CCSD solutions as its zeroth-order eigenfunction) plus a first-order piece coupling the fragments. If considerations are limited to a single molecule, the proposed intermolecular similarity-transformed perturbation theory represents a frozen-orbital variant of the “(2)”-type theories shown to be competitive with CCSD(T) and of similar cost if all terms are retained. Different restrictions on the zeroth- and first-order amplitudes are explored in the context of large-computation tractability and elucidation of non-local effects in the space of singles and doubles. To accurately approximate CCSD intermolecular interaction energies, a quadratically growing number of variables must be included at zeroth-order.

  16. Cosmological term in general relativity theory and localization of de Sitter and Einstein groups

    International Nuclear Information System (INIS)

    Tunyak, V.N.

    1984-01-01

    The theory of gauge gravitational field with the de Sitter group localization is formulated. proceeding from the de Sitter Universe tetrad components the relationship between Riemann metrics and de Sitter gauge field is established. It is shown that General relativity theory (GRT) with a cosmological term is the simplest variant of the de Sitter gauge gravitation theory passing in the limit of infinite curvature radius of the de Sitter Universe into the Poincare - invariant GRT without cosmological term. Similarly the theory of gauge gravitational field at localization of the dynamical group of the Einstein homogeneous static Universe (Einstein group RxSO(4)) is formulated

  17. Mathematical models and methods of localized interaction theory

    CERN Document Server

    Bunimovich, AI

    1995-01-01

    The interaction of the environment with a moving body is called "localized" if it has been found or assumed that the force or/and thermal influence of the environment on each body surface point is independent and can be determined by the local geometrical and kinematical characteristics of this point as well as by the parameters of the environment and body-environment interactions which are the same for the whole surface of contact.Such models are widespread in aerodynamics and gas dynamics, covering supersonic and hypersonic flows, and rarefied gas flows. They describe the influence of light

  18. GOVERNANCE FROM BELOW A Theory of Local Government With Two Empirical Tests

    OpenAIRE

    Jean-Paul Faguet

    2005-01-01

    I examine decentralization through the lens of the local dynamics that it unleashes. The national effects of decentralization are simply the sum of its local-level effects. Hence to understand decentralization we must first understand how local government works. This paper proposes a theory of local government as the confluence of two quasi-markets and one organizational dynamic. Good government results when these three elements - political, economic and civil - are in rough balance, and acto...

  19. Multiple scattering theory for non-local and multichannel potentials

    Czech Academy of Sciences Publication Activity Database

    Natoli, C.R.; Krüger, P.; Hatada, K.; Hayakawa, K.; Sébilleau, D.; Šipr, Ondřej

    2012-01-01

    Roč. 24, č. 36 (2012), s. 1-20 ISSN 0953-8984 Institutional research plan: CEZ:AV0Z10100521 Keywords : multichannel scattering * correlation s * density matrix Subject RIV: BM - Solid Matter Physics ; Magnetism Impact factor: 2.355, year: 2012

  20. Local structure theory: calculation on hexagonal arrays, and interaction of rule and lattice

    International Nuclear Information System (INIS)

    Gutowitz, H.A.; Victor, J.D.

    1989-01-01

    Local structure theory calculations are applied to the study of cellular automata on the two-dimensional hexagonal lattice. A particular hexagonal lattice rule denoted (3422) is considered in detail. This rule has many features in common with Conway's Life. The local structure theory captures many of the statistical properties of this rule; this supports hypotheses raised by a study of Life itself. As in Life, the state of a cell under (3422) depends only on the state of the cell itself and the sum of states in its neighborhood at the previous time step. This property implies that evolution rules which operate in the same way can be studied on different lattices. The differences between the behavior of these rules on different lattices are dramatic. The mean field theory cannot reflect these differences. However, a generalization of the mean field theory, the local structure theory, does account for the rule-lattice interaction

  1. Physical principles, geometrical aspects, and locality properties of gauge field theories

    International Nuclear Information System (INIS)

    Mack, G.; Hamburg Univ.

    1981-01-01

    Gauge field theories, particularly Yang - Mills theories, are discussed at a classical level from a geometrical point of view. The introductory chapters are concentrated on physical principles and mathematical tools. The main part is devoted to locality problems in gauge field theories. Examples show that locality problems originate from two sources in pure Yang - Mills theories (without matter fields). One is topological and the other is related to the existence of degenerated field configurations of the infinitesimal holonomy groups on some extended region of space or space-time. Nondegenerate field configurations in theories with semisimple gauge groups can be analysed with the help of the concept of a local gauge. Such gauges play a central role in the discussion. (author)

  2. Provider integration and local market conditions: a contingency theory perspective.

    Science.gov (United States)

    Young, G J; Parker, V A; Charns, M P

    2001-01-01

    In recent years we have witnessed an expanding array of organizational arrangements for providing health care services in the U.S. These arrangements integrate previously independent providers at one or more points on the continuum of care. The presence of so many of these arrangements raises the question of whether certain types are more effective than are others to help providers adapt to their environment. This article discusses contingency theory as a conceptual lens for guiding empirical studies of the effectiveness of different types of arrangements.

  3. Of N=1 supersymmetric gauge theories and localization

    OpenAIRE

    Wens, Vincent

    2009-01-01

    In this thesis, we study certain non-perturbative aspects of N=1 gauge theories. We show how to compute the expectation values of chiral operators (i.e. those that preserve the anti-chiral supercharges) exactly from a first-principle approach based on the path integral over the microscopic fields. The text is divided into two parts. The first one consists of an original introduction to the tools that underlie the researches and results obtained during this thesis. After a general introduction...

  4. Local thermodynamic mapping for effective liquid density-functional theory

    Science.gov (United States)

    Kyrlidis, Agathagelos; Brown, Robert A.

    1992-01-01

    The structural-mapping approximation introduced by Lutsko and Baus (1990) in the generalized effective-liquid approximation is extended to include a local thermodynamic mapping based on a spatially dependent effective density for approximating the solid phase in terms of the uniform liquid. This latter approximation, called the local generalized effective-liquid approximation (LGELA) yields excellent predictions for the free energy of hard-sphere solids and for the conditions of coexistence of a hard-sphere fcc solid with a liquid. Moreover, the predicted free energy remains single valued for calculations with more loosely packed crystalline structures, such as the diamond lattice. The spatial dependence of the weighted density makes the LGELA useful in the study of inhomogeneous solids.

  5. Plaquette-plaquette correlations in the SU(2) lattice gauge theory

    International Nuclear Information System (INIS)

    Berg, B.

    1980-09-01

    Monte Carlo measurements of plaquette-plaquette correlations in the 4-dimensional SU(2) lattice gauge theory are reported. For low temperatures the glue ball mass (= inverse correlation length) is estimated to be msub(g) = (3.7 +- 1.2) √K, where K is the string tension. (orig.)

  6. From plane waves to local Gaussians for the simulation of correlated periodic systems

    International Nuclear Information System (INIS)

    Booth, George H.; Tsatsoulis, Theodoros; Grüneis, Andreas; Chan, Garnet Kin-Lic

    2016-01-01

    We present a simple, robust, and black-box approach to the implementation and use of local, periodic, atom-centered Gaussian basis functions within a plane wave code, in a computationally efficient manner. The procedure outlined is based on the representation of the Gaussians within a finite bandwidth by their underlying plane wave coefficients. The core region is handled within the projected augment wave framework, by pseudizing the Gaussian functions within a cutoff radius around each nucleus, smoothing the functions so that they are faithfully represented by a plane wave basis with only moderate kinetic energy cutoff. To mitigate the effects of the basis set superposition error and incompleteness at the mean-field level introduced by the Gaussian basis, we also propose a hybrid approach, whereby the complete occupied space is first converged within a large plane wave basis, and the Gaussian basis used to construct a complementary virtual space for the application of correlated methods. We demonstrate that these pseudized Gaussians yield compact and systematically improvable spaces with an accuracy comparable to their non-pseudized Gaussian counterparts. A key advantage of the described method is its ability to efficiently capture and describe electronic correlation effects of weakly bound and low-dimensional systems, where plane waves are not sufficiently compact or able to be truncated without unphysical artifacts. We investigate the accuracy of the pseudized Gaussians for the water dimer interaction, neon solid, and water adsorption on a LiH surface, at the level of second-order Møller–Plesset perturbation theory.

  7. From plane waves to local Gaussians for the simulation of correlated periodic systems

    Energy Technology Data Exchange (ETDEWEB)

    Booth, George H., E-mail: george.booth@kcl.ac.uk [Department of Physics, King’s College London, Strand, London WC2R 2LS (United Kingdom); Tsatsoulis, Theodoros; Grüneis, Andreas, E-mail: a.grueneis@fkf.mpg.de [Max Planck Institute for Solid State Research, Heisenbergstraße 1, 70569 Stuttgart (Germany); Chan, Garnet Kin-Lic [Frick Laboratory, Department of Chemistry, Princeton University, Princeton, New Jersey 08544 (United States)

    2016-08-28

    We present a simple, robust, and black-box approach to the implementation and use of local, periodic, atom-centered Gaussian basis functions within a plane wave code, in a computationally efficient manner. The procedure outlined is based on the representation of the Gaussians within a finite bandwidth by their underlying plane wave coefficients. The core region is handled within the projected augment wave framework, by pseudizing the Gaussian functions within a cutoff radius around each nucleus, smoothing the functions so that they are faithfully represented by a plane wave basis with only moderate kinetic energy cutoff. To mitigate the effects of the basis set superposition error and incompleteness at the mean-field level introduced by the Gaussian basis, we also propose a hybrid approach, whereby the complete occupied space is first converged within a large plane wave basis, and the Gaussian basis used to construct a complementary virtual space for the application of correlated methods. We demonstrate that these pseudized Gaussians yield compact and systematically improvable spaces with an accuracy comparable to their non-pseudized Gaussian counterparts. A key advantage of the described method is its ability to efficiently capture and describe electronic correlation effects of weakly bound and low-dimensional systems, where plane waves are not sufficiently compact or able to be truncated without unphysical artifacts. We investigate the accuracy of the pseudized Gaussians for the water dimer interaction, neon solid, and water adsorption on a LiH surface, at the level of second-order Møller–Plesset perturbation theory.

  8. Maximal locality and predictive power in higher-dimensional, compactified field theories

    International Nuclear Information System (INIS)

    Kubo, Jisuke; Nunami, Masanori

    2004-01-01

    To realize maximal locality in a trivial field theory, we maximize the ultraviolet cutoff of the theory by fine tuning the infrared values of the parameters. This optimization procedure is applied to the scalar theory in D + 1 dimensional (D ≥ 4) with one extra dimension compactified on a circle of radius R. The optimized, infrared values of the parameters are then compared with the corresponding ones of the uncompactified theory in D dimensions, which is assumed to be the low-energy effective theory. We find that these values approximately agree with each other as long as R -1 > approx sM is satisfied, where s ≅ 10, 50, 50, 100 for D = 4,5,6,7, and M is a typical scale of the D-dimensional theory. This result supports the previously made claim that the maximization of the ultraviolet cutoff in a nonrenormalizable field theory can give the theory more predictive power. (author)

  9. Existence of local degrees of freedom for higher dimensional pure Chern-Simons theories

    International Nuclear Information System (INIS)

    Banados, M.; Garay, L.J.; Henneaux, M.

    1996-01-01

    The canonical structure of higher dimensional pure Chern-Simons theories is analyzed. It is shown that these theories have generically a nonvanishing number of local degrees of freedom, even though they are obtained by means of a topological construction. This number of local degrees of freedom is computed as a function of the spacetime dimension and the dimension of the gauge group. copyright 1996 The American Physical Society

  10. Vacuum correlation functions for ghost superfields and multiloop amplitudes in the theory of closed superstrings

    International Nuclear Information System (INIS)

    Danilov, G.S.

    1995-01-01

    A new formalism for ghosts on complex (1 bar 1) supermanifolds of genus n > 1 is discussed in superstring theory. In this formalism, vacuum correlation functions for ghost superfields differ substantially from correlation functions discussed earlier. In particular, the new correlation functions do not have unphysical poles. Among other things, these correlation functions take into account contributions to partition functions from the phase space of modular forms and from zero modes of ghosts. The above correlation functions, obtained for all even spinor structures, can be used to evaluate partition functions from equations that are nothing but Ward identities. 21 refs

  11. Light Condensation and Localization in Disordered Photonic Media: Theory and Large Scale ab initio Simulations

    KAUST Repository

    Toth, Laszlo Daniel

    2013-05-07

    Disordered photonics is the study of light in random media. In a disordered photonic medium, multiple scattering of light and coherence, together with the fundamental principle of reciprocity, produce a wide range of interesting phenomena, such as enhanced backscattering and Anderson localization of light. They are also responsible for the existence of modes in these random systems. It is known that analogous processes to Bose-Einstein condensation can occur in classical wave systems, too. Classical condensation has been studied in several contexts in photonics: pulse formation in lasers, mode-locking theory and coherent emission of disordered lasers. All these systems have the common theme of possessing a large ensemble of waves or modes, together with nonlinearity, dispersion or gain. In this work, we study light condensation and its connection with light localization in a disordered, passive dielectric medium. We develop a theory for the modes inside the disordered resonator, which combines the Feshbach projection technique with spin-glass theory and statistical physics. In particular, starting from the Maxwell’s equations, we map the system to a spherical p-spin model with p = 2. The spins are replaced by modes and the temperature is related to the fluctuations in the environment. We study the equilibrium thermodynamics of the system in a general framework and show that two distinct phases exist: a paramagnetic phase, where all the modes are randomly oscillating and a condensed phase, where the energy condensates on a single mode. The thermodynamic quantities can be explicitly interpreted and can also be computed from the disorder-averaged time domain correlation function. We launch an ab initio simulation campaign using our own code and the Shaheen supercomputer to test the theoretical predictions. We construct photonic samples of varying disorder and find computationally relevant ways to obtain the thermodynamic quantities. We observe the phase transition

  12. Quasi-local conserved charges in Lorenz-diffeomorphism covariant theory of gravity

    Energy Technology Data Exchange (ETDEWEB)

    Adami, H.; Setare, M.R. [University of Kurdistan, Department of Science, Sanandaj (Iran, Islamic Republic of)

    2016-04-15

    In this paper, using the combined Lorenz-diffeomorphism symmetry, we find a general formula for the quasi-local conserved charge of the covariant gravity theories in a first order formalism of gravity. We simplify the general formula for the Lovelock theory of gravity. Afterwards, we apply the obtained formula on BHT gravity to obtain the energy and angular momentum of the rotating OTT black hole solution in the context of this theory. (orig.)

  13. Quasi-local conserved charges in Lorenz-diffeomorphism covariant theory of gravity

    Science.gov (United States)

    Adami, H.; Setare, M. R.

    2016-04-01

    In this paper, using the combined Lorenz-diffeomorphism symmetry, we find a general formula for the quasi-local conserved charge of the covariant gravity theories in a first order formalism of gravity. We simplify the general formula for the Lovelock theory of gravity. Afterwards, we apply the obtained formula on BHT gravity to obtain the energy and angular momentum of the rotating OTT black hole solution in the context of this theory.

  14. Calculations with the quasirelativistic local-spin-density-functional theory for high-Z atoms

    International Nuclear Information System (INIS)

    Guo, Y.; Whitehead, M.A.

    1988-01-01

    The generalized-exchange local-spin-density-functional theory (LSD-GX) with relativistic corrections of the mass velocity and Darwin terms has been used to calculate statistical total energies for the neutral atoms, the positive ions, and the negative ions for high-Z elements. The effect of the correlation and relaxation correction on the statistical total energy is discussed. Comparing the calculated results for the ionization potentials and electron affinities for the atoms (atomic number Z from 37 to 56 and 72 to 80) with experiment, shows that for the atoms rubidium to barium both the LSD-GX and the quasirelativistic LSD-GX, with self-interaction correction, Gopinathan, Whitehead, and Bogdanovic's Fermi-hole parameters [Phys. Rev. A 14, 1 (1976)], and Vosko, Wilk, and Nusair's correlation correction [Can. J. Phys. 58, 1200 (1980)], are very good methods for calculating ionization potentials and electron affinities. For the atoms hafnium to mercury the relativistic effect has to be considered

  15. A formal derivation of the local energy transfer (LET) theory of homogeneous turbulence

    Science.gov (United States)

    McComb, W. D.; Yoffe, S. R.

    2017-09-01

    A statistical closure of the Navier-Stokes hierarchy which leads to equations for the two-point, two-time covariance of the velocity field for stationary, homogeneous isotropic turbulence is presented. It is a generalisation of the self-consistent field method due to Edwards (1964) for the stationary, single-time velocity covariance. The probability distribution functional P≤ft[\\mathbf{u},t\\right] is obtained, in the form of a series, from the Liouville equation by means of a perturbation expansion about a Gaussian distribution, which is chosen to give the exact two-point, two-time covariance. The triple moment is calculated in terms of an ensemble-averaged infinitesimal velocity-field propagator, and shown to yield the Edwards result as a special case. The use of a Gaussian zero-order distribution has been found to justify the introduction of a fluctuation-response relation, which is in accord with modern dynamical theories. In a sense this work completes the analogy drawn by Edwards between turbulence and Brownian motion. Originally Edwards had shown that the noise input was determined by the correlation of the velocity field with the externally applied stirring forces but was unable to determine the system response. Now we find that the system response is determined by the correlation of the velocity field with internal quasi-entropic forces. This analysis is valid to all orders of perturbation theory, and allows the recovery of the local energy transfer (LET) theory, which had previously been derived by more heuristical methods. The LET theory is known to be in good agreement with experimental results. It is also unique among two-point statistical closures in displaying an acceptable (i.e. non-Markovian) relationship between the transfer spectrum and the system response, in accordance with experimental results. As a result of the latter property, it is compatible with the Kolmogorov (K41) spectral phenomenology. In memory of Professor Sir Sam Edwards F

  16. The quasi-diffusive approximation in transport theory: Local solutions

    International Nuclear Information System (INIS)

    Celaschi, M.; Montagnini, B.

    1995-01-01

    The one velocity, plane geometry integral neutron transport equation is transformed into a system of two equations, one of them being the equation of continuity and the other a generalized Fick's law, in which the usual diffusion coefficient is replaced by a self-adjoint integral operator. As the kernel of this operator is very close to the Green function of a diffusion equation, an approximate inversion by means of a second order differential operator allows to transform these equations into a purely differential system which is shown to be equivalent, in the simplest case, to a diffusion-like equation. The method, the principles of which have been exposed in a previous paper, is here extended and applied to a variety of problems. If the inversion is properly performed, the quasi-diffusive solutions turn out to be quite accurate, even in the vicinity of the interface between different material regions, where elementary diffusion theory usually fails. 16 refs., 3 tabs

  17. Localized Plasmon resonance in metal nanoparticles using Mie theory

    Science.gov (United States)

    Duque, J. S.; Blandón, J. S.; Riascos, H.

    2017-06-01

    In this work, scattering light by colloidal metal nanoparticles with spherical shape was studied. Optical properties such as diffusion efficiencies of extinction and absorption Q ext and Q abs were calculated using Mie theory. We employed a MATLAB program to calculate the Mie efficiencies and the radial dependence of electric field intensities emitted for colloidal metal nanoparticles (MNPs). By UV-Vis spectroscopy we have determined the LSPR for Cu nanoparticles (CuNPs), Ni nanoparticles (NiNPs) and Co nanoparticles (CoNPs) grown by laser ablation technique. The peaks of resonances appear in 590nm, 384nm and 350nm for CuNPs, NiNPs and CoNPs respectively suspended in water. Changing the medium to acetone and ethanol we observed a shift of the resonance peaks, these values agreed with our simulations results.

  18. Acoustic Source Localization and Beamforming: Theory and Practice

    Directory of Open Access Journals (Sweden)

    Chen Joe C

    2003-01-01

    Full Text Available We consider the theoretical and practical aspects of locating acoustic sources using an array of microphones. A maximum-likelihood (ML direct localization is obtained when the sound source is near the array, while in the far-field case, we demonstrate the localization via the cross bearing from several widely separated arrays. In the case of multiple sources, an alternating projection procedure is applied to determine the ML estimate of the DOAs from the observed data. The ML estimator is shown to be effective in locating sound sources of various types, for example, vehicle, music, and even white noise. From the theoretical Cramér-Rao bound analysis, we find that better source location estimates can be obtained for high-frequency signals than low-frequency signals. In addition, large range estimation error results when the source signal is unknown, but such unknown parameter does not have much impact on angle estimation. Much experimentally measured acoustic data was used to verify the proposed algorithms.

  19. Neuropsychological correlates of theory of mind in patients with early Parkinson's disease.

    Science.gov (United States)

    Santangelo, Gabriella; Vitale, Carmine; Trojano, Luigi; Errico, Domenico; Amboni, Marianna; Barbarulo, Anna Maria; Grossi, Dario; Barone, Paolo

    2012-01-01

    The theory of mind is the ability to attribute mental states to oneself and others and to understand that others have beliefs, desires and intentions different from one's own. The aim of the study was to explore the neuropsychological correlates of theory of mind in patients affected by early Parkinson's disease (PD). Thirty-three PD patients and 33 age-, sex-, and education-matched control subjects underwent the Frontal Assessment Battery, as well as tasks assessing "cognitive" and "affective" theory of mind, and memory abilities; questionnaires evaluating behavioral disorders and quality of life were also administrated. Although the 2 groups did not differ on neuropsychological tasks, PD patients' performance on tasks assessing cognitive and affective theory of mind was significantly worse than controls. Moreover, PD patients had more behavioral disorders and worse quality of life than controls. After covarying for behavioral and quality of life scores, the differences between patients and controls on theory of mind tasks remained significant. "Cognitive" theory of mind was associated with Frontal Assessment Battery score and 2 domains of quality of life scale, whereas "affective" theory of mind scores correlated only with behavioral scales such as the Frontal Behavioral Inventory and Apathy Evaluation Scale. The results demonstrate that both affective and cognitive aspects of theory of mind are simultaneously impaired in early PD and suggest that deficits in the 2 subcomponents of theory of mind may be linked to dysfunction of different frontosubcortical circuitries in early PD. Copyright © 2011 Movement Disorder Society.

  20. On local field products in special Wightman theories

    International Nuclear Information System (INIS)

    Baumann, K.

    1975-01-01

    We shall try to define local field products under assumptions imposed only on the four-point-function. This idea is based on the work of Schlieder and Seiler. In our framework we shall prove that the two-point-function carries the strongest singularity whenever two arguments in a Wightman function coincide. This will be generalized to the case when more arguments coincide. We shall define 'regulated' n-point-functions and study their properties in detail. This will lead us to the definition of arbitrarily high powers of the field-operators as operator-valued distributions over D(R 4 ) in the center coordinate with a dense domain of definition. (orig.) [de

  1. Hypo-analytic structures local theory (PMS-40)

    CERN Document Server

    Treves, François

    2014-01-01

    In Hypo-Analytic Structures Franois Treves provides a systematic approach to the study of the differential structures on manifolds defined by systems of complex vector fields. Serving as his main examples are the elliptic complexes, among which the De Rham and Dolbeault are the best known, and the tangential Cauchy-Riemann operators. Basic geometric entities attached to those structures are isolated, such as maximally real submanifolds and orbits of the system. Treves discusses the existence, uniqueness, and approximation of local solutions to homogeneous and inhomogeneous equations and delimits their supports. The contents of this book consist of many results accumulated in the last decade by the author and his collaborators, but also include classical results, such as the Newlander-Nirenberg theorem. The reader will find an elementary description of the FBI transform, as well as examples of its use. Treves extends the main approximation and uniqueness results to first-order nonlinear equations by means of ...

  2. The CPT-theorem in two-dimensional theories of local observables

    International Nuclear Information System (INIS)

    Borchers, H.J.

    1992-01-01

    Let M be a von Neumann algebra with cyclic and separating vector Ω, and let U(a) be a continuous unitary representation of R with positive generator and Ω as fixed point. If these unitaries induce for positive arguments endomorphisms of M then the modular group act as dilatations on the group of unitaries. Using this it will be shown that every theory of local observables in two dimensions, which is covariant under translations only, can be imbedded into a theory of local observables covariant under the whole Poincare group. This theory is also covariant under the CPT-transformation. (orig.)

  3. Theory of mind in schizophrenia: correlation with clinical symptomatology, emotional recognition and ward behavior.

    Science.gov (United States)

    Lee, Woo Kyeong; Kim, Yong Kyu

    2013-09-01

    Several studies have suggested the presence of a theory of mind (ToM) deficit in schizophrenic disorders. This study examined the relationship of emotion recognition, theory of mind, and ward behavior in patients with schizophrenia. Fifty-five patients with chronic schizophrenia completed measures of emotion recognition, ToM, intelligence, Positive and Negative Syndrome Scale (PANSS) and Nurse's Observation Scale for Inpatient Evaluation (NOSIE). Theory of mind sum score correlated significantly with IQ, emotion recognition, and ward behavior. Ward behavior was linked to the duration of the illness, and even more so to theory of mind deficits. Theory of mind contributed a significant proportion of the amount of variance to explain social behavior on the ward. Considering our study results, impaired theory of mind contributes significantly to the understanding of social competence in patients with schizophrenia. Copyright © 2012 Wiley Publishing Asia Pty Ltd.

  4. Localization and diagonalization. A review of functional integral techniques for low-dimensional gauge theories and topological field theories

    International Nuclear Information System (INIS)

    Blau, M.; Thompson, G.

    1995-01-01

    We review localization techniques for functional integrals which have recently been used to perform calculations in and gain insight into the structure of certain topological field theories and low-dimensional gauge theories. These are the functional integral counterparts of the Mathai-Quillen formalism, the Duistermaat-Heckman theorem, and the Weyl integral formula respectively. In each case, we first introduce the necessary mathematical background (Euler classes of vector bundles, equivariant cohomology, topology of Lie groups), and describe the finite dimensional integration formulae. We then discuss some applications to path integrals and give an overview of the relevant literature. The applications we deal with include supersymmetric quantum mechanics, cohomological field theories, phase space path integrals, and two-dimensional Yang-Mills theory. (author). 83 refs

  5. Extended Møller-Plesset perturbation theory for dynamical and static correlations

    International Nuclear Information System (INIS)

    Tsuchimochi, Takashi; Van Voorhis, Troy

    2014-01-01

    We present a novel method that appropriately handles both dynamical and static electron correlations in a balanced manner, using a perturbation theory on a spin-extended Hartree-Fock (EHF) wave function reference. While EHF is a suitable candidate for degenerate systems where static correlation is ubiquitous, it is known that most of dynamical correlation is neglected in EHF. In this work, we derive a perturbative correction to a fully spin-projected self-consistent wave function based on second-order Møller-Plesset perturbation theory (MP2). The proposed method efficiently captures the ability of EHF to describe static correlation in degeneracy, combined with MP2's ability to treat dynamical correlation effects. We demonstrate drastic improvements on molecular ground state and excited state potential energy curves and singlet-triplet splitting energies over both EHF and MP2 with similar computational effort to the latter

  6. Local vibrational modes of the water dimer - Comparison of theory and experiment

    Science.gov (United States)

    Kalescky, R.; Zou, W.; Kraka, E.; Cremer, D.

    2012-12-01

    Local and normal vibrational modes of the water dimer are calculated at the CCSD(T)/CBS level of theory. The local H-bond stretching frequency is 528 cm-1 compared to a normal mode stretching frequency of just 143 cm-1. The adiabatic connection scheme between local and normal vibrational modes reveals that the lowering is due to mass coupling, a change in the anharmonicity, and coupling with the local HOH bending modes. The local mode stretching force constant is related to the strength of the H-bond whereas the normal mode stretching force constant and frequency lead to an erroneous underestimation of the H-bond strength.

  7. Local versus nonlocal information in quantum-information theory: Formalism and phenomena

    International Nuclear Information System (INIS)

    Horodecki, Michal; Horodecki, Ryszard; Synak-Radtke, Barbara; Horodecki, Pawel; Oppenheim, Jonathan; Sen, Aditi; Sen, Ujjwal

    2005-01-01

    In spite of many results in quantum information theory, the complex nature of compound systems is far from clear. In general the information is a mixture of local and nonlocal ('quantum') information. It is important from both pragmatic and theoretical points of view to know the relationships between the two components. To make this point more clear, we develop and investigate the quantum-information processing paradigm in which parties sharing a multipartite state distill local information. The amount of information which is lost because the parties must use a classical communication channel is the deficit. This scheme can be viewed as complementary to the notion of distilling entanglement. After reviewing the paradigm in detail, we show that the upper bound for the deficit is given by the relative entropy distance to so-called pseudoclassically correlated states; the lower bound is the relative entropy of entanglement. This implies, in particular, that any entangled state is informationally nonlocal - i.e., has nonzero deficit. We also apply the paradigm to defining the thermodynamical cost of erasing entanglement. We show the cost is bounded from below by relative entropy of entanglement. We demonstrate the existence of several other nonlocal phenomena which can be found using the paradigm of local information. For example, we prove the existence of a form of nonlocality without entanglement and with distinguishability. We analyze the deficit for several classes of multipartite pure states and obtain that in contrast to the GHZ state, the Aharonov state is extremely nonlocal. We also show that there do not exist states for which the deficit is strictly equal to the whole informational content (bound local information). We discuss the relation of the paradigm with measures of classical correlations introduced earlier. It is also proved that in the one-way scenario, the deficit is additive for Bell diagonal states. We then discuss complementary features of

  8. On the local well-posedness of Lovelock and Horndeski theories

    Science.gov (United States)

    Papallo, Giuseppe; Reall, Harvey S.

    2017-08-01

    We investigate local well-posedness of the initial value problem for Lovelock and Horndeski theories of gravity. A necessary condition for local well-posedness is strong hyperbolicity of the equations of motion. Even weak hyperbolicity can fail for strong fields so we restrict to weak fields. The Einstein equation is known to be strongly hyperbolic in harmonic gauge so we study Lovelock theories in harmonic gauge. We show that the equation of motion is always weakly hyperbolic for weak fields but, in a generic weak-field background, it is not strongly hyperbolic. For Horndeski theories, we prove that, for weak fields, the equation of motion is always weakly hyperbolic in any generalized harmonic gauge. For some Horndeski theories there exists a generalized harmonic gauge for which the equation of motion is strongly hyperbolic in a weak-field background. This includes "k-essence" like theories. However, for more general Horndeski theories, there is no generalized harmonic gauge for which the equation of motion is strongly hyperbolic in a generic weak-field background. Our results show that the standard method used to establish local well-posedness of the Einstein equation does not extend to Lovelock or general Horndeski theories. This raises the possibility that these theories may not admit a well-posed initial value problem even for weak fields.

  9. Theory of heavy-fermion compounds theory of strongly correlated Fermi-systems

    CERN Document Server

    Amusia, Miron Ya; Shaginyan, Vasily R; Stephanovich, Vladimir A

    2015-01-01

    This book explains modern and interesting physics in heavy-fermion (HF) compounds to graduate students and researchers in condensed matter physics. It presents a theory of heavy-fermion (HF) compounds such as HF metals, quantum spin liquids, quasicrystals and two-dimensional Fermi systems. The basic low-temperature properties and the scaling behavior of the compounds are described within the framework of the theory of fermion condensation quantum phase transition (FCQPT). Upon reading the book, the reader finds that HF compounds with quite different microscopic nature exhibit the same non-Fermi liquid behavior, while the data collected on very different HF systems have a universal scaling behavior, and these compounds are unexpectedly uniform despite their diversity. For the reader's convenience, the analysis of compounds is carried out in the context of salient experimental results. The numerous calculations of the non-Fermi liquid behavior, thermodynamic, relaxation and transport properties, being in good...

  10. Field theories on supermanifolds: general formalism, local supersymmetry, and the limit of global supersymmetry

    International Nuclear Information System (INIS)

    Bruzzo, V.

    1986-01-01

    This paper reports briefly on recent investigations concerning the formulation of field theories on supermanifolds. The usual formulations are unsatisfactory from a mathematical viewpoint, hence, this report. A variational theory for fields on a supermanifold is described where the action is a map between Banach spaces. The relationship between the field theory on the supermanifold and a suitably constructed field theory on space-time is also discussed. On-shell local supersymmetry are examined and the limit of global (rigid) supersymmetry is considered. A specific example is given which shows that the limit reproduces the known results

  11. Feature Genes Selection Using Supervised Locally Linear Embedding and Correlation Coefficient for Microarray Classification.

    Science.gov (United States)

    Xu, Jiucheng; Mu, Huiyu; Wang, Yun; Huang, Fangzhou

    2018-01-01

    The selection of feature genes with high recognition ability from the gene expression profiles has gained great significance in biology. However, most of the existing methods have a high time complexity and poor classification performance. Motivated by this, an effective feature selection method, called supervised locally linear embedding and Spearman's rank correlation coefficient (SLLE-SC 2 ), is proposed which is based on the concept of locally linear embedding and correlation coefficient algorithms. Supervised locally linear embedding takes into account class label information and improves the classification performance. Furthermore, Spearman's rank correlation coefficient is used to remove the coexpression genes. The experiment results obtained on four public tumor microarray datasets illustrate that our method is valid and feasible.

  12. Communication: Recovering the flat-plane condition in electronic structure theory at semi-local DFT cost

    Science.gov (United States)

    Bajaj, Akash; Janet, Jon Paul; Kulik, Heather J.

    2017-11-01

    The flat-plane condition is the union of two exact constraints in electronic structure theory: (i) energetic piecewise linearity with fractional electron removal or addition and (ii) invariant energetics with change in electron spin in a half filled orbital. Semi-local density functional theory (DFT) fails to recover the flat plane, exhibiting convex fractional charge errors (FCE) and concave fractional spin errors (FSE) that are related to delocalization and static correlation errors. We previously showed that DFT+U eliminates FCE but now demonstrate that, like other widely employed corrections (i.e., Hartree-Fock exchange), it worsens FSE. To find an alternative strategy, we examine the shape of semi-local DFT deviations from the exact flat plane and we find this shape to be remarkably consistent across ions and molecules. We introduce the judiciously modified DFT (jmDFT) approach, wherein corrections are constructed from few-parameter, low-order functional forms that fit the shape of semi-local DFT errors. We select one such physically intuitive form and incorporate it self-consistently to correct semi-local DFT. We demonstrate on model systems that jmDFT represents the first easy-to-implement, no-overhead approach to recovering the flat plane from semi-local DFT.

  13. Relativistic local quantum field theory for m=0 particles; Campos cuanticos locales relativos a particulas de masa no nula

    Energy Technology Data Exchange (ETDEWEB)

    Morales Villasevil, A

    1965-07-01

    A method is introduced ta deal with relativistic quantum field theory for particles with m=0. Two mappings I and J, giving rise respectively to particle and anti particle states, are defined between a test space and the physical Hilbert space. The intrinsic field operator is then defined as the minimal causal linear combinations of operators belonging to the annihilation-creation algebra associated to the germ and antigerm parts of the element. Local elements are introduced as improper test elements and local field operators are constructed in the same way as the intrinsic ones. Commutation rules are given. (Author) 17 refs.

  14. Bleed-through correction for rendering and correlation analysis in multi-colour localization microscopy

    International Nuclear Information System (INIS)

    Kim, Dahan; Curthoys, Nikki M; Parent, Matthew T; Hess, Samuel T

    2013-01-01

    Multi-colour localization microscopy has enabled sub-diffraction studies of colocalization between multiple biological species and quantification of their correlation at length scales previously inaccessible with conventional fluorescence microscopy. However, bleed-through, or misidentification of probe species, creates false colocalization and artificially increases certain types of correlation between two imaged species, affecting the reliability of information provided by colocalization and quantified correlation. Despite the potential risk of these artefacts of bleed-through, neither the effect of bleed-through on correlation nor methods for its correction in correlation analyses have been systematically studied at typical rates of bleed-through reported to affect multi-colour imaging. Here, we present a reliable method of bleed-through correction applicable to image rendering and correlation analysis of multi-colour localization microscopy. Application of our bleed-through correction shows that our method accurately corrects the artificial increase in both types of correlation studied (Pearson coefficient and pair correlation), at all rates of bleed-through tested, in all types of correlation examined. In particular, anti-correlation could not be quantified without our bleed-through correction, even at rates of bleed-through as low as 2%. While it is demonstrated with dichroic-based multi-colour FPALM here, our presented method of bleed-through correction can be applied to all types of localization microscopy (PALM, STORM, dSTORM, GSDIM, etc), including both simultaneous and sequential multi-colour modalities, provided the rate of bleed-through can be reliably determined. (special issue article)

  15. δ expansion for local gauge theories. I. A one-dimensional model

    International Nuclear Information System (INIS)

    Bender, C.M.; Cooper, F.; Milton, K.A.; Moshe, M.; Pinsky, S.S.; Simmons, L.M. Jr.

    1992-01-01

    The principles of the δ perturbation theory were first proposed in the context of self-interacting scalar quantum field theory. There it was shown how to expand a (φ 2 ) 1+δ theory as a series in powers of δ and how to recover nonperturbative information about a φ 4 field theory from the δ expansion at δ=1. The purpose of this series of papers is to extend the notions of δ perturbation theory from boson theories to theories having a local gauge symmetry. In the case of quantum electrodynamics one introduces the parameter δ by generalizing the minimal coupling terms to bar ψ(∂-ieA) δ ψ and expanding in powers of δ. This interaction preserves local gauge invariance for all δ. While there are enormous benefits in using the δ expansion (obtaining nonperturbative results), gauge theories present new technical difficulties not encountered in self-interacting boson theories because the expression (∂-ieA) δ contains a derivative operator. In the first paper of this series a one-dimensional model whose interaction term has the form bar ψ[d/dt-igφ(t)] δ ψ is considered. The virtue of this model is that it provides a laboratory in which to study fractional powers of derivative operators without the added complexity of γ matrices. In the next paper of this series we consider two-dimensional electrodynamics and show how to calculate the anomaly in the δ expansion

  16. Extending the random-phase approximation for electronic correlation energies: the renormalized adiabatic local density approximation

    DEFF Research Database (Denmark)

    Olsen, Thomas; Thygesen, Kristian S.

    2012-01-01

    The adiabatic connection fluctuation-dissipation theorem with the random phase approximation (RPA) has recently been applied with success to obtain correlation energies of a variety of chemical and solid state systems. The main merit of this approach is the improved description of dispersive forces...... while chemical bond strengths and absolute correlation energies are systematically underestimated. In this work we extend the RPA by including a parameter-free renormalized version of the adiabatic local-density (ALDA) exchange-correlation kernel. The renormalization consists of a (local) truncation...... of the ALDA kernel for wave vectors q > 2kF, which is found to yield excellent results for the homogeneous electron gas. In addition, the kernel significantly improves both the absolute correlation energies and atomization energies of small molecules over RPA and ALDA. The renormalization can...

  17. Stress-stress correlator in ϕ 4 theory: poles or a cut?

    Science.gov (United States)

    Moore, Guy D.

    2018-05-01

    We explore the analytical properties of the traceless stress tensor 2-point function at zero momentum and small frequency (relevant for shear viscosity and hydrodynamic response) in hot, weakly coupled λ ϕ 4 theory. We show that, rather than one or a small number of poles, the correlator has a cut along the negative imaginary frequency axis. We briefly discuss this result's relevance for constructing 2'nd order hydrodynamic models of hot relativistic field theories.

  18. Evolutionary theory of ageing and the problem of correlated Gompertz parameters.

    Science.gov (United States)

    Burger, Oskar; Missov, Trifon I

    2016-11-07

    The Gompertz mortality model is often used to evaluate evolutionary theories of ageing, such as the Medawar-Williams' hypothesis that high extrinsic mortality leads to faster ageing. However, fits of the Gompertz mortality model to data often find the opposite result that mortality is negatively correlated with the rate of ageing. This negative correlation has been independently discovered in several taxa and is known in actuarial studies of ageing as the Strehler-Mildvan correlation. We examine the role of mortality selection in determining late-life variation in susceptibility to death, which has been suggested to be the cause of this negative correlation. We demonstrate that fixed-frailty models that account for heterogeneity in frailty do not remove the correlation and that the correlation is an inherent statistical property of the Gompertz distribution. Linking actuarial and biological rates of ageing will continue to be a pressing challenge, but the Strehler-Mildvan correlation itself should not be used to diagnose any biological, physiological, or evolutionary process. These findings resolve some key tensions between theory and data that affect evolutionary and biological studies of ageing and mortality. Tests of evolutionary theories of ageing should include direct measures of physiological performance or condition. Copyright © 2016 Elsevier Ltd. All rights reserved.

  19. Local indicators of geocoding accuracy (LIGA: theory and application

    Directory of Open Access Journals (Sweden)

    Jacquez Geoffrey M

    2009-10-01

    Full Text Available Abstract Background Although sources of positional error in geographic locations (e.g. geocoding error used for describing and modeling spatial patterns are widely acknowledged, research on how such error impacts the statistical results has been limited. In this paper we explore techniques for quantifying the perturbability of spatial weights to different specifications of positional error. Results We find that a family of curves describes the relationship between perturbability and positional error, and use these curves to evaluate sensitivity of alternative spatial weight specifications to positional error both globally (when all locations are considered simultaneously and locally (to identify those locations that would benefit most from increased geocoding accuracy. We evaluate the approach in simulation studies, and demonstrate it using a case-control study of bladder cancer in south-eastern Michigan. Conclusion Three results are significant. First, the shape of the probability distributions of positional error (e.g. circular, elliptical, cross has little impact on the perturbability of spatial weights, which instead depends on the mean positional error. Second, our methodology allows researchers to evaluate the sensitivity of spatial statistics to positional accuracy for specific geographies. This has substantial practical implications since it makes possible routine sensitivity analysis of spatial statistics to positional error arising in geocoded street addresses, global positioning systems, LIDAR and other geographic data. Third, those locations with high perturbability (most sensitive to positional error and high leverage (that contribute the most to the spatial weight being considered will benefit the most from increased positional accuracy. These are rapidly identified using a new visualization tool we call the LIGA scatterplot. Herein lies a paradox for spatial analysis: For a given level of positional error increasing sample density

  20. Development of generalized correlation equation for the local wall shear stress

    International Nuclear Information System (INIS)

    Jeon, Yu Mi; Bae, Jun Ho; Park, Joo Hwan

    2010-01-01

    The pressure drop characteristics for a fuel channel are essential for the design and reliable operation of a nuclear reactor. Over several decades, analytical methods have been developed to predict the friction factor in the fuel bundle flows. In order to enhance the accuracy of prediction for the pressure drop in a rod bundle, the influences of a channel wall and the local shear stress distribution should be considered. Hence, the correlation equation for a local shear stress distribution should be developed in order to secure an analytical solution for the friction factor of a rod bundle. For a side subchannel, which has the influence of the channel wall, the local shear stress distribution is dependent on the ratio of wall to diameter (W/D) as well as the ratio of pitch to diameter (P/D). In the case that W/D has the same value with P/D, the local shear stress distribution can be simply correlated with the function of angular position for each value of P/D. While, in the case that W/D has the different value with P/D, the correlation equation should be developed for each case of P/D and W/D. Hence, in the present study, the generalized correlation equation of a local shear stress distribution is developed for a side subchannel in the case that W/D has the different value with P/D

  1. Local extinction and the evolution of dispersal rates: Causes and correlations

    OpenAIRE

    Poethke, Hans-Joachim; Hovestadt, Thomas; Mitesser, Oliver

    2010-01-01

    We present the results of individual-based simulation experiments on the evolution of dispersal rates of organisms living in metapopulations. We find conflicting results regarding the relationship between local extinction rate and evolutionarily stable (ES) dispersal rate depending on which principal mechanism causes extinction: if extinction is caused by environmental catastrophes eradicating local populations, we observe a positive correlation between extinction and ES dispersal rate; if ex...

  2. Local Genetic Correlation Gives Insights into the Shared Genetic Architecture of Complex Traits.

    Science.gov (United States)

    Shi, Huwenbo; Mancuso, Nicholas; Spendlove, Sarah; Pasaniuc, Bogdan

    2017-11-02

    Although genetic correlations between complex traits provide valuable insights into epidemiological and etiological studies, a precise quantification of which genomic regions disproportionately contribute to the genome-wide correlation is currently lacking. Here, we introduce ρ-HESS, a technique to quantify the correlation between pairs of traits due to genetic variation at a small region in the genome. Our approach requires GWAS summary data only and makes no distributional assumption on the causal variant effect sizes while accounting for linkage disequilibrium (LD) and overlapping GWAS samples. We analyzed large-scale GWAS summary data across 36 quantitative traits, and identified 25 genomic regions that contribute significantly to the genetic correlation among these traits. Notably, we find 6 genomic regions that contribute to the genetic correlation of 10 pairs of traits that show negligible genome-wide correlation, further showcasing the power of local genetic correlation analyses. Finally, we report the distribution of local genetic correlations across the genome for 55 pairs of traits that show putative causal relationships. Copyright © 2017 American Society of Human Genetics. Published by Elsevier Inc. All rights reserved.

  3. Local normalization: Uncovering correlations in non-stationary financial time series

    Science.gov (United States)

    Schäfer, Rudi; Guhr, Thomas

    2010-09-01

    The measurement of correlations between financial time series is of vital importance for risk management. In this paper we address an estimation error that stems from the non-stationarity of the time series. We put forward a method to rid the time series of local trends and variable volatility, while preserving cross-correlations. We test this method in a Monte Carlo simulation, and apply it to empirical data for the S&P 500 stocks.

  4. Comparisons of perturbation and integral equation theories for the angular pair correlation function in molecular fluids

    International Nuclear Information System (INIS)

    Murad, S.; Gubbins, K.E.; Gray, C.G.

    1983-01-01

    We compare several recently proposed theories for the angular pair correlation function g(rω 1 ω 2 ), including first- and second-order perturbation theory (the u-expansion), a Pade approximant to this series, first-order f-expansion, the single superchain, generalized mean field, linearized hypernetted chain, and quadratic hypernetted chain approximations. Numerical results from these theories are compared with available computer simulation data for four model fluids whose intermolecular pair potential is of the form u 0 +usub(a), where u 0 is a hard-sphere of Lennard-Jones model, while usub(a) is a dipole-dipole or quadrupole-quadrupole interaction; we refer to these model fluids as HS+μμ, HS+QQ, LJ+μμ, and LJ+QQ. Properties studied include the angular pair correlation function and its spherical harmonic components, the thermodynamic properties, and the angular correlation parameters G 1 and G 2 that are related to the dielectric and Kerr constants. The second-order perturbation theory is superior to the integral equation theories for the thermodynamic harmonics of g(rω 1 ω 2 ) and for the thermodynamic properties themselves at moderate multipole strengths. For other harmonics and properties, the integral equation theories are better, with the quadratic hypernetted chain approximation being the best overall. (orig.)

  5. Vasoconstriction Potency Induced by Aminoamide Local Anesthetics Correlates with Lipid Solubility

    Directory of Open Access Journals (Sweden)

    Hui-Jin Sung

    2012-01-01

    Full Text Available Aminoamide local anesthetics induce vasoconstriction in vivo and in vitro. The goals of this in vitro study were to investigate the potency of local anesthetic-induced vasoconstriction and to identify the physicochemical property (octanol/buffer partition coefficient, pKa, molecular weight, or potency of local anesthetics that determines their potency in inducing isolated rat aortic ring contraction. Cumulative concentration-response curves to local anesthetics (levobupivacaine, ropivacaine, lidocaine, and mepivacaine were obtained from isolated rat aorta. Regression analyses were performed to determine the relationship between the reported physicochemical properties of local anesthetics and the local anesthetic concentration that produced 50% (ED50 of the local anesthetic-induced maximum vasoconstriction. We determined the order of potency (ED50 of vasoconstriction among local anesthetics to be levobupivacaine > ropivacaine > lidocaine > mepivacaine. The relative importance of the independent variables that affect the vasoconstriction potency is octanol/buffer partition coefficient > potency > pKa > molecular weight. The ED50 in endothelium-denuded aorta negatively correlated with the octanol/buffer partition coefficient of local anesthetics (r2=0.9563; P<0.001. The potency of the vasoconstriction in the endothelium-denuded aorta induced by local anesthetics is determined primarily by lipid solubility and, in part, by other physicochemical properties including potency and pKa.

  6. Energy momentum tensor and operator product expansion in local causal perturbation theory

    International Nuclear Information System (INIS)

    Prange, D.

    2000-09-01

    We derive new examples for algebraic relations of interacting fields in local perturbative quantum field theory. The fundamental building blocks in this approach are time ordered products of free (composed) fields. We give explicit formulas for the construction of Poincare covariant ones, which were already known to exist through cohomological arguments. For a large class of theories the canonical energy momentum tensor is shown to be conserved. Classical theories without dimensionful couplings admit an improved tensor that is additionally traceless. On the example of φ 4 -theory we discuss the improved tensor in the quantum theory. Its trace receives an anomalous contribution due to its conservation. Moreover, we define an interacting bilocal normal product for scalar theories. This leads to an operator product expansion of two time ordered fields. (orig.) [de

  7. Four-point correlation function of stress-energy tensors in N=4 superconformal theories

    CERN Document Server

    Korchemsky, G P

    2015-01-01

    We derive the explicit expression for the four-point correlation function of stress-energy tensors in four-dimensional N=4 superconformal theory. We show that it has a remarkably simple and suggestive form allowing us to predict a large class of four-point correlation functions involving the stress-energy tensor and other conserved currents. We then apply the obtained results on the correlation functions to computing the energy-energy correlations, which measure the flow of energy in the final states created from the vacuum by a source. We demonstrate that they are given by a universal function independent of the choice of the source. Our analysis relies only on N=4 superconformal symmetry and does not use the dynamics of the theory.

  8. Communication: A Jastrow factor coupled cluster theory for weak and strong electron correlation

    International Nuclear Information System (INIS)

    Neuscamman, Eric

    2013-01-01

    We present a Jastrow-factor-inspired variant of coupled cluster theory that accurately describes both weak and strong electron correlation. Compatibility with quantum Monte Carlo allows for variational energy evaluations and an antisymmetric geminal power reference, two features not present in traditional coupled cluster that facilitate a nearly exact description of the strong electron correlations in minimal-basis N 2 bond breaking. In double-ζ treatments of the HF and H 2 O bond dissociations, where both weak and strong correlations are important, this polynomial cost method proves more accurate than either traditional coupled cluster or complete active space perturbation theory. These preliminary successes suggest a deep connection between the ways in which cluster operators and Jastrow factors encode correlation

  9. Development of Generalized Correlation Equation for the Local Wall Shear Stress

    International Nuclear Information System (INIS)

    Jeon, Yu Mi; Park, Ju Hwan

    2010-06-01

    The pressure drop characteristics for a fuel channel are essential for the design and reliable operation of a nuclear reactor. Over several decades, analytical methods have been developed to predict the friction factor in the fuel bundle flows. In order to enhance the accuracy of prediction for the pressure drop in a rod bundle, the influences of a channel wall and the local shear stress distribution should be considered. Therefore, the correlation equation for a local wall shear stress distribution should be developed in order to secure an analytical solution for the friction factor of a rod bundle. For a side subchannel, which has the influence of the channel wall, the local wall shear stress distribution is dependent on the ratio of wall to diameter (W/D) as well as the ratio of pitch to diameter (P/D). In the case that W/D has the same value with P/D, the local shear stress distribution can be simply correlated with the function of angular position for each value of P/D. While in the case where W/D has a different value than P/D, the correlation equation should be developed for each case of P/D and W/D. Therefore, in the present study, the generalized correlation equation of the local wall shear stress distribution was developed for a side subchannel in the case where W/D has a different value than P/D. Consequently, the generalized correlation equation of a local wall shear stress distribution can be represented by the equivalent pitch to diameter ratio, P'/D for the case that P/D and W/D had a different value

  10. Nuclear many-body correlation dynamics--a nonperturbative approach in quantum many-body theory

    International Nuclear Information System (INIS)

    Wang Shunjin

    1996-01-01

    Based on the experimental results and theoretical experience in nuclear physics, the article has explored the basic physical ideas and theoretical methods in nuclear and quantum many-body correlation dynamics. The main theoretical results and important applications are introduced briefly. The paper addresses the fundamental ingredients and physical interpretation of theoretical results in a comprehensive way. Recent new results about correlation dynamics in quantum field theories are also presented. The perspectives of further application are viewed. (91 refs.)

  11. Localization of Bogoliubov quasiparticles in interacting Bose gases with correlated disorder

    International Nuclear Information System (INIS)

    Lugan, P.; Sanchez-Palencia, L.

    2011-01-01

    We study the Anderson localization of Bogoliubov quasiparticles (elementary many-body excitations) in a weakly interacting Bose gas of chemical potential μ subjected to a disordered potential V. We introduce a general mapping (valid for weak inhomogeneous potentials in any dimension) of the Bogoliubov-de Gennes equations onto a single-particle Schroedinger-like equation with an effective potential. For disordered potentials, the Schroedinger-like equation accounts for the scattering and localization properties of the Bogoliubov quasiparticles. We derive analytically the localization lengths for correlated disordered potentials in the one-dimensional geometry. Our approach relies on a perturbative expansion in V/μ, which we develop up to third order, and we discuss the impact of the various perturbation orders. Our predictions are shown to be in very good agreement with direct numerical calculations. We identify different localization regimes: For low energy, the effective disordered potential exhibits a strong screening by the quasicondensate density background, and localization is suppressed. For high-energy excitations, the effective disordered potential reduces to the bare disordered potential, and the localization properties of quasiparticles are the same as for free particles. The maximum of localization is found at intermediate energy when the quasicondensate healing length is of the order of the disorder correlation length. Possible extensions of our work to higher dimensions are also discussed.

  12. Coral reef degradation is not correlated with local human population density

    Science.gov (United States)

    Bruno, John F.; Valdivia, Abel

    2016-07-01

    The global decline of reef-building corals is understood to be due to a combination of local and global stressors. However, many reef scientists assume that local factors predominate and that isolated reefs, far from human activities, are generally healthier and more resilient. Here we show that coral reef degradation is not correlated with human population density. This suggests that local factors such as fishing and pollution are having minimal effects or that their impacts are masked by global drivers such as ocean warming. Our results also suggest that the effects of local and global stressors are antagonistic, rather than synergistic as widely assumed. These findings indicate that local management alone cannot restore coral populations or increase the resilience of reefs to large-scale impacts. They also highlight the truly global reach of anthropogenic warming and the immediate need for drastic and sustained cuts in carbon emissions.

  13. Random matrix theory analysis of cross-correlations in the US stock market: Evidence from Pearson’s correlation coefficient and detrended cross-correlation coefficient

    Science.gov (United States)

    Wang, Gang-Jin; Xie, Chi; Chen, Shou; Yang, Jiao-Jiao; Yang, Ming-Yan

    2013-09-01

    In this study, we first build two empirical cross-correlation matrices in the US stock market by two different methods, namely the Pearson’s correlation coefficient and the detrended cross-correlation coefficient (DCCA coefficient). Then, combining the two matrices with the method of random matrix theory (RMT), we mainly investigate the statistical properties of cross-correlations in the US stock market. We choose the daily closing prices of 462 constituent stocks of S&P 500 index as the research objects and select the sample data from January 3, 2005 to August 31, 2012. In the empirical analysis, we examine the statistical properties of cross-correlation coefficients, the distribution of eigenvalues, the distribution of eigenvector components, and the inverse participation ratio. From the two methods, we find some new results of the cross-correlations in the US stock market in our study, which are different from the conclusions reached by previous studies. The empirical cross-correlation matrices constructed by the DCCA coefficient show several interesting properties at different time scales in the US stock market, which are useful to the risk management and optimal portfolio selection, especially to the diversity of the asset portfolio. It will be an interesting and meaningful work to find the theoretical eigenvalue distribution of a completely random matrix R for the DCCA coefficient because it does not obey the Marčenko-Pastur distribution.

  14. Variational local moment approach: From Kondo effect to Mott transition in correlated electron systems

    International Nuclear Information System (INIS)

    Kauch, Anna; Byczuk, Krzysztof

    2012-01-01

    The variational local moment approach (VLMA) solution of the single impurity Anderson model is presented. It generalizes the local moment approach of Logan et al. by invoking the variational principle to determine the lengths of local moments and orbital occupancies. We show that VLMA is a comprehensive, conserving and thermodynamically consistent approximation and treats both Fermi and non-Fermi liquid regimes as well as local moment phases on equal footing. We tested VLMA on selected problems. We solved the single- and multi-orbital impurity Anderson model in various regions of parameters, where different types of Kondo effects occur. The application of VLMA as an impurity solver of the dynamical mean-field theory, used to solve the multi-orbital Hubbard model, is also addressed.

  15. Probing the structural and dynamical properties of liquid water with models including non-local electron correlation

    International Nuclear Information System (INIS)

    Del Ben, Mauro; Hutter, Jürg; VandeVondele, Joost

    2015-01-01

    Water is a ubiquitous liquid that displays a wide range of anomalous properties and has a delicate structure that challenges experiment and simulation alike. The various intermolecular interactions that play an important role, such as repulsion, polarization, hydrogen bonding, and van der Waals interactions, are often difficult to reproduce faithfully in atomistic models. Here, electronic structure theories including all these interactions at equal footing, which requires the inclusion of non-local electron correlation, are used to describe structure and dynamics of bulk liquid water. Isobaric-isothermal (NpT) ensemble simulations based on the Random Phase Approximation (RPA) yield excellent density (0.994 g/ml) and fair radial distribution functions, while various other density functional approximations produce scattered results (0.8-1.2 g/ml). Molecular dynamics simulation in the microcanonical (NVE) ensemble based on Møller-Plesset perturbation theory (MP2) yields dynamical properties in the condensed phase, namely, the infrared spectrum and diffusion constant. At the MP2 and RPA levels of theory, ice is correctly predicted to float on water, resolving one of the anomalies as resulting from a delicate balance between van der Waals and hydrogen bonding interactions. For several properties, obtaining quantitative agreement with experiment requires correction for nuclear quantum effects (NQEs), highlighting their importance, for structure, dynamics, and electronic properties. A computed NQE shift of 0.6 eV for the band gap and absorption spectrum illustrates the latter. Giving access to both structure and dynamics of condensed phase systems, non-local electron correlation will increasingly be used to study systems where weak interactions are of paramount importance

  16. S-pairing in neutron matter: I. Correlated basis function theory

    International Nuclear Information System (INIS)

    Fabrocini, Adelchi; Fantoni, Stefano; Illarionov, Alexey Yu.; Schmidt, Kevin E.

    2008-01-01

    S-wave pairing in neutron matter is studied within an extension of correlated basis function (CBF) theory to include the strong, short range spatial correlations due to realistic nuclear forces and the pairing correlations of the Bardeen, Cooper and Schrieffer (BCS) approach. The correlation operator contains central as well as tensor components. The correlated BCS scheme of [S. Fantoni, Nucl. Phys. A 363 (1981) 381], developed for simple scalar correlations, is generalized to this more realistic case. The energy of the correlated pair condensed phase of neutron matter is evaluated at the two-body order of the cluster expansion, but considering the one-body density and the corresponding energy vertex corrections at the first order of the Power Series expansion. Based on these approximations, we have derived a system of Euler equations for the correlation factors and for the BCS amplitudes, resulting in correlated nonlinear gap equations, formally close to the standard BCS ones. These equations have been solved for the momentum independent part of several realistic potentials (Reid, Argonne v 14 and Argonne v 8 ' ) to stress the role of the tensor correlations and of the many-body effects. Simple Jastrow correlations and/or the lack of the density corrections enhance the gap with respect to uncorrelated BCS, whereas it is reduced according to the strength of the tensor interaction and following the inclusion of many-body contributions

  17. Discrete gravity as a local theory of the Poincare group in the first-order formalism

    Energy Technology Data Exchange (ETDEWEB)

    Gionti, Gabriele [Vatican Observatory Research Group, Steward Observatory, 933 North Cherry Avenue, University of Arizona, Tucson, AZ 85721 (United States); Specola Vaticana, V-00120 Citta Del Vaticano (Vatican City State, Holy See,)

    2005-10-21

    A discrete theory of gravity, locally invariant under the Poincare group, is considered as in a companion paper. We define a first-order theory, in the sense of Palatini, on the metric-dual Voronoi complex of a simplicial complex. We follow the same spirit as the continuum theory of general relativity in the Cartan formalism. The field equations are carefully derived taking in account the constraints of the theory. They look very similar to first-order Einstein continuum equations in the Cartan formalism. It is shown that in the limit of small deficit angles these equations have Regge calculus, locally, as the only solution. A quantum measure is easily defined which does not suffer the ambiguities of Regge calculus, and a coupling with fermionic matter is easily introduced.

  18. Discrete gravity as a local theory of the Poincare group in the first-order formalism

    International Nuclear Information System (INIS)

    Gionti, Gabriele

    2005-01-01

    A discrete theory of gravity, locally invariant under the Poincare group, is considered as in a companion paper. We define a first-order theory, in the sense of Palatini, on the metric-dual Voronoi complex of a simplicial complex. We follow the same spirit as the continuum theory of general relativity in the Cartan formalism. The field equations are carefully derived taking in account the constraints of the theory. They look very similar to first-order Einstein continuum equations in the Cartan formalism. It is shown that in the limit of small deficit angles these equations have Regge calculus, locally, as the only solution. A quantum measure is easily defined which does not suffer the ambiguities of Regge calculus, and a coupling with fermionic matter is easily introduced

  19. The status and prospects of quantum non-local field theory

    International Nuclear Information System (INIS)

    Cornish, N.J.; Melbourne Univ., Parkville

    1991-01-01

    A critical review of the physical constraints on the form the non-locality can take is presented. The conclusion of this review is that non-locality must be restricted to interactions with the vacuum sea of virtual particles. A successful formulation of such a theory, Quantum Nonlocal Field Theory (QNFT), is applied to scalar electrodynamics and serves to illustrate how gauge invariance and manifest finiteness can be achieved. The importance of the infinite dimensional symmetry groups that occur in QNFT are discussed as an alternative to supersymmetry, the ability to generate masses by breaking the non-local symmetry with a non-invariant functional measure is given a critical assessment. To demonstrate some of the many novel applications QNFT may make possible, three disparate examples are mooted, the existence of electroweak monopoles, an mechanism for CP violation and the formulation of a finite perturbative theory of Quantum Gravity. 21 refs., ills

  20. Tensions between Scottish National Policies for onshore wind energy and local dissatisfaction - insights from regulation theory

    Energy Technology Data Exchange (ETDEWEB)

    Parkhill, Karen [School of Psychology, Tower Building, Cardiff University, Cardiff, (United Kingdom)

    2007-09-15

    Although best described as a meta theory addressing the endurance of capitalism, regulation theory can successfully be used to explore not only the economic dimensions, but also the political, socio-cultural and environmental dimensions of particular developmental strategies. Thus, it offers a framework for embedding abstract debates about social attitudes to new technologies within debates about real regulation - the economic, social and cultural relationships operating through particular places. This paper uses regulation theory and qualitative, interview-based data to analyse Scotland's drive for onshore wind energy. This approach teases out how responses to wind farms are bound up with wider debates about how rural spaces are, and should be, regulated; the tensions within and between national political objectives, local political objectives and local communities' dissatisfaction; and the connections between local actors and more formal dimensions of renewable energy policy. (Author)

  1. Study of rare earth local moment magnetism and strongly correlated phenomena in various crystal structures

    Energy Technology Data Exchange (ETDEWEB)

    Kong, Tai [Iowa State Univ., Ames, IA (United States)

    2016-12-17

    Benefiting from unique properties of 4f electrons, rare earth based compounds are known for offering a versatile playground for condensed matter physics research as well as industrial applications. This thesis focuses on three specific examples that further explore the rare earth local moment magnetism and strongly correlated phenomena in various crystal structures.

  2. Local Correlation during Ostwald ripening of two-dimensional islands on Ag(111)

    NARCIS (Netherlands)

    Morgenstern, Karina; Rosenfeld, G.; Comsa, George

    1999-01-01

    Using two-dimensional Ag adatom islands on Ag(111) as a model system, we study the importance of local correlations in diffusion-limited Ostwald ripening. For the coverages studied (0.08, 0.21, and 0.3 ML), we find that the ripening can be surprisingly well described in a nearest neighbour model

  3. Modular localization and the holistic structure of causal quantum theory, a historical perspective

    International Nuclear Information System (INIS)

    Schroer, Bert

    2014-01-01

    Recent insights into the conceptual structure of localization in QFT ('modular localization') led to clarifications of old unsolved problems. The oldest one is the Einstein-Jordan conundrum which led Jordan in 1925 to the discovery of quantum field theory. This comparison of fluctuations in subsystems of heat bath systems (Einstein) with those resulting from the restriction of the QFT vacuum state to an open subvolume (Jordan) leads to a perfect analogy; the globally pure vacuum state becomes upon local restriction a strongly impure KMS state. This phenomenon of localization-caused thermal behavior as well as the vacuum-polarization clouds at the causal boundary of the localization region places localization in QFT into a sharp contrast with quantum mechanics and justifies the attribute 'holstic'. In fact it positions the E-J Gedankenexperiment into the same conceptual category as the cosmological constant problem and the Unruh Gedankenexperiment. The holistic structure of QFT resulting from 'modular localization' also leads to a revision of the conceptual origin of the crucial crossing property which entered particle theory at the time of the bootstrap S-matrix approach but suffered from incorrect use in the S-matrix settings of the dual model and string theory. The new holistic point of view, which strengthens the autonomous aspect of QFT, also comes with new messages for gauge theory by exposing the clash between Hilbert space structure and localization and presenting alternative solutions based on the use of string local fields in Hilbert space. Among other things this leads to a radical reformulation of the Englert-Higgs symmetry breaking mechanism. (author)

  4. Spontaneous breaking of N=2 to N=1 in rigid and local supersymmetric theories

    CERN Document Server

    Ferrara, Sergio; Porrati, Massimo

    1996-01-01

    We analyze the relation between rigid and local supersymmetric N=2 field theories, when half of the supersymmetries are spontaneously broken. In particular, we show that the recently found partial supersymmety breaking induced by electric and magnetic Fayet-Iliopoulos terms in rigid theories can be obtained by a suitable flat limit of previously constructed N=2 supergravity models with partial super-Higgs in the observable sector.

  5. Examining the impact of harmonic correlation on vibrational frequencies calculated in localized coordinates

    Energy Technology Data Exchange (ETDEWEB)

    Hanson-Heine, Magnus W. D., E-mail: magnus.hansonheine@nottingham.ac.uk [School of Chemistry, University of Nottingham, University Park, Nottingham NG7 2RD (United Kingdom)

    2015-10-28

    Carefully choosing a set of optimized coordinates for performing vibrational frequency calculations can significantly reduce the anharmonic correlation energy from the self-consistent field treatment of molecular vibrations. However, moving away from normal coordinates also introduces an additional source of correlation energy arising from mode-coupling at the harmonic level. The impact of this new component of the vibrational energy is examined for a range of molecules, and a method is proposed for correcting the resulting self-consistent field frequencies by adding the full coupling energy from connected pairs of harmonic and pseudoharmonic modes, termed vibrational self-consistent field (harmonic correlation). This approach is found to lift the vibrational degeneracies arising from coordinate optimization and provides better agreement with experimental and benchmark frequencies than uncorrected vibrational self-consistent field theory without relying on traditional correlated methods.

  6. Generalized extended Navier-Stokes theory: correlations in molecular fluids with intrinsic angular momentum.

    Science.gov (United States)

    Hansen, J S; Daivis, Peter J; Dyre, Jeppe C; Todd, B D; Bruus, Henrik

    2013-01-21

    The extended Navier-Stokes theory accounts for the coupling between the translational and rotational molecular degrees of freedom. In this paper, we generalize this theory to non-zero frequencies and wavevectors, which enables a new study of spatio-temporal correlation phenomena present in molecular fluids. To discuss these phenomena in detail, molecular dynamics simulations of molecular chlorine are performed for three different state points. In general, the theory captures the behavior for small wavevector and frequencies as expected. For example, in the hydrodynamic regime and for molecular fluids with small moment of inertia like chlorine, the theory predicts that the longitudinal and transverse intrinsic angular velocity correlation functions are almost identical, which is also seen in the molecular dynamics simulations. However, the theory fails at large wavevector and frequencies. To account for the correlations at these scales, we derive a phenomenological expression for the frequency dependent rotational viscosity and wavevector and frequency dependent longitudinal spin viscosity. From this we observe a significant coupling enhancement between the molecular angular velocity and translational velocity for large frequencies in the gas phase; this is not observed for the supercritical fluid and liquid state points.

  7. Multicultural adolescents between tradition and postmodernity: Dialogical Self Theory and the paradox of localization and globalization.

    Science.gov (United States)

    van Meijl, Toon

    2012-01-01

    This chapter builds on Dialogical Self Theory to investigate the identity development of adolescents growing up in multicultural societies. Their cultural identity is not only compounded by the rapid cultural changes associated with globalization, but also by the paradoxical revival of cultural traditions which the large-scale compression of time and space has incited at local levels of society. Dialogical Self Theory, which is based on the metaphor of the self as a "society of mind," helps to understand the dilemmas of tradition and postmodernity, of localization and globalization, within the self of individual youngsters. Copyright © 2012 Wiley Periodicals, Inc., A Wiley Company.

  8. Local field theory on κ-Minkowski space, star products and noncommutative translations

    International Nuclear Information System (INIS)

    Kosinski, P.; Maslanka, P.; Lukierski, J.

    2000-01-01

    We consider local field theory on κ-deformed Minkowski space which is an example of solvable Lie-algebraic noncommutative structure. Using integration formula over κ-Minkowski space and κ-deformed Fourier transform, we consider for deformed local fields the reality conditions as well as deformation of action functionals in standard Minkowski space. We present explicit formulas for two equivalent star products describing CBH quantization of field theory on κ-Minkowski space. We express also via star product technique the noncommutative translations in κ-Minkowski space by commutative translations in standard Minkowski space. (author)

  9. Statistical electron angular correlation coefficients for atoms within the Hohenberg-Kohn-Sham theory

    International Nuclear Information System (INIS)

    Pathak, R.K.

    1985-01-01

    Statistical electron angular correlation coefficients tau = 2 2 He through 14 Si, within the Hohenberg-Kohn-Sham density-functional formalism. These are computed with use of the spectral sum rules obtained from the pseudoexcitation spectrum employing the recent formulation of the time-dependent Kohn-Sham theory due to Bartolotti. Various approximations to the exchange-correlation energy functional are used and for first-row atoms, a comparison is made with the highly accurate correlation coefficients recently obtained by Thakkar. The present tau values show closer agreement with those of Thakkar with increasing number of electrons

  10. Correlation functions of the energy-momentum tensor in SU(2) gauge theory at finite temperature

    DEFF Research Database (Denmark)

    Huebner, K.; Karsch, F.; Pica, Claudio

    2008-01-01

    We calculate correlation functions of the energy-momentum tensor in the vicinity of the deconfinement phase transition of (3+1)-dimensional SU(2) gauge theory and discuss their critical behavior in the vicinity of the second order deconfinement transition. We show that correlation functions...... of the trace of the energy momentum tensor diverge uniformly at the critical point in proportion to the specific heat singularity. Correlation functions of the pressure, on the other hand, stay finite at the critical point. We discuss the consequences of these findings for the analysis of transport...... coefficients, in particular the bulk viscosity, in the vicinity of a second order phase transition point....

  11. Spontaneous symmetry breaking in local gauge quantum field theory; the Higgs mechanism

    International Nuclear Information System (INIS)

    Strocchi, F.

    1977-01-01

    Spontaneous symmetry breakings in indefinite metric quantum field theories are analyzed and a generalization of the Goldstone theorem is proved. The case of local gauge quantum field theories is discussed in detail and a characterization is given of the occurrence of the Higgs mechanism versus the Goldstone mechanism. The Higgs phenomenon is explained on general grounds without the introduction of the so-called Higgs fields. The basic property is the relation between the local internal symmetry group and the local group of gauge transformations of the second kind. Spontaneous symmetry breaking of c-number gauge transformations of the second kind is shown to always occur if there are charged local fields. The implications about the absence of mass gap in the Wightman functions and the occurrence of massless particles associated with the unbroken generators in the Higgs phenomenon are discussed. (orig.) [de

  12. Unified description of perturbation theory and band center anomaly in one-dimensional Anderson localization

    International Nuclear Information System (INIS)

    Kang, Kai; Qin, Shaojing; Wang, Chuilin

    2011-01-01

    We calculated numerically the localization length of one-dimensional Anderson model with diagonal disorder. For weak disorder, we showed that the localization length changes continuously as the energy changes from the band center to the boundary of the anomalous region near the band edge. We found that all the localization lengths for different disorder strengths and different energies collapse onto a single curve, which can be fitted by a simple equation. Thus the description of the perturbation theory and the band center anomaly were unified into this equation. -- Highlights: → We study the band center anomaly of one-dimensional Anderson localization. → We study numerically the Lyapunov exponent through a parametrization method of the transfer matrix. → We give a unified equation to describe the band center anomaly and perturbation theory.

  13. Characterization of the spatial structure of local functional connectivity using multi-distance average correlation measures.

    Science.gov (United States)

    Macia, Didac; Pujol, Jesus; Blanco-Hinojo, Laura; Martínez-Vilavella, Gerard; Martín-Santos, Rocío; Deus, Joan

    2018-04-24

    There is ample evidence from basic research in neuroscience of the importance of local cortico-cortical networks. Millimetric resolution is achievable with current functional MRI (fMRI) scanners and sequences, and consequently a number of "local" activity similarity measures have been defined to describe patterns of segregation and integration at this spatial scale. We have introduced the use of Iso-Distant local Average Correlation (IDAC), easily defined as the average fMRI temporal correlation of a given voxel with other voxels placed at increasingly separated iso-distant intervals, to characterize the curve of local fMRI signal similarities. IDAC curves can be statistically compared using parametric multivariate statistics. Furthermore, by using RGB color-coding to display jointly IDAC values belonging to three different distance lags, IDAC curves can also be displayed as multi-distance IDAC maps. We applied IDAC analysis to a sample of 41 subjects scanned under two different conditions, a resting state and an auditory-visual continuous stimulation. Multi-distance IDAC mapping was able to discriminate between gross anatomo-functional cortical areas and, moreover, was sensitive to modulation between the two brain conditions in areas known to activate and de-activate during audio-visual tasks. Unlike previous fMRI local similarity measures already in use, our approach draws special attention to the continuous smooth pattern of local functional connectivity.

  14. Correlation between local structure and stability of supercooled liquid state in Zr-based metallic glasses

    International Nuclear Information System (INIS)

    Saida, Junji; Imafuku, Muneyuki; Sato, Shigeo; Sanada, Takashi; Matsubara, Eiichiro; Inoue, Akihisa

    2007-01-01

    The correlation between the local structure and stability of supercooled liquid state is investigated in the Zr 70 (Ni, Cu) 30 binary and Zr 70 Al 10 (Ni, Cu) 20 (numbers indicate at.%) ternary metallic glasses. The Zr 70 Ni 30 binary amorphous alloy with a low stability of supercooled liquid state has a tetragonal Zr 2 Ni-like local structure around Ni atom. Meanwhile, the Zr 70 Cu 30 binary metallic glass has a different local structure of tetragonal Zr 2 Cu, where we suggest the icosahedral local structure by the quasicrystallization behavior in addition of a very small amount of noble metals. The effect of Al addition on the local structure in the Zr-Ni alloy is also examined. We have investigated that the dominant local structure changes in the icosahedral-like structure from the tetragonal Zr 2 Ni-like local structure by the Al substitution with Ni accompanying with the significant stabilization of supercooled liquid state. It is concluded that the formation of icosahedral local structure contributes to the enhancement of stability of supercooled liquid state in the Zr-based alloys

  15. Local existence of N=1 supersymmetric gauge theory in four Dimensions

    Energy Technology Data Exchange (ETDEWEB)

    Akbar, Fiki T. [Theoretical Physics Laboratory, Theoretical High Energy Physics and Instrumentation Research Group, Faculty of Mathematics and Natural Sciences, Institut Teknologi Bandung Jl. Ganesha no. 10 Bandung, 40132 (Indonesia); Gunara, Bobby E.; Zen, Freddy P.; Triyanta [Theoretical Physics Laboratory, Theoretical High Energy Physics and Instrumentation Research Group, Faculty of Mathematics and Natural Sciences, Institut Teknologi Bandung Jl. Ganesha no. 10 Bandung, 40132 (Indonesia); Indonesian Center of Theoretical and Mathematical Physics (ICTMP) (Indonesia)

    2015-04-16

    In this paper, we shall prove the local existence of N=1 supersymmetry gauge theory in 4 dimension. We start from the Lagrangian for coupling chiral and vector multiplets with constant gauge kinetic function and only considering a bosonic part by setting all fermionic field to be zero at level equation of motion. We consider a U(n) model as isometry for scalar field internal geometry. And we use a nonlinear semigroup method to prove the local existence.

  16. Analytical energy gradients for explicitly correlated wave functions. I. Explicitly correlated second-order Møller-Plesset perturbation theory

    Science.gov (United States)

    Győrffy, Werner; Knizia, Gerald; Werner, Hans-Joachim

    2017-12-01

    We present the theory and algorithms for computing analytical energy gradients for explicitly correlated second-order Møller-Plesset perturbation theory (MP2-F12). The main difficulty in F12 gradient theory arises from the large number of two-electron integrals for which effective two-body density matrices and integral derivatives need to be calculated. For efficiency, the density fitting approximation is used for evaluating all two-electron integrals and their derivatives. The accuracies of various previously proposed MP2-F12 approximations [3C, 3C(HY1), 3*C(HY1), and 3*A] are demonstrated by computing equilibrium geometries for a set of molecules containing first- and second-row elements, using double-ζ to quintuple-ζ basis sets. Generally, the convergence of the bond lengths and angles with respect to the basis set size is strongly improved by the F12 treatment, and augmented triple-ζ basis sets are sufficient to closely approach the basis set limit. The results obtained with the different approximations differ only very slightly. This paper is the first step towards analytical gradients for coupled-cluster singles and doubles with perturbative treatment of triple excitations, which will be presented in the second part of this series.

  17. Short-range correlations in an extended time-dependent mean-field theory

    International Nuclear Information System (INIS)

    Madler, P.

    1982-01-01

    A generalization is performed of the time-dependent mean-field theory by an explicit inclusion of strong short-range correlations on a level of microscopic reversibility relating them to realistic nucleon-nucleon forces. Invoking a least action principle for correlated trial wave functions, equations of motion for the correlation functions and the single-particle model wave function are derived in lowest order of the FAHT cluster expansion. Higher order effects as well as long-range correlations are consider only to the extent to which they contribute to the mean field via a readjusted phenomenological effective two-body interaction. The corresponding correlated stationary problem is investigated and appropriate initial conditions to describe a heavy ion reaction are proposed. The singleparticle density matrix is evaluated

  18. Effect of superconducting correlation on the localization of quasiparticles in low dimensions

    International Nuclear Information System (INIS)

    Xiang, T.

    1995-01-01

    Localization lengths of superconducting quasiparticles λ s are evaluated and compared with the corresponding normal-state values λ n in one-dimensional (1D) and two-dimensional lattices. The effect of superconducting correlation on the localization of quasiparticles is generally stronger in an off-site pairing state than in an on-site pairing state. The modification of superconducting correlation to λ is strongly correlated with the density of states (DOS) of superconducting quasiparticles. λ s drops within the energy gap but is largely enhanced around energies where DOS peaks appear. For a gapless pairing state in 1D or a d-wave pairing state in 2D, λ s /λ n at the Fermi energy E F is of order 1 and determined purely by the value of gap parameter not by the random potential. For the d-wave pairing state, the localization effect is largely weakened compared with the corresponding normal state and quasiparticles with energies close to E F are more strongly localized than other low-energy quasiparticles

  19. Beyond Bell's theorem: realism and locality without Bell-type correlations.

    Science.gov (United States)

    De Zela, F

    2017-11-06

    The long-lasting view of entanglement as the characteristic trait of quantum mechanics has been recently challenged by experimental demonstrations of non-quantum entanglement. This motivates a review of the meaning of Bell violations, which have been widely taken to prove the impossibility of a realistic interpretation of quantum mechanics and as a manifestation of its non-local character. This work provides new theoretical evidence for the need of reviewing the meaning of Bell violations, especially when they occur outside the quantum framework. We present a local-realistic model that reproduces quantum predictions concerning Bell tests. We claim that local-realism is fully compatible with correlations that are not of the Bell type and therefore lie outside the scope of Bell's theorem. Most experimental Bell tests involve either spin vectors spanning the Bloch sphere or Stokes vectors spanning the Poincaré sphere. A suitable statistical tool that allows assessing correlations between vectors is given by inner-product-type correlations. Using them, it is possible to reproduce quantum predictions for all Bell states, thereby explaining experimental results of Bell tests within a local-realistic framework.

  20. Analysis of correlation structure in Lymantria dispar L. larvae from locally adapted populations

    Directory of Open Access Journals (Sweden)

    Mrdaković Marija

    2013-01-01

    Full Text Available The influence of allelochemical stress and population origin on the patterns of phenotypic and genetic correlations among life history traits and digestive enzyme activities were investigated in larvae of the gypsy moth (Lymantria dispar L.; Lepidoptera: Lymantriidae. Thirty-two full-sib families from oak (suitable host plant, Quercus population, and twenty-six full-sib families from locust-tree (unsuitable host plant, Robinia population forests were reared on an artificial diet, with or without a 5% tannic acid supplement. Comparison of correlation matrices revealed significant similarity between the two populations in the structure of phenotypic and genetic correlations of life history traits and of digestive enzyme activities. The patterns of correlations of the examined traits, within each of the two locally adapted populations and in the presence of allelochemical stress, remained stabile despite the different selection pressures that mold these traits. [Projekat Ministarstva nauke Republike Srbije, br. 173027

  1. Anderson localization and its ramifications disorder, phase coherence and electron correlations

    CERN Document Server

    Kettemann, S

    2003-01-01

    The phenomenon of localization of the electronic wave function in a random medium can be regarded as the key manifestation of quantum coherence in a condensed matter system. As one of the most remarkable phenomena in condensed matter physics discovered in the 20th century, the localization problem is an indispensable part of the theory of the quantum Hall effects and rivals superconductivity in its significance as a manifestation of quantum coherence at a macroscopic scale. The present volume, written by some of the leading experts in the field, is intended to highlight some of the recent progress in the field of localization, with particular emphasis on the effect of interactions on quantum coherence. The chapters are written in textbook style and should serve as a reliable and thorough introduction for advanced students or researchers already working in the field of mesoscopic physics.

  2. Group of local biholomorphisms of C/sup 1/ and conformal field theory on the operator formalism

    Energy Technology Data Exchange (ETDEWEB)

    Budzynski, R.J.; Klimek, S.; Sadowski, P.

    1989-01-01

    Motivated by the operator formulation of conformal field theory on Riemann surfaces, we study the properties of the infinite dimensional group of local biholomorphic transformations (conformal reparametrizations) of C/sup 1/ and develop elements of its representation theory.

  3. Segment-scale, force-level theory of mesoscopic dynamic localization and entropic elasticity in entangled chain polymer liquids

    Science.gov (United States)

    Dell, Zachary E.; Schweizer, Kenneth S.

    2017-04-01

    We develop a segment-scale, force-based theory for the breakdown of the unentangled Rouse model and subsequent emergence of isotropic mesoscopic localization and entropic elasticity in chain polymer liquids in the absence of ergodicity-restoring anisotropic reptation or activated hopping motion. The theory is formulated in terms of a conformational N-dynamic-order-parameter generalized Langevin equation approach. It is implemented using a universal field-theoretic Gaussian thread model of polymer structure and closed at the level of the chain dynamic second moment matrix. The physical idea is that the isotropic Rouse model fails due to the dynamical emergence, with increasing chain length, of time-persistent intermolecular contacts determined by the combined influence of local uncrossability, long range polymer connectivity, and a self-consistent treatment of chain motion and the dynamic forces that hinder it. For long chain melts, the mesoscopic localization length (identified as the tube diameter) and emergent entropic elasticity predictions are in near quantitative agreement with experiment. Moreover, the onset chain length scales with the semi-dilute crossover concentration with a realistic numerical prefactor. Distinctive novel predictions are made for various off-diagonal correlation functions that quantify the full spatial structure of the dynamically localized polymer conformation. As the local excluded volume constraint and/or intrachain bonding spring are softened to allow chain crossability, the tube diameter is predicted to swell until it reaches the radius-of-gyration at which point mesoscopic localization vanishes in a discontinuous manner. A dynamic phase diagram for such a delocalization transition is constructed, which is qualitatively consistent with simulations and the classical concept of a critical entanglement degree of polymerization.

  4. Landscape and Local Correlates of Bee Abundance and Species Richness in Urban Gardens.

    Science.gov (United States)

    Quistberg, Robyn D; Bichier, Peter; Philpott, Stacy M

    2016-03-31

    Urban gardens may preserve biodiversity as urban population densities increase, but this strongly depends on the characteristics of the gardens and the landscapes in which they are embedded. We investigated whether local and landscape characteristics are important correlates of bee (Hymenoptera: Apiformes) abundance and species richness in urban community gardens. We worked in 19 gardens in the California central coast and sampled bees with aerial nets and pan traps. We measured local characteristics (i.e., vegetation and ground cover) and used the USGS National Land Cover Database to classify the landscape surrounding our garden study sites at 2 km scales. We classified bees according to nesting type (i.e., cavity, ground) and body size and determined which local and landscape characteristics correlate with bee community characteristics. We found 55 bee species. One landscape and several local factors correlated with differences in bee abundance and richness for all bees, cavity-nesting bees, ground-nesting bees, and different sized bees. Generally, bees were more abundant and species rich in bigger gardens, in gardens with higher floral abundance, less mulch cover, more bare ground, and with more grass. Medium bees were less abundant in sites surrounded by more medium intensity developed land within 2 km. The fact that local factors were generally more important drivers of bee abundance and richness indicates a potential for gardeners to promote bee conservation by altering local management practices. In particular, increasing floral abundance, decreasing use of mulch, and providing bare ground may promote bees in urban gardens. © The Authors 2016. Published by Oxford University Press on behalf of Entomological Society of America. All rights reserved. For Permissions, please email: journals.permissions@oup.com.

  5. Cutoff effects on energy-momentum tensor correlators in lattice gauge theory

    International Nuclear Information System (INIS)

    Meyer, Harvey B.

    2009-01-01

    We investigate the discretization errors affecting correlators of the energy-momentum tensor T μν at finite temperature in SU(N c ) gauge theory with the Wilson action and two different discretizations of T μν . We do so by using lattice perturbation theory and non-perturbative Monte-Carlo simulations. These correlators, which are functions of Euclidean time x 0 and spatial momentum p, are the starting point for a lattice study of the transport properties of the gluon plasma. We find that the correlator of the energy ∫d 3 x T 00 has much larger discretization errors than the correlator of momentum ∫d 3 x T 0k . Secondly, the shear and diagonal stress correlators (T 12 and T kk ) require N τ ≥ 8 for the Tx 0 = 1/2 point to be in the scaling region and the cutoff effect to be less than 10%. We then show that their discretization errors on an anisotropic lattice with a σ /a τ = 2 are comparable to those on the isotropic lattice with the same temporal lattice spacing. Finally, we also study finite p correlators.

  6. Multireference second order perturbation theory with a simplified treatment of dynamical correlation.

    Science.gov (United States)

    Xu, Enhua; Zhao, Dongbo; Li, Shuhua

    2015-10-13

    A multireference second order perturbation theory based on a complete active space configuration interaction (CASCI) function or density matrix renormalized group (DMRG) function has been proposed. This method may be considered as an approximation to the CAS/A approach with the same reference, in which the dynamical correlation is simplified with blocked correlated second order perturbation theory based on the generalized valence bond (GVB) reference (GVB-BCPT2). This method, denoted as CASCI-BCPT2/GVB or DMRG-BCPT2/GVB, is size consistent and has a similar computational cost as the conventional second order perturbation theory (MP2). We have applied it to investigate a number of problems of chemical interest. These problems include bond-breaking potential energy surfaces in four molecules, the spectroscopic constants of six diatomic molecules, the reaction barrier for the automerization of cyclobutadiene, and the energy difference between the monocyclic and bicyclic forms of 2,6-pyridyne. Our test applications demonstrate that CASCI-BCPT2/GVB can provide comparable results with CASPT2 (second order perturbation theory based on the complete active space self-consistent-field wave function) for systems under study. Furthermore, the DMRG-BCPT2/GVB method is applicable to treat strongly correlated systems with large active spaces, which are beyond the capability of CASPT2.

  7. ICOM-ICTOP 14 October 2015 Workshop : Applying Global Theory to Local Practice

    NARCIS (Netherlands)

    Ariese, C.E.; Con, Aguilar E.O.; Martin, J.A.

    2015-01-01

    This workshop is connected to the presentation ‘Transforming global theory to local practice: Case studies from museums and education in the Caribbean’ and provides a practical and creative exercise for participants. The objective of the workshop is to support participants in exploring how to apply

  8. Local density approximation for exchange in excited-state density functional theory

    OpenAIRE

    Harbola, Manoj K.; Samal, Prasanjit

    2004-01-01

    Local density approximation for the exchange energy is made for treatment of excited-states in density-functional theory. It is shown that taking care of the state-dependence of the LDA exchange energy functional leads to accurate excitation energies.

  9. Shift versus no-shift in local regularization of Chern-Simons theory

    International Nuclear Information System (INIS)

    Giavarini, G.; Parma Univ.; Martin, C.P.; Ruiz Ruiz, F.

    1994-01-01

    We consider a family of local BRS-invariant higher covariant derivative regularizations of SU(N) Chern-Simons theory that do not shift the value of the Chern-Simons parameter k to k + sign(k) c v at one loop. (orig.)

  10. Poincare invariant gravity with local supersymmetry as a gauge theory for the M-algebra

    International Nuclear Information System (INIS)

    Hassaine, Mokhtar; Troncoso, Ricardo; Zanelli, Jorge

    2004-01-01

    Here we consider a gravitational action having local Poincare invariance which is given by the dimensional continuation of the Euler density in ten dimensions. It is shown that the local supersymmetric extension of this action requires the algebra to be the maximal extension of the N=1 super-Poincare algebra. The resulting action is shown to describe a gauge theory for the M-algebra, and is not the eleven-dimensional supergravity theory of Cremmer-Julia-Scherk. The theory admits a class of vacuum solutions of the form S10-dxXd+1, where Xd+1 is a warped product of R with a d-dimensional spacetime. It is shown that a nontrivial propagator for the graviton exists only for d=4 and positive cosmological constant. Perturbations of the metric around this solution reproduce linearized General Relativity around four-dimensional de Sitter spacetime

  11. Theory of a gauge gravitational field at localization of the Einstein group

    International Nuclear Information System (INIS)

    Tunyak, V.N.

    1985-01-01

    Theory of a gauge gravitational field when localizing a group of movements of the Einstein homogeneous static Universe (the R x SO Einstein group (4)) has been formulated. Proceeding from tetrade components of the Einstein Universe the relation between the Riemann metrics and gauge fields of the Einstein group has been established. Metric coherence with torsion transforming to the Kristoffel coherence of the Einstein Universe has been found when switching out gauge fields. It is shown that within the limit of infinite radius of the Einstein Universe curvature the given Einstein-invariant gauge theory transforms to the tetrade gravitation theory with localized triade rotations. Exact solutions in the form of nonsingular cosmological models have been obtained

  12. Reliability measures in item response theory: manifest versus latent correlation functions.

    Science.gov (United States)

    Milanzi, Elasma; Molenberghs, Geert; Alonso, Ariel; Verbeke, Geert; De Boeck, Paul

    2015-02-01

    For item response theory (IRT) models, which belong to the class of generalized linear or non-linear mixed models, reliability at the scale of observed scores (i.e., manifest correlation) is more difficult to calculate than latent correlation based reliability, but usually of greater scientific interest. This is not least because it cannot be calculated explicitly when the logit link is used in conjunction with normal random effects. As such, approximations such as Fisher's information coefficient, Cronbach's α, or the latent correlation are calculated, allegedly because it is easy to do so. Cronbach's α has well-known and serious drawbacks, Fisher's information is not meaningful under certain circumstances, and there is an important but often overlooked difference between latent and manifest correlations. Here, manifest correlation refers to correlation between observed scores, while latent correlation refers to correlation between scores at the latent (e.g., logit or probit) scale. Thus, using one in place of the other can lead to erroneous conclusions. Taylor series based reliability measures, which are based on manifest correlation functions, are derived and a careful comparison of reliability measures based on latent correlations, Fisher's information, and exact reliability is carried out. The latent correlations are virtually always considerably higher than their manifest counterparts, Fisher's information measure shows no coherent behaviour (it is even negative in some cases), while the newly introduced Taylor series based approximations reflect the exact reliability very closely. Comparisons among the various types of correlations, for various IRT models, are made using algebraic expressions, Monte Carlo simulations, and data analysis. Given the light computational burden and the performance of Taylor series based reliability measures, their use is recommended. © 2014 The British Psychological Society.

  13. Renormalization group improved computation of correlation functions in theories with nontrivial phase diagram

    DEFF Research Database (Denmark)

    Codello, Alessandro; Tonero, Alberto

    2016-01-01

    We present a simple and consistent way to compute correlation functions in interacting theories with nontrivial phase diagram. As an example we show how to consistently compute the four-point function in three dimensional Z2-scalar theories. The idea is to perform the path integral by weighting...... the momentum modes that contribute to it according to their renormalization group (RG) relevance, i.e. we weight each mode according to the value of the running couplings at that scale. In this way, we are able to encode in a loop computation the information regarding the RG trajectory along which we...

  14. A theory of local and global processes which affect solar wind electrons. 2. Experimental support

    International Nuclear Information System (INIS)

    Scudder, J.D.; Olbert, S.

    1979-05-01

    The microscopic characteristics of the Coulomb cross section show that there are three natural subpopulations for plasma electrons: the subthermals; the transthermals; and the extrathermals. Data from three experimental groups on three different spacecraft in the interplanetary medium over a radial range are presented to support the five interrelations projected between solar wind electron properties and changes in the interplanetary medium: (1) subthermals respond primarily to local changes (compression and rarefactions) in stream dynamics; (2) the extrathermal fraction of the ambient electron density should be anti-correlated with the asymptotic bulk speed; (3) the extrathermal 'temperature' should be anti-correlated with the local wind speed at 1 AU; (4) the heat flux carried by electrons should be anti-correlated with the local bulk speed; and (5) the extrathermal differential 'temperature' should be nearly independent of radius within 1 AU

  15. Cooperative Localization for Multi-AUVs Based on GM-PHD Filters and Information Entropy Theory

    Directory of Open Access Journals (Sweden)

    Lichuan Zhang

    2017-10-01

    Full Text Available Cooperative localization (CL is considered a promising method for underwater localization with respect to multiple autonomous underwater vehicles (multi-AUVs. In this paper, we proposed a CL algorithm based on information entropy theory and the probability hypothesis density (PHD filter, aiming to enhance the global localization accuracy of the follower. In the proposed framework, the follower carries lower cost navigation systems, whereas the leaders carry better ones. Meanwhile, the leaders acquire the followers’ observations, including both measurements and clutter. Then, the PHD filters are utilized on the leaders and the results are communicated to the followers. The followers then perform weighted summation based on all received messages and obtain a final positioning result. Based on the information entropy theory and the PHD filter, the follower is able to acquire a precise knowledge of its position.

  16. Burst Detection and Localization using Discrete Wavelet Transform and Cross-Correlation

    Directory of Open Access Journals (Sweden)

    Eduardo Trutié-Carrero

    2018-03-01

    Full Text Available Burst in water distribution systems causes great loss of this natural resource, interrupts the water supply, damages the streets, builds and increases the transmission of infectious diseases. In this paper we propose a new algorithm that allows the detection and automatic localization of burst in water distribution systems. As for detection, the novelty is to use the wavelet correlation criterion to compute the statistical decision and compare it with a detection threshold. The novelty in the localization is to use the statistical operator cross-correlation. The algorithm was implemented in Octave and was validated with 32 signals acquired in the laboratory in a 26.7 m long steel pipe. In 16 signals burst were triggered which were detected under a false positive probability of 2 %. No false positives were present on the 16 signals where only noise was present.

  17. Z-1 perturbation theory applied to the correlation energy problem of atoms

    International Nuclear Information System (INIS)

    Robinson, B.H.

    1975-01-01

    Rayleigh--Schroedinger Perturbation Theory is applied to obtain directly exact and explicit analytic formulas for the electron correlation energies of N electron systems in terms of their pairwise interactions through second order in Z -1 , where Z is the nucleus of the atom. It is demonstrated that the second order correlation energy may be expressed as exactly the sum of pairwise correlation energies. In the case of no zeroth order degeneracy, the zeroth and first order terms vanish. The expression for the pairwise energies is an infinite sum, all terms of which are of the same sign. There is no numerical differencing. In the case of zeroth order degeneracy it is shown that the above statement concerning the second order energy still holds, but the expressions are a bit more complicated. It is shown that they ''almost'' reduce to a much simpler form. Also, the computation of the first order correlation energy is considered

  18. The theory precision analyse of RFM localization of satellite remote sensing imagery

    Science.gov (United States)

    Zhang, Jianqing; Xv, Biao

    2009-11-01

    The tradition method of detecting precision of Rational Function Model(RFM) is to make use of a great deal check points, and it calculates mean square error through comparing calculational coordinate with known coordinate. This method is from theory of probability, through a large number of samples to statistic estimate value of mean square error, we can think its estimate value approaches in its true when samples are well enough. This paper is from angle of survey adjustment, take law of propagation of error as the theory basis, and it calculates theory precision of RFM localization. Then take the SPOT5 three array imagery as experiment data, and the result of traditional method and narrated method in the paper are compared, while has confirmed tradition method feasible, and answered its theory precision question from the angle of survey adjustment.

  19. Diagrammatic analysis of correlations in polymer fluids: Cluster diagrams via Edwards' field theory

    International Nuclear Information System (INIS)

    Morse, David C.

    2006-01-01

    Edwards' functional integral approach to the statistical mechanics of polymer liquids is amenable to a diagrammatic analysis in which free energies and correlation functions are expanded as infinite sums of Feynman diagrams. This analysis is shown to lead naturally to a perturbative cluster expansion that is closely related to the Mayer cluster expansion developed for molecular liquids by Chandler and co-workers. Expansion of the functional integral representation of the grand-canonical partition function yields a perturbation theory in which all quantities of interest are expressed as functionals of a monomer-monomer pair potential, as functionals of intramolecular correlation functions of non-interacting molecules, and as functions of molecular activities. In different variants of the theory, the pair potential may be either a bare or a screened potential. A series of topological reductions yields a renormalized diagrammatic expansion in which collective correlation functions are instead expressed diagrammatically as functionals of the true single-molecule correlation functions in the interacting fluid, and as functions of molecular number density. Similar renormalized expansions are also obtained for a collective Ornstein-Zernicke direct correlation function, and for intramolecular correlation functions. A concise discussion is given of the corresponding Mayer cluster expansion, and of the relationship between the Mayer and perturbative cluster expansions for liquids of flexible molecules. The application of the perturbative cluster expansion to coarse-grained models of dense multi-component polymer liquids is discussed, and a justification is given for the use of a loop expansion. As an example, the formalism is used to derive a new expression for the wave-number dependent direct correlation function and recover known expressions for the intramolecular two-point correlation function to first-order in a renormalized loop expansion for coarse-grained models of

  20. Quantum phase space theory for the calculation of v·j vector correlations

    International Nuclear Information System (INIS)

    Hall, G.E.

    1995-01-01

    The quantum state-counting phase space theory commonly used to describe barrierless dissociation is recast in a helicity basis to calculate photofragment v·j correlations. Counting pairs of fragment states with specific angular momentum projection numbers on the relative velocity provides a simple connection between angular momentum conservation and the v·j correlation, which is not so evident in the conventional basis for phase space state counts. The upper bound on the orbital angular momentum, l, imposed by the centrifugal barrier cannot be included simply in the helicity basis, where l is not a good quantum number. Two approaches for a quantum calculation of the v·j correlation are described to address this point. An application to the photodissociation of NCCN is consistent with recent classical phase space calculations of Cline and Klippenstein. The observed vector correlation exceeds the phase space theory prediction. The authors take this as evidence of incomplete mixing of the K states of the linear parent molecule at the transition state, corresponding to an evolution of the body-fixed projection number K into the total helicity of the fragment pair state. The average over a thermal distribution of parent angular momentum in the special case of a linear molecule does not significantly reduce the v·j correlation below that computed for total J = 0

  1. Structure of N = 2 superconformally invariant unitary ''minimal'' theories: Operator algebra and correlation functions

    International Nuclear Information System (INIS)

    Kiritsis, E.B.

    1987-01-01

    N = 2 superconformal-invariant theories are studied and their general structure is analyzed. The geometry of N = 2 complex superspace is developed as a tool to study the correlation functions of the theories above. The Ward identities of the global N = 2 superconformal symmetry are solved, to restrict the form of correlation functions. Advantage is taken of the existence of the degenerate operators to derive the ''fusion'' rules for the unitary minimal systems with c<1. In particular, the closure of the operator algebra for such systems is shown. The c = (1/3 minimal system is analyzed and its two-, three-, and four-point functions as well as its operator algebra are calculated explicitly

  2. Locally covariant quantum field theory and the problem of formulating the same physics in all space-times.

    Science.gov (United States)

    Fewster, Christopher J

    2015-08-06

    The framework of locally covariant quantum field theory is discussed, motivated in part using 'ignorance principles'. It is shown how theories can be represented by suitable functors, so that physical equivalence of theories may be expressed via natural isomorphisms between the corresponding functors. The inhomogeneous scalar field is used to illustrate the ideas. It is argued that there are two reasonable definitions of the local physical content associated with a locally covariant theory; when these coincide, the theory is said to be dynamically local. The status of the dynamical locality condition is reviewed, as are its applications in relation to (i) the foundational question of what it means for a theory to represent the same physics in different space-times and (ii) a no-go result on the existence of natural states. © 2015 The Author(s) Published by the Royal Society. All rights reserved.

  3. Analysis of deuterium relaxation-derived methyl axis order parameters and correlation with local structure

    International Nuclear Information System (INIS)

    Mittermaier, Anthony; Kay, Lewis E.; Forman-Kay, Julie D.

    1999-01-01

    Methyl axis (S2axis) and backbone NH (S2NH) order parameters derived from eight proteins have been analyzed. Similar distribution profiles for Ala S2axis and S2NH order parameters were observed. A good correlation between the two S2axis values of Val and Leu methyl groups is noted, although differences between order parameters can arise. The relation of S2axis or S2NH to solvent accessibility and packing density has also been investigated. Correlations are weak, likely reflecting the importance of collective, non-local motions in proteins. The lack of correlation between these simple structural parameters and dynamics emphasizes the importance of motional studies to fully characterize proteins

  4. Local probe studies on lattice distortions and electronic correlations in manganites

    CERN Document Server

    lopes, Armandina; Correia, João Guilherme

    This thesis presents an experimental study on lattice distortions and electronic correlations in colossal magnetoresistive magnetic oxides. The Perturbed Angular Correlation local probe technique is used to study selected manganite systems in order to obtain relevant insight into microscopic phenomena responsible for their macroscopic pr operties. Complementary structural, magnetic and electric characterization was performed. The work is focused on the following aspects: \\\\Lattice distortions and polaron clusters in LaMnO$_{3+ \\Delta}$ system. A study of the electric field gradi ent and magnetic hyperfine field was performed in representative samples of the LaMnO$_{3+ \\Delta}$ system, and correlated with macroscopic information obtained in the same samples. Particular attention was given to the LaMnO$_{3.12}$ sample since this compound is a prototype of a ferromagnetic-insulat or manganite, presenting a rhombohedric- orthorhombic structural phase transition near room temperature. We found that random distribu...

  5. Correlation functions in topological Yang-Mills theory with two fermionic charges

    International Nuclear Information System (INIS)

    Marculescu, S.

    1997-01-01

    The solution of the Donaldson cohomology problem for the topological Yang-Mills theory with two fermionic symmetries needs besides the gauge field and its descendants additional fields, hereafter called ascendants of the gauge field. It is shown that the dependence of the ascendants disappears in the all the correlation functions. This property allows one for the usual interpretation of the Donaldson invariants as cocycles of the instanton moduli space. (orig.)

  6. General theory for calculating disorder-averaged Green's function correlators within the coherent potential approximation

    Science.gov (United States)

    Zhou, Chenyi; Guo, Hong

    2017-01-01

    We report a diagrammatic method to solve the general problem of calculating configurationally averaged Green's function correlators that appear in quantum transport theory for nanostructures containing disorder. The theory treats both equilibrium and nonequilibrium quantum statistics on an equal footing. Since random impurity scattering is a problem that cannot be solved exactly in a perturbative approach, we combine our diagrammatic method with the coherent potential approximation (CPA) so that a reliable closed-form solution can be obtained. Our theory not only ensures the internal consistency of the diagrams derived at different levels of the correlators but also satisfies a set of Ward-like identities that corroborate the conserving consistency of transport calculations within the formalism. The theory is applied to calculate the quantum transport properties such as average ac conductance and transmission moments of a disordered tight-binding model, and results are numerically verified to high precision by comparing to the exact solutions obtained from enumerating all possible disorder configurations. Our formalism can be employed to predict transport properties of a wide variety of physical systems where disorder scattering is important.

  7. Characterization of identification errors and uses in localization of poor modal correlation

    Science.gov (United States)

    Martin, Guillaume; Balmes, Etienne; Chancelier, Thierry

    2017-05-01

    While modal identification is a mature subject, very few studies address the characterization of errors associated with components of a mode shape. This is particularly important in test/analysis correlation procedures, where the Modal Assurance Criterion is used to pair modes and to localize at which sensors discrepancies occur. Poor correlation is usually attributed to modeling errors, but clearly identification errors also occur. In particular with 3D Scanning Laser Doppler Vibrometer measurement, many transfer functions are measured. As a result individual validation of each measurement cannot be performed manually in a reasonable time frame and a notable fraction of measurements is expected to be fairly noisy leading to poor identification of the associated mode shape components. The paper first addresses measurements and introduces multiple criteria. The error measures the difference between test and synthesized transfer functions around each resonance and can be used to localize poorly identified modal components. For intermediate error values, diagnostic of the origin of the error is needed. The level evaluates the transfer function amplitude in the vicinity of a given mode and can be used to eliminate sensors with low responses. A Noise Over Signal indicator, product of error and level, is then shown to be relevant to detect poorly excited modes and errors due to modal property shifts between test batches. Finally, a contribution is introduced to evaluate the visibility of a mode in each transfer. Using tests on a drum brake component, these indicators are shown to provide relevant insight into the quality of measurements. In a second part, test/analysis correlation is addressed with a focus on the localization of sources of poor mode shape correlation. The MACCo algorithm, which sorts sensors by the impact of their removal on a MAC computation, is shown to be particularly relevant. Combined with the error it avoids keeping erroneous modal components

  8. Basic quantum theory and measurement from the viewpoint of local quantum physics

    International Nuclear Information System (INIS)

    Schroer, Bert

    1999-04-01

    Several aspects of the manifestation of the causality principle in LQP (local quantum physics) are reviewed or presented. Particular emphasis is given to those properties which are typical for LQP in the sense that they do go beyond the structure of general quantum theory and even escape the Lagrangian quantization methods of standard QFT. The most remarkable are those relating causality to the modular Tomita-Takesaki theory, since they bring in the basic concepts of antiparticles, charge superselections as well as internal and external (geometric and hidden) symmetries. (author)

  9. Foundations of complex analysis in non locally convex spaces function theory without convexity condition

    CERN Document Server

    Bayoumi, A

    2003-01-01

    All the existing books in Infinite Dimensional Complex Analysis focus on the problems of locally convex spaces. However, the theory without convexity condition is covered for the first time in this book. This shows that we are really working with a new, important and interesting field. Theory of functions and nonlinear analysis problems are widespread in the mathematical modeling of real world systems in a very broad range of applications. During the past three decades many new results from the author have helped to solve multiextreme problems arising from important situations, non-convex and

  10. Localization of supersymmetric field theories on non-compact hyperbolic three-manifolds

    Energy Technology Data Exchange (ETDEWEB)

    Assel, Benjamin; Martelli, Dario; Murthy, Sameer; Yokoyama, Daisuke [Department of Mathematics, King’s College London,The Strand, London WC2R 2LS (United Kingdom)

    2017-03-17

    We study supersymmetric gauge theories with an R-symmetry, defined on non-compact, hyperbolic, Riemannian three-manifolds, focusing on the case of a supersymmetry-preserving quotient of Euclidean AdS{sub 3}. We compute the exact partition function in these theories, using the method of localization, thus reducing the problem to the computation of one-loop determinants around a supersymmetric locus. We evaluate the one-loop determinants employing three different techniques: an index theorem, the method of pairing of eigenvalues, and the heat kernel method. Along the way, we discuss aspects of supersymmetry in manifolds with a conformal boundary, including supersymmetric actions and boundary conditions.

  11. Correlation between locally deformed structure and oxide film properties in austenitic stainless steel irradiated with neutrons

    Energy Technology Data Exchange (ETDEWEB)

    Chimi, Yasuhiro, E-mail: chimi.yasuhiro@jaea.go.jp [Japan Atomic Energy Agency (JAEA), 2-4 Shirakata, Tokai-mura, Naka-gun, Ibaraki 319-1195 (Japan); Kitsunai, Yuji [Nippon Nuclear Fuel Development, 2163 Narita-cho, Oarai-machi, Higashi-ibaraki-gun, Ibaraki 311-1313 (Japan); Kasahara, Shigeki [Japan Atomic Energy Agency (JAEA), 2-4 Shirakata, Tokai-mura, Naka-gun, Ibaraki 319-1195 (Japan); Chatani, Kazuhiro; Koshiishi, Masato [Nippon Nuclear Fuel Development, 2163 Narita-cho, Oarai-machi, Higashi-ibaraki-gun, Ibaraki 311-1313 (Japan); Nishiyama, Yutaka [Japan Atomic Energy Agency (JAEA), 2-4 Shirakata, Tokai-mura, Naka-gun, Ibaraki 319-1195 (Japan)

    2016-07-15

    To elucidate the mechanism of irradiation-assisted stress corrosion cracking (IASCC) in high-temperature water for neutron-irradiated austenitic stainless steels (SSs), the locally deformed structures, the oxide films formed on the deformed areas, and their correlation were investigated. Tensile specimens made of irradiated 316L SSs were strained 0.1%–2% at room temperature or at 563 K, and the surface structures and crystal misorientation among grains were evaluated. The strained specimens were immersed in high-temperature water, and the microstructures of the oxide films on the locally deformed areas were observed. The appearance of visible step structures on the specimens' surface depended on the neutron dose and the applied strain. The surface oxides were observed to be prone to increase in thickness around grain boundaries (GBs) with increasing neutron dose and increasing local strain at the GBs. No penetrative oxidation was observed along GBs or along surface steps. - Highlights: • Visible step structures depend on the neutron dose and the applied strain. • Local strain at grain boundaries was accumulated with the neutron dose. • Oxide thickness increases with neutron dose and local strain at grain boundaries. • No penetrative oxidation was observed along grain boundaries or surface steps.

  12. Social cognitive theory correlates of moderate-intensity exercise among adults with type 2 diabetes.

    Science.gov (United States)

    Heiss, Valerie J; Petosa, R L

    2016-01-01

    The purpose of this study was to identify social cognitive theory (SCT) correlates of moderate- to vigorous-intensity exercise (MVPA) among adults with type 2 diabetes. Adults with type 2 diabetes (N = 181) participated in the study. Participants were recruited through ResearchMatch.org to complete an online survey. The survey used previously validated instruments to measure dimensions of self-efficacy, self-regulation, social support, outcome expectations, the physical environment, and minutes of MVPA per week. Spearman Rank Correlations were used to determine the relationship between SCT variables and MVPA. Classification and Regression Analysis using a decision tree model was used to determine the amount of variance in MVPA explained by SCT variables. Due to low levels of vigorous activity, only moderate-intensity exercise (MIE) was analyzed. SCT variables explained 42.4% of the variance in MIE. Self-monitoring, social support from family, social support from friends, and self-evaluative outcome expectations all contributed to the variability in MIE. Other contributing variables included self-reward, task self-efficacy, social outcome expectations, overcoming barriers, and self-efficacy for making time for exercise. SCT is a useful theory for identifying correlates of MIE among adults with type 2 diabetes. The SCT correlates can be used to refine diabetes education programs to target the adoption and maintenance of regular exercise.

  13. Correlation between isotopic and meteorological parameters in Italian wines: a local-scale approach.

    Science.gov (United States)

    Aghemo, Costanza; Albertino, Andrea; Gobetto, Roberto; Spanna, Federico

    2011-08-30

    Since the beginning of the 1980s deuterium nuclear magnetic resonance and carbon-13 mass spectrometry have proved to be reliable techniques for detecting adulteration and for classifying natural products by their geographic origin. Scientific literature has so far mainly focused on data acquired at regional level where isotopic parameters are correlated to climatic mean data relative to large territories. Nebbiolo and Barbera wine samples of various vintages and from different areas within the Piedmont region (northern Italy) were analysed using SNIF-NMR and GC-C-IRMS and a large set of meteorological parameters were recorded by means of weather stations placed in fields where the grapes were grown. Correlations between isotopic ((2)H and (13)C) data and several climatic parameters at a local level (mean temperature, total rainfall, mean humidity and thermal sums) were attempted and some linear correlations were found. Mean temperature and total rainfall were found to be correlated to isotopic ((2)H and (13)C) abundance in linear direct and inverse proportions respectively. Lower or no correlations between deuterium and carbon-13 abundances and other meteorological parameters such as mean humidity and thermal sums were found. Moreover, wines produced from different grape varieties in the same grape field showed significantly different isotopic values. Copyright © 2011 Society of Chemical Industry.

  14. 3D spatially-adaptive canonical correlation analysis: Local and global methods.

    Science.gov (United States)

    Yang, Zhengshi; Zhuang, Xiaowei; Sreenivasan, Karthik; Mishra, Virendra; Curran, Tim; Byrd, Richard; Nandy, Rajesh; Cordes, Dietmar

    2018-04-01

    Local spatially-adaptive canonical correlation analysis (local CCA) with spatial constraints has been introduced to fMRI multivariate analysis for improved modeling of activation patterns. However, current algorithms require complicated spatial constraints that have only been applied to 2D local neighborhoods because the computational time would be exponentially increased if the same method is applied to 3D spatial neighborhoods. In this study, an efficient and accurate line search sequential quadratic programming (SQP) algorithm has been developed to efficiently solve the 3D local CCA problem with spatial constraints. In addition, a spatially-adaptive kernel CCA (KCCA) method is proposed to increase accuracy of fMRI activation maps. With oriented 3D spatial filters anisotropic shapes can be estimated during the KCCA analysis of fMRI time courses. These filters are orientation-adaptive leading to rotational invariance to better match arbitrary oriented fMRI activation patterns, resulting in improved sensitivity of activation detection while significantly reducing spatial blurring artifacts. The kernel method in its basic form does not require any spatial constraints and analyzes the whole-brain fMRI time series to construct an activation map. Finally, we have developed a penalized kernel CCA model that involves spatial low-pass filter constraints to increase the specificity of the method. The kernel CCA methods are compared with the standard univariate method and with two different local CCA methods that were solved by the SQP algorithm. Results show that SQP is the most efficient algorithm to solve the local constrained CCA problem, and the proposed kernel CCA methods outperformed univariate and local CCA methods in detecting activations for both simulated and real fMRI episodic memory data. Copyright © 2017 Elsevier Inc. All rights reserved.

  15. Comparison of Subset-Based Local and Finite Element-Based Global Digital Image Correlation

    KAUST Repository

    Pan, Bing

    2015-02-12

    Digital image correlation (DIC) techniques require an image matching algorithm to register the same physical points represented in different images. Subset-based local DIC and finite element-based (FE-based) global DIC are the two primary image matching methods that have been extensively investigated and regularly used in the field of experimental mechanics. Due to its straightforward implementation and high efficiency, subset-based local DIC has been used in almost all commercial DIC packages. However, it is argued by some researchers that FE-based global DIC offers better accuracy because of the enforced continuity between element nodes. We propose a detailed performance comparison between these different DIC algorithms both in terms of measurement accuracy and computational efficiency. Then, by measuring displacements of the same calculation points using the same calculation algorithms (e.g., correlation criterion, initial guess estimation, subpixel interpolation, optimization algorithm and convergence conditions) and identical calculation parameters (e.g., subset or element size), the performances of subset-based local DIC and two FE-based global DIC approaches are carefully compared in terms of measurement error and computational efficiency using both numerical tests and real experiments. A detailed examination of the experimental results reveals that, when subset (element) size is not very small and the local deformation within a subset (element) can be well approximated by the shape function used, standard subset-based local DIC approach not only provides better results in measured displacements, but also demonstrates much higher computation efficiency. However, several special merits of FE-based global DIC approaches are indicated.

  16. Comparison of Subset-Based Local and Finite Element-Based Global Digital Image Correlation

    KAUST Repository

    Pan, Bing; Wang, B.; Lubineau, Gilles; Moussawi, Ali

    2015-01-01

    Digital image correlation (DIC) techniques require an image matching algorithm to register the same physical points represented in different images. Subset-based local DIC and finite element-based (FE-based) global DIC are the two primary image matching methods that have been extensively investigated and regularly used in the field of experimental mechanics. Due to its straightforward implementation and high efficiency, subset-based local DIC has been used in almost all commercial DIC packages. However, it is argued by some researchers that FE-based global DIC offers better accuracy because of the enforced continuity between element nodes. We propose a detailed performance comparison between these different DIC algorithms both in terms of measurement accuracy and computational efficiency. Then, by measuring displacements of the same calculation points using the same calculation algorithms (e.g., correlation criterion, initial guess estimation, subpixel interpolation, optimization algorithm and convergence conditions) and identical calculation parameters (e.g., subset or element size), the performances of subset-based local DIC and two FE-based global DIC approaches are carefully compared in terms of measurement error and computational efficiency using both numerical tests and real experiments. A detailed examination of the experimental results reveals that, when subset (element) size is not very small and the local deformation within a subset (element) can be well approximated by the shape function used, standard subset-based local DIC approach not only provides better results in measured displacements, but also demonstrates much higher computation efficiency. However, several special merits of FE-based global DIC approaches are indicated.

  17. Correlation Matrix Renormalization Theory: Improving Accuracy with Two-Electron Density-Matrix Sum Rules.

    Science.gov (United States)

    Liu, C; Liu, J; Yao, Y X; Wu, P; Wang, C Z; Ho, K M

    2016-10-11

    We recently proposed the correlation matrix renormalization (CMR) theory to treat the electronic correlation effects [Phys. Rev. B 2014, 89, 045131 and Sci. Rep. 2015, 5, 13478] in ground state total energy calculations of molecular systems using the Gutzwiller variational wave function (GWF). By adopting a number of approximations, the computational effort of the CMR can be reduced to a level similar to Hartree-Fock calculations. This paper reports our recent progress in minimizing the error originating from some of these approximations. We introduce a novel sum-rule correction to obtain a more accurate description of the intersite electron correlation effects in total energy calculations. Benchmark calculations are performed on a set of molecules to show the reasonable accuracy of the method.

  18. Differentiability in density-functional theory: Further study of the locality theorem

    International Nuclear Information System (INIS)

    Lindgren, Ingvar; Salomonson, Sten

    2004-01-01

    The locality theorem in density-functional theory (DFT) states that the functional derivative of the Hohenberg-Kohn universal functional can be expressed as a local multiplicative potential function, and this is the basis of DFT and of the successful Kohn-Sham model. Nesbet has in several papers [Phys. Rev. A 58, R12 (1998); ibid.65, 010502 (2001); Adv. Quant. Chem, 43, 1 (2003)] claimed that this theorem is in conflict with fundamental quantum physics, and as a consequence that the Hohenberg-Kohn theory cannot be generally valid. We have commented upon these works [Comment, Phys. Rev. A 67, 056501 (2003)] and recently extended the arguments [Adv. Quantum Chem. 43, 95 (2003)]. We have shown that there is no such conflict and that the locality theorem is inherently exact. In the present work we have furthermore verified this numerically by constructing a local Kohn-Sham potential for the 1s2s 3 S state of helium that generates the many-body electron density and shown that the corresponding 2s Kohn-Sham orbital eigenvalue agrees with the ionization energy to nine digits. Similar result is obtained with the Hartree-Fock density. Therefore, in addition to verifying the locality theorem, this result also confirms the so-called ionization-potential theorem

  19. On strong-coupling correlation functions of circular Wilson loops and local operators

    International Nuclear Information System (INIS)

    Alday, Luis F; Tseytlin, Arkady A

    2011-01-01

    Motivated by the problem of understanding 3-point correlation functions of gauge-invariant operators in N=4 super Yang-Mills theory we consider correlators involving Wilson loops and a 'light' operator with fixed quantum numbers. At leading order in the strong-coupling expansion such correlators are given by the 'light' vertex operator evaluated on a semiclassical string world surface ending on the corresponding loops at the boundary of AdS 5 x S 5 . We study in detail the example of a correlator of two concentric circular Wilson loops and a dilaton vertex operator. The resulting expression is given by an integral of combinations of elliptic functions and can be computed analytically in some special limits. We also consider a generalization of the minimal surface ending on two circles to the case of non-zero angular momentum J in S 5 and discuss a special limit when one of the Wilson loops is effectively replaced by a 'heavy' operator with charge J. (paper)

  20. A density distribution algorithm for bone incorporating local orthotropy, modal analysis and theories of cellular solids.

    Science.gov (United States)

    Impelluso, Thomas J

    2003-06-01

    An algorithm for bone remodeling is presented which allows for both a redistribution of density and a continuous change of principal material directions for the orthotropic material properties of bone. It employs a modal analysis to add density for growth and a local effective strain based analysis to redistribute density. General re-distribution functions are presented. The model utilizes theories of cellular solids to relate density and strength. The code predicts the same general density distributions and local orthotropy as observed in reality.

  1. Using the electron localization function to correct for confinement physics in semi-local density functional theory

    International Nuclear Information System (INIS)

    Hao, Feng; Mattsson, Ann E.; Armiento, Rickard

    2014-01-01

    We have previously proposed that further improved functionals for density functional theory can be constructed based on the Armiento-Mattsson subsystem functional scheme if, in addition to the uniform electron gas and surface models used in the Armiento-Mattsson 2005 functional, a model for the strongly confined electron gas is also added. However, of central importance for this scheme is an index that identifies regions in space where the correction provided by the confined electron gas should be applied. The electron localization function (ELF) is a well-known indicator of strongly localized electrons. We use a model of a confined electron gas based on the harmonic oscillator to show that regions with high ELF directly coincide with regions where common exchange energy functionals have large errors. This suggests that the harmonic oscillator model together with an index based on the ELF provides the crucial ingredients for future improved semi-local functionals. For a practical illustration of how the proposed scheme is intended to work for a physical system we discuss monoclinic cupric oxide, CuO. A thorough discussion of this system leads us to promote the cell geometry of CuO as a useful benchmark for future semi-local functionals. Very high ELF values are found in a shell around the O ions, and take its maximum value along the Cu–O directions. An estimate of the exchange functional error from the effect of electron confinement in these regions suggests a magnitude and sign that could account for the error in cell geometry

  2. Expectation values of local fields for a two-parameter family of integrable models and related perturbed conformal field theories

    International Nuclear Information System (INIS)

    Baseilhac, P.; Fateev, V.A.

    1998-01-01

    We calculate the vacuum expectation values of local fields for the two-parameter family of integrable field theories introduced and studied by Fateev (1996). Using this result we propose an explicit expression for the vacuum expectation values of local operators in parafermionic sine-Gordon models and in integrable perturbed SU(2) coset conformal field theories. (orig.)

  3. Transport and magnetism in the organic conductors in relation to one dimension localization theory

    International Nuclear Information System (INIS)

    Zuppiroli, L.

    1985-09-01

    On the one side all states are exponentially localized in one dimension, on the other side most of the transport properties of quasi-one-dimensional organic conductors are Drude-like. This apparent contradiction is solved by revisiting the main experimental results concerning disordered organic conductors and by comparing them to the most relevant theories, especially those which take into account electron-phonon an electron-electron interactions [fr

  4. Star-product functions in higher-spin theory and locality

    Energy Technology Data Exchange (ETDEWEB)

    Vasiliev, M.A. [I.E. Tamm Department of Theoretical Physics, Lebedev Physical Institute,Leninsky prospect 53, 119991, Moscow (Russian Federation)

    2015-06-04

    Properties of the functional classes of star-product elements associated with higher-spin gauge fields and gauge parameters are elaborated. Cohomological interpretation of the nonlinear higher-spin equations is given. An algebra ℋ, where solutions of the nonlinear higher-spin equations are valued, is found. A conjecture on the classes of star-product functions underlying (non)local maps and gauge transformations in the nonlinear higher-spin theory is proposed.

  5. Performance of exchange-correlation functionals in density functional theory calculations for liquid metal: A benchmark test for sodium

    Science.gov (United States)

    Han, Jeong-Hwan; Oda, Takuji

    2018-04-01

    The performance of exchange-correlation functionals in density-functional theory (DFT) calculations for liquid metal has not been sufficiently examined. In the present study, benchmark tests of Perdew-Burke-Ernzerhof (PBE), Armiento-Mattsson 2005 (AM05), PBE re-parameterized for solids, and local density approximation (LDA) functionals are conducted for liquid sodium. The pair correlation function, equilibrium atomic volume, bulk modulus, and relative enthalpy are evaluated at 600 K and 1000 K. Compared with the available experimental data, the errors range from -11.2% to 0.0% for the atomic volume, from -5.2% to 22.0% for the bulk modulus, and from -3.5% to 2.5% for the relative enthalpy depending on the DFT functional. The generalized gradient approximation functionals are superior to the LDA functional, and the PBE and AM05 functionals exhibit the best performance. In addition, we assess whether the error tendency in liquid simulations is comparable to that in solid simulations, which would suggest that the atomic volume and relative enthalpy performances are comparable between solid and liquid states but that the bulk modulus performance is not. These benchmark test results indicate that the results of liquid simulations are significantly dependent on the exchange-correlation functional and that the DFT functional performance in solid simulations can be used to roughly estimate the performance in liquid simulations.

  6. Relativistic time-dependent local-density approximation theory and applications to atomic physics

    International Nuclear Information System (INIS)

    Parpia, F.Z.

    1984-01-01

    A time-dependent linear-response theory appropriate to the relativistic local-density approximation (RLDA) to quantum electrodynamics (QED) is developed. The resulting theory, the relativistic time-dependent local-density approximation (RTDLDA) is specialized to the treatment of electric excitations in closed-shell atoms. This formalism is applied to the calculation of atomic photoionization parameters in the dipole approximation. The static-field limit of the RTDLDA is applied to the calculation of dipole polarizabilities. Extensive numerical calculations of the photoionization parameters for the rare gases neon, argon, krypton, and xenon, and for mercury from the RTDLDA are presented and compared in detail with the results of other theories, in particular the relativistic random-phase approximation (RRPA), and with experimental measurements. The predictions of the RTDLDA are comparable with the RRPA calculations made to date. This is remarkable in that the RTDLDA entails appreciably less computational effort. Finally, the dipole polarizabilities predicted by the static-field RTDLDA are compared with other determinations of these quantities. In view of its simplicity, the static-field RTDLDA demonstrates itself to be one of the most powerful theories available for the calculation of dipole polarizabilities

  7. Non-Kähler resolved conifold, localized fluxes in M-theory and supersymmetry

    International Nuclear Information System (INIS)

    Dasgupta, Keshav; Emelin, Maxim; McDonough, Evan

    2015-01-01

    The known supergravity solution for wrapped D5-branes on the two-cycle of a Kähler resolved conifold is in general ISD but not supersymmetric, with the supersymmetry being broken by the presence of (1, 2) fluxes. However if we allow a non-Kähler metric on the resolved conifold, supersymmetry can easily be restored. The vanishing of the (1, 2) fluxes here corresponds to, under certain conformal rescalings of the metric, the torsion class constraints. We construct a class of explicit non-Kähler metrics on the resolved conifold satisfying the constraints. All this can also be studied from M-theory, where the fluxes and branes become non-localized G-fluxes on deformed Taub-NUT spaces. Interestingly, the gauge fluctuations on the wrapped D5-branes appear now as localized G-fluxes in M-theory. These localized fluxes are related to certain harmonic two-forms that are normalizable. We compute these forms explicitly and discuss how new constraints on the geometry of the non-Kähler manifolds may appear from M-theory considerations.

  8. Correlations of theory of mind deficits with clinical patterns and quality of life in schizophrenia

    Directory of Open Access Journals (Sweden)

    Mathieu eUrbach

    2013-05-01

    Full Text Available Background: Numerous studies have demonstrated the existence of theory of mind (ToM impairments in patients with schizophrenia. The clinical consequences of these impairments are currently under debate. Accumulated evidence suggests that ToM deficits are linked to negative and disorganization symptoms, but direct correlations are lacking. Moreover, it is unclear whether ToM deficits are related to reduced quality of life (QoL. Methods: To extend the understanding of objective (i.e., clinical symptoms and subjective (QoL correlates of impaired ToM, we assessed 206 patients with schizophrenia based on performance of an ecological task (Versailles-Situational Intention Reading, V-SIR, a Communication Disorders Scale (SCD, the Positive and Negative Syndrome Scale (PANSS, the Clinical Global Impression rating, and a QoL questionnaire (S-QoL. Statistical inferences were drawn from correlations analyses considering both factors/subscales aggregates and single items.Results: ToM performance was negatively correlated to disorganization and negative PANSS factors. Poor V-SIR performance was correlated with conceptual disorganization, difficulties in abstract thinking and apathy/social withdrawal. The SCD was correlated with negative, disorganization, and anxiety/depression PANSS factors. The S-QoL total score was not significantly correlated with ToM performance. Only the item difficulties in expressing feelings was significantly correlated with poorer V-SIR performance. Conclusions: We discuss the intriguing paucity of the results and what they reveal about the difficulties faced by psychiatrists with patients not expressing complaints about lack of social skills.

  9. Correlation between chromosome 9p21 locus deletion and prognosis in clinically localized prostate cancer.

    Science.gov (United States)

    Barros, Érika Aparecida Felix de; Pontes-Junior, José; Reis, Sabrina Thalita; Lima, Amanda Eunice Ramos; Souza, Isida C; Salgueiro, Jose Lucas; Fontes, Douglas; Dellê, Humberto; Coelho, Rafael Ferreira; Viana, Nayara Izabel; Leite, Kátia Ramos Moreira; Nahas, William C; Srougi, Miguel

    2017-05-04

    Some studies have reported that deletions at chromosome arm 9p occur frequently and represent a critical step in carcinogenesis of some neoplasms. Our aim was to evaluate the deletion of locus 9p21 and chromosomes 3, 7 and 17 in localized prostate cancer (PC) and correlate these alterations with prognostic factors and biochemical recurrence after surgery. We retrospectively evaluated surgical specimens from 111 patients with localized PC who underwent radical prostatectomy. Biochemical recurrence was defined as a prostate-specific antigen (PSA) >0.2 ng/mL and the mean postoperative follow-up was 123 months. The deletions were evaluated using fluorescence in situ hybridization with centromeric and locus-specific probes in a tissue microarray containing 2 samples from each patient. We correlated the occurrence of any deletion with pathological stage, Gleason score, ISUP grade group, PSA and biochemical recurrence. We observed a loss of any probe in only 8 patients (7.2%). The most common deletion was the loss of locus 9p21, which occurred in 6.4% of cases. Deletions of chromosomes 3, 7 and 17 were observed in 2.3%, 1.2% and 1.8% patients, respectively. There was no correlation between chromosome loss and Gleason score, ISUP, PSA or stage. Biochemical recurrence occurred in 83% cases involving 9p21 deletions. Loss of 9p21 locus was significantly associated with time to recurrence (p = 0.038). We found low rates of deletion in chromosomes 3, 7 and 17 and 9p21 locus. We observed that 9p21 locus deletion was associated with worse prognosis in localized PC treated by radical prostatectomy.

  10. Correlating Nitrile IR Frequencies to Local Electrostatics Quantifies Noncovalent Interactions of Peptides and Proteins.

    Science.gov (United States)

    Deb, Pranab; Haldar, Tapas; Kashid, Somnath M; Banerjee, Subhrashis; Chakrabarty, Suman; Bagchi, Sayan

    2016-05-05

    Noncovalent interactions, in particular the hydrogen bonds and nonspecific long-range electrostatic interactions are fundamental to biomolecular functions. A molecular understanding of the local electrostatic environment, consistently for both specific (hydrogen-bonding) and nonspecific electrostatic (local polarity) interactions, is essential for a detailed understanding of these processes. Vibrational Stark Effect (VSE) has proven to be an extremely useful method to measure the local electric field using infrared spectroscopy of carbonyl and nitrile based probes. The nitrile chemical group would be an ideal choice because of its absorption in an infrared spectral window transparent to biomolecules, ease of site-specific incorporation into proteins, and common occurrence as a substituent in various drug molecules. However, the inability of VSE to describe the dependence of IR frequency on electric field for hydrogen-bonded nitriles to date has severely limited nitrile's utility to probe the noncovalent interactions. In this work, using infrared spectroscopy and atomistic molecular dynamics simulations, we have reported for the first time a linear correlation between nitrile frequencies and electric fields in a wide range of hydrogen-bonding environments that may bridge the existing gap between VSE and H-bonding interactions. We have demonstrated the robustness of this field-frequency correlation for both aromatic nitriles and sulfur-based nitriles in a wide range of molecules of varying size and compactness, including small molecules in complex solvation environments, an amino acid, disordered peptides, and structured proteins. This correlation, when coupled to VSE, can be used to quantify noncovalent interactions, specific or nonspecific, in a consistent manner.

  11. Approximate self-consistent potentials for density-functional-theory exchange-correlation functionals

    International Nuclear Information System (INIS)

    Cafiero, Mauricio; Gonzalez, Carlos

    2005-01-01

    We show that potentials for exchange-correlation functionals within the Kohn-Sham density-functional-theory framework may be written as potentials for simpler functionals multiplied by a factor close to unity, and in a self-consistent field calculation, these effective potentials find the correct self-consistent solutions. This simple theory is demonstrated with self-consistent exchange-only calculations of the atomization energies of some small molecules using the Perdew-Kurth-Zupan-Blaha (PKZB) meta-generalized-gradient-approximation (meta-GGA) exchange functional. The atomization energies obtained with our method agree with or surpass previous meta-GGA calculations performed in a non-self-consistent manner. The results of this work suggest the utility of this simple theory to approximate exchange-correlation potentials corresponding to energy functionals too complicated to generate closed forms for their potentials. We hope that this method will encourage the development of complex functionals which have correct boundary conditions and are free of self-interaction errors without the worry that the functionals are too complex to differentiate to obtain potentials

  12. Correlation functions with fusion-channel multiplicity in W3 Toda field theory

    International Nuclear Information System (INIS)

    Belavin, Vladimir; Estienne, Benoit; Foda, Omar; Santachiara, Raoul

    2016-01-01

    Current studies of W N Toda field theory focus on correlation functions such that the W N highest-weight representations in the fusion channels are multiplicity-free. In this work, we study W 3 Toda 4-point functions with multiplicity in the fusion channel. The conformal blocks of these 4-point functions involve matrix elements of a fully-degenerate primary field with a highest-weight in the adjoint representation of sl 3 , and a fully-degenerate primary field with a highest-weight in the fundamental representation of sl 3 . We show that, when the fusion rules do not involve multiplicities, the matrix elements of the fully-degenerate adjoint field, between two arbitrary descendant states, can be computed explicitly, on equal footing with the matrix elements of the semi-degenerate fundamental field. Using null-state conditions, we obtain a fourth-order Fuchsian differential equation for the conformal blocks. Using Okubo theory, we show that, due to the presence of multiplicities, this differential equation belongs to a class of Fuchsian equations that is different from those that have appeared so far in W N theories. We solve this equation, compute its monodromy group, and construct the monodromy-invariant correlation functions. This computation shows in detail how the ambiguities that are caused by the presence of multiplicities are fixed by requiring monodromy-invariance.

  13. Correlation functions with fusion-channel multiplicity in W{sub 3} Toda field theory

    Energy Technology Data Exchange (ETDEWEB)

    Belavin, Vladimir [I.E. Tamm Department of Theoretical Physics, P.N. Lebedev Physical Institute,Leninsky Avenue 53, 119991 Moscow (Russian Federation); Department of Quantum Physics, Institute for Information Transmission Problems,Bolshoy Karetny per. 19, 127994 Moscow (Russian Federation); Estienne, Benoit [LPTHE, CNRS and Université Pierre et Marie Curie,Sorbonne Universités, 4 Place Jussieu, 75252 Paris Cedex 05 (France); Foda, Omar [School of Mathematics and Statistics, University of Melbourne,Parkville, Victoria 3010 (Australia); Santachiara, Raoul [LPTMS, CNRS (UMR 8626), Université Paris-Saclay,15 rue Georges Clémenceau, 91405 Orsay (France)

    2016-06-22

    Current studies of W{sub N} Toda field theory focus on correlation functions such that the W{sub N} highest-weight representations in the fusion channels are multiplicity-free. In this work, we study W{sub 3} Toda 4-point functions with multiplicity in the fusion channel. The conformal blocks of these 4-point functions involve matrix elements of a fully-degenerate primary field with a highest-weight in the adjoint representation of sl{sub 3}, and a fully-degenerate primary field with a highest-weight in the fundamental representation of sl{sub 3}. We show that, when the fusion rules do not involve multiplicities, the matrix elements of the fully-degenerate adjoint field, between two arbitrary descendant states, can be computed explicitly, on equal footing with the matrix elements of the semi-degenerate fundamental field. Using null-state conditions, we obtain a fourth-order Fuchsian differential equation for the conformal blocks. Using Okubo theory, we show that, due to the presence of multiplicities, this differential equation belongs to a class of Fuchsian equations that is different from those that have appeared so far in W{sub N} theories. We solve this equation, compute its monodromy group, and construct the monodromy-invariant correlation functions. This computation shows in detail how the ambiguities that are caused by the presence of multiplicities are fixed by requiring monodromy-invariance.

  14. Approximating the Shifted Hartree-Exchange-Correlation Potential in Direct Energy Kohn-Sham Theory.

    Science.gov (United States)

    Sharpe, Daniel J; Levy, Mel; Tozer, David J

    2018-02-13

    Levy and Zahariev [Phys. Rev. Lett. 113 113002 (2014)] have proposed a new approach for performing density functional theory calculations, termed direct energy Kohn-Sham (DEKS) theory. In this approach, the electronic energy equals the sum of orbital energies, obtained from Kohn-Sham-like orbital equations involving a shifted Hartree-exchange-correlation potential, which must be approximated. In the present study, density scaling homogeneity considerations are used to facilitate DEKS calculations on a series of atoms and molecules, leading to three nonlocal approximations to the shifted potential. The first two rely on preliminary Kohn-Sham calculations using a standard generalized gradient approximation (GGA) exchange-correlation functional and the results illustrate the benefit of describing the dominant Hartree component of the shift exactly. A uniform electron gas analysis is used to eliminate the need for these preliminary Kohn-Sham calculations, leading to a potential with an unconventional form that yields encouraging results, providing strong motivation for further research in DEKS theory.

  15. Localization, correlation, and visualization of electroencephalographic surface electrodes and brain anatomy in epilepsy studies

    Science.gov (United States)

    Brinkmann, Benjamin H.; O'Brien, Terence J.; Robb, Richard A.; Sharbrough, Frank W.

    1997-05-01

    Advances in neuroimaging have enhanced the clinician's ability to localize the epileptogenic zone in focal epilepsy, but 20-50 percent of these cases still remain unlocalized. Many sophisticated modalities have been used to study epilepsy, but scalp electrode recorded electroencephalography is particularly useful due to its noninvasive nature and excellent temporal resolution. This study is aimed at specific locations of scalp electrode EEG information for correlation with anatomical structures in the brain. 3D position localizing devices commonly used in virtual reality systems are used to digitize the coordinates of scalp electrodes in a standard clinical configuration. The electrode coordinates are registered with a high- resolution MRI dataset using a robust surface matching algorithm. Volume rendering can then be used to visualize the electrodes and electrode potentials interpolated over the scalp. The accuracy of the coordinate registration is assessed quantitatively with a realistic head phantom.

  16. Measurement of Local Deformations in Steel Monostrands Using Digital Image Correlation

    DEFF Research Database (Denmark)

    Winkler, Jan; Fischer, Gregor; Georgakis, Christos T.

    2014-01-01

    The local deformation mechanisms in steel monostrands have a significant influence on their fatigue life and failure mode. However, the observation and quantification of deformations in monostrands experiencing axial and transverse deformations is challenging because of their complex geometry......, difficulties with the placement of strain gauges in the vicinity of the anchorage, and, most importantly, the relatively small magnitude of deformation occurring in the monostrand. This paper focuses on the measurement of localized deformations in high-strength steel monostrands using the digital image...... correlation (DIC) technique. The presented technique enables the measurement of individual wire strains along the length of the monostrand and also provides quantitative information on the relative movement between individual wires, leading to a more in-depth understanding of the underlying fatigue mechanisms...

  17. Characterization of Quantum Correlations with Local Dimension Constraints and Its Device-Independent Applications

    Directory of Open Access Journals (Sweden)

    Miguel Navascués

    2014-01-01

    Full Text Available The future progress of semi-device-independent quantum information science depends crucially on our ability to bound the strength of the nonlocal correlations achievable with finite-dimensional quantum resources. In this work, we characterize quantum nonlocality under local dimension constraints via a complete hierarchy of semidefinite programming relaxations. In the bipartite case, we find that the first level of the hierarchy returns nontrivial bounds in all cases considered, allowing us to study nonlocality scenarios with four measurement settings on one side and twelve on the other in a normal desktop. In the tripartite case, we apply the hierarchy to derive a Bell-type inequality that can only be violated when each of the three parties has local dimension greater than 2, hence certifying three-dimensional tripartite entanglement in a device-independent way. Finally, we show how the new method can be trivially modified to detect nonseparable measurements in two-qubit scenarios.

  18. Detrended cross-correlation coefficient: Application to predict apoptosis protein subcellular localization.

    Science.gov (United States)

    Liang, Yunyun; Liu, Sanyang; Zhang, Shengli

    2016-12-01

    Apoptosis, or programed cell death, plays a central role in the development and homeostasis of an organism. Obtaining information on subcellular location of apoptosis proteins is very helpful for understanding the apoptosis mechanism. The prediction of subcellular localization of an apoptosis protein is still a challenging task, and existing methods mainly based on protein primary sequences. In this paper, we introduce a new position-specific scoring matrix (PSSM)-based method by using detrended cross-correlation (DCCA) coefficient of non-overlapping windows. Then a 190-dimensional (190D) feature vector is constructed on two widely used datasets: CL317 and ZD98, and support vector machine is adopted as classifier. To evaluate the proposed method, objective and rigorous jackknife cross-validation tests are performed on the two datasets. The results show that our approach offers a novel and reliable PSSM-based tool for prediction of apoptosis protein subcellular localization. Copyright © 2016 Elsevier Inc. All rights reserved.

  19. Local and Landscape Correlates of Spider Activity Density and Species Richness in Urban Gardens.

    Science.gov (United States)

    Otoshi, Michelle D; Bichier, Peter; Philpott, Stacy M

    2015-08-01

    Urbanization is a major threat to arthropod biodiversity and abundance due to reduction and loss of suitable natural habitat. Green spaces and small-scale agricultural areas may provide habitat and resources for arthropods within densely developed cities. We studied spider activity density (a measure of both abundance and degree of movement) and diversity in urban gardens in Santa Cruz, Santa Clara, and Monterey counties in central California, USA. We sampled for spiders with pitfall traps and sampled 38 local site characteristics for 5 mo in 19 garden sites to determine the relative importance of individual local factors. We also analyzed 16 landscape variables at 500-m and 1-km buffers surrounding each garden to determine the significance of landscape factors. We identified individuals from the most common families to species and identified individuals from other families to morphospecies. Species from the families Lycosidae and Gnaphosidae composed 81% of total adult spider individuals. Most of the significant factors that correlated with spider activity density and richness were local rather than landscape factors. Spider activity density and richness increased with mulch cover and flowering plant species, and decreased with bare soil. Thus, changes in local garden management have the potential to promote diversity of functionally important spiders in urban environments. © The Authors 2015. Published by Oxford University Press on behalf of Entomological Society of America. All rights reserved. For Permissions, please email: journals.permissions@oup.com.

  20. Frontal Face Detection using Haar Wavelet Coefficients and Local Histogram Correlation

    Directory of Open Access Journals (Sweden)

    Iwan Setyawan

    2011-12-01

    Full Text Available Face detection is the main building block on which all automatic systems dealing with human faces is built. For example, a face recognition system must rely on face detection to process an input image and determine which areas contain human faces. These areas then become the input for the face recognition system for further processing. This paper presents a face detection system designed to detect frontal faces. The system uses Haar wavelet coefficients and local histogram correlation as differentiating features. Our proposed system is trained using 100 training images. Our experiments show that the proposed system performed well during testing, achieving a detection rate of 91.5%.

  1. Correlation between MRS and serum PSA in the diagnosis of local recurrence after radical prostatectomy

    Directory of Open Access Journals (Sweden)

    Ghafuri M

    2012-08-01

    Full Text Available Background: Multifocality, multicentricity and extension beyond the prostate capsule are all characteristics of prostatic adenocarcinoma that may escape diagnosis by conventional CT scanning or MRI. This study was designed to assess the diagnostic value of magnetic resonance spectroscopy (MRS in prostatic carcinoma and its compatibility with prostatic specific antigen (PSA as the conventional method.Methods: In this cross-sectional study, we recruited 139 patients with previous radical prostatectomy referring to Radiology department of Hazrate-e-Rasul Hospital during the first half of 2011 for the evaluation of local recurrence. Traditionally, local recurrence is defined as serum PSA concentration >0.2 ng/dl. We used 1.5-tesla Siemens Avanto MRI unit with endorectal coil and measured creatine, choline and citrate levels before calculating choline-creatine/citrate ratio. Correlation between MRS findings with PSA concentration was evaluated in regards to the multiple levels of the previously mentioned ratio.Results: Local recurrence was found in 107 (77% patients based on PSA levels. The mean values for serum PSA levels and creatine-choline/citrate ratio were significantly different in patients with and without local recurrence. Creatine-choline/citrate ratios greater than 50, 100 and 150 (as different cut-off points of recurrence were respectively seen in 104, 102 and 97 patients and agreement ratio between MRS and PSA in these levels were 94.1%, 94.4% and 85.1%, respectively. Correlation coefficient between these two methods was 0.481.Conclusion: MRS is a valuable tool for evaluating recurrence inpatients with prostate cancer treated by radical prostatectomy and it is in good agreement with serum PSA levels.

  2. Potential Functional Embedding Theory at the Correlated Wave Function Level. 2. Error Sources and Performance Tests.

    Science.gov (United States)

    Cheng, Jin; Yu, Kuang; Libisch, Florian; Dieterich, Johannes M; Carter, Emily A

    2017-03-14

    Quantum mechanical embedding theories partition a complex system into multiple spatial regions that can use different electronic structure methods within each, to optimize trade-offs between accuracy and cost. The present work incorporates accurate but expensive correlated wave function (CW) methods for a subsystem containing the phenomenon or feature of greatest interest, while self-consistently capturing quantum effects of the surroundings using fast but less accurate density functional theory (DFT) approximations. We recently proposed two embedding methods [for a review, see: Acc. Chem. Res. 2014 , 47 , 2768 ]: density functional embedding theory (DFET) and potential functional embedding theory (PFET). DFET provides a fast but non-self-consistent density-based embedding scheme, whereas PFET offers a more rigorous theoretical framework to perform fully self-consistent, variational CW/DFT calculations [as defined in part 1, CW/DFT means subsystem 1(2) is treated with CW(DFT) methods]. When originally presented, PFET was only tested at the DFT/DFT level of theory as a proof of principle within a planewave (PW) basis. Part 1 of this two-part series demonstrated that PFET can be made to work well with mixed Gaussian type orbital (GTO)/PW bases, as long as optimized GTO bases and consistent electron-ion potentials are employed throughout. Here in part 2 we conduct the first PFET calculations at the CW/DFT level and compare them to DFET and full CW benchmarks. We test the performance of PFET at the CW/DFT level for a variety of types of interactions (hydrogen bonding, metallic, and ionic). By introducing an intermediate CW/DFT embedding scheme denoted DFET/PFET, we show how PFET remedies different types of errors in DFET, serving as a more robust type of embedding theory.

  3. Alternative separation of exchange and correlation energies in multi-configuration range-separated density-functional theory.

    Science.gov (United States)

    Stoyanova, Alexandrina; Teale, Andrew M; Toulouse, Julien; Helgaker, Trygve; Fromager, Emmanuel

    2013-10-07

    The alternative separation of exchange and correlation energies proposed by Toulouse et al. [Theor. Chem. Acc. 114, 305 (2005)] is explored in the context of multi-configuration range-separated density-functional theory. The new decomposition of the short-range exchange-correlation energy relies on the auxiliary long-range interacting wavefunction rather than the Kohn-Sham (KS) determinant. The advantage, relative to the traditional KS decomposition, is that the wavefunction part of the energy is now computed with the regular (fully interacting) Hamiltonian. One potential drawback is that, because of double counting, the wavefunction used to compute the energy cannot be obtained by minimizing the energy expression with respect to the wavefunction parameters. The problem is overcome by using short-range optimized effective potentials (OEPs). The resulting combination of OEP techniques with wavefunction theory has been investigated in this work, at the Hartree-Fock (HF) and multi-configuration self-consistent-field (MCSCF) levels. In the HF case, an analytical expression for the energy gradient has been derived and implemented. Calculations have been performed within the short-range local density approximation on H2, N2, Li2, and H2O. Significant improvements in binding energies are obtained with the new decomposition of the short-range energy. The importance of optimizing the short-range OEP at the MCSCF level when static correlation becomes significant has also been demonstrated for H2, using a finite-difference gradient. The implementation of the analytical gradient for MCSCF wavefunctions is currently in progress.

  4. Restoration of the local gauge symmetry and color confinement in non-Abelian gauge theories

    International Nuclear Information System (INIS)

    Hata, Hiroyuki

    1982-01-01

    Restoration of the local gauge symmetry and its connection to color confinement is investigated in non-Abelian gauge theories with covariant gauge fixing. We consider the Noether current J sub(μ,#betta#)sup(a) of the local gauge transformation with transformation functions #betta#sup(b)(x) linear in x sub(μ); #betta#sup(b)(x) = delta sup(ab)x sub(#betta#). This current is conserved only in the physical subspace of the state vector space and in perturbation theory contains a massless pole communicating to the gauge field. We define the local gauge symmetry restoration as the disappearance of this massless ''Goldstone'' pole from J sub(μ,#betta#)sup(a). The restoration condition is obtained and it coincides exactly with the color confinement criterion proposed earlier by Kugo and Ojima. Quarks and other colored particles are shown to be confined in the local gauge symmetry restored phase by using the Ward identities of J sub(μ,#betta#)sup(a). (author)

  5. Keldysh meets Lindblad: Correlated Gain and Loss in Higher Order Perturbation Theory

    Science.gov (United States)

    Stace, Tom; Mueller, Clemens

    Motivated by correlated decay processes driving gain, loss and lasing in driven artificial quantum systems, we develop a theoretical technique using Keldysh diagrammatic perturbation theory to derive a Lindblad master equation that goes beyond the usual second order perturbation theory. We demonstrate the method on the driven dissipative Rabi model, including terms up to fourth order in the interaction between the qubit and both the resonator and environment. This results in a large class of Lindblad dissipators and associated rates which go beyond the terms that have previously been proposed to describe similar systems. All of the additional terms contribute to the system behaviour at the same order of perturbation theory. We then apply these results to analyse the phonon-assisted steady-state gain of a microwave field driving a double quantum-dot in a resonator. We show that resonator gain and loss are substantially affected by dephasing- assisted dissipative processes in the quantum-dot system. These additional processes, which go beyond recently proposed polaronic theories, are in good quantitative agreement with experimental observations.

  6. An airloads theory for morphing airfoils in dynamic stall with experimental correlation

    Science.gov (United States)

    Ahaus, Loren A.

    Helicopter rotor blades frequently encounter dynamic stall during normal flight conditions, limiting the applicability of classical thin-airfoil theory at large angles of attack. Also, it is evident that because of the largely different conditions on the advancing and retreating sides of the rotor, future rotorcraft may incorporate dynamically morphing airfoils (trailing-edge aps, dynamic camber, dynamic droop, etc.). Reduced-order aerodynamic models are needed for preliminary design and ight simulation. A unified model for predicting the airloads on a morphing airfoil in dynamic stall is presented, consisting of three components. First, a linear airloads theory allows for arbitrary airfoil deformations consistent with a morphing airfoil. Second, to capture the effects of the wake, the airloads theory is coupled to an induced ow model. Third, the overshoot and time delay associated with dynamic stall are modeled by a second-order dynamic filter, along the lines of the ONERA dynamic stall model. This paper presents a unified airloads model that allows arbitrary airfoil morphing with dynamic stall. Correlations with experimental data validate the theory.

  7. Locally extracting scalar, vector and tensor modes in cosmological perturbation theory

    International Nuclear Information System (INIS)

    Clarkson, Chris; Osano, Bob

    2011-01-01

    Cosmological perturbation theory relies on the decomposition of perturbations into so-called scalar, vector and tensor modes. This decomposition is non-local and depends on unknowable boundary conditions. The non-locality is particularly important at second and higher order because perturbative modes are sourced by products of lower order modes, which must be integrated over all space in order to isolate each mode. However, given a trace-free rank-2 tensor, a locally defined scalar mode may be trivially derived by taking two divergences, which knocks out the vector and tensor degrees of freedom. A similar local differential operation will return a pure vector mode. This means that scalar and vector degrees of freedom have local descriptions. The corresponding local extraction of the tensor mode is unknown however. We give it here. The operators we define are useful for defining gauge-invariant quantities at second order. We perform much of our analysis using an index-free 'vector-calculus' approach which makes manipulating tensor equations considerably simpler. (papers)

  8. Quantum Noether identities for non-local transformations in higher-order derivatives theories

    International Nuclear Information System (INIS)

    Li, Z.P.; Long, Z.W.

    2003-01-01

    Based on the phase-space generating functional of the Green function for a system with a regular/singular higher-order Lagrangian, the quantum canonical Noether identities (NIs) under a local and non-local transformation in phase space have been deduced, respectively. For a singular higher-order Lagrangian, one must use an effective canonical action I eff P in quantum canonical NIs instead of the classical I P in classical canonical NIs. The quantum NIs under a local and non-local transformation in configuration space for a gauge-invariant system with a higher-order Lagrangian have also been derived. The above results hold true whether or not the Jacobian of the transformation is equal to unity or not. It has been pointed out that in certain cases the quantum NIs may be converted to conservation laws at the quantum level. This algorithm to derive the quantum conservation laws is significantly different from the quantum first Noether theorem. The applications of our formulation to the Yang-Mills fields and non-Abelian Chern-Simons (CS) theories with higher-order derivatives are given, and the conserved quantities at the quantum level for local and non-local transformations are found, respectively. (orig.)

  9. Local realistic theories and quantum mechanics for the two-neutral-kaon system

    International Nuclear Information System (INIS)

    Dalitz, R.H.; Garbarino, G.

    2001-01-01

    The predictions of local realistic theories for the observables concerning the evolution of a K 0 K-bar 0 quantum entangled pair (created in the decay of the phi-meson) are discussed. It is shown, in agreement with Bell's theorem, that the most general local hidden-variable model fails in reproducing the whole set of quantum-mechanical joint probabilities. We achieve these conclusion by employing two different approaches. In the first approach, the local realistic observables are deduced from the most general premises concerning locality and realism, and Bell-like inequalities are not employed. The other approach makes use of Bell's inequalities. In the first approach, under particular conditions for the detection times, the discrepancy between quantum mechanics and local realism for the time-dependent asymmetry turns out to be not less than 20%. A similar incompatibility can be made evident by means of a Bell-type test by employing both Wigner's and (once properly normalized probabilities are used) Clauser-Horne-Shimony-Holt's inequalities. Because of its relatively low experimental accuracy, the data obtained by the CPLEAR collaboration for the asymmetry parameter do not yet allow a decisive test of local realism. Such a test, both with and without the use of Bell's inequalities, should be feasible in the future at the Frascati PHI-factory

  10. Superconformal field theory in three dimensions: correlation functions of conserved currents

    Energy Technology Data Exchange (ETDEWEB)

    Buchbinder, Evgeny I.; Kuzenko, Sergei M.; Samsonov, Igor B. [School of Physics M013, The University of Western Australia,35 Stirling Highway, Crawley W.A. 6009 (Australia)

    2015-06-22

    For N-extended superconformal field theories in three spacetime dimensions (3D), with 1≤N≤3, we compute the two- and three-point correlation functions of the supercurrent and the flavour current multiplets. We demonstrate that supersymmetry imposes additional restrictions on the correlators of conserved currents as compared with the non-supersymmetric case studied by Osborn and Petkou in hep-th/9307010. It is shown that the three-point function of the supercurrent is determined by a single functional form consistent with the conservation equation and all the symmetry properties. Similarly, the three-point function of the flavour current multiplets is also determined by a single functional form in the N=1 and N=3 cases. The specific feature of the N=2 case is that two independent structures are allowed for the three-point function of flavour current multiplets, but only one of them contributes to the three-point function of the conserved currents contained in these multiplets. Since the supergravity and super-Yang-Mills Ward identities are expected to relate the coefficients of the two- and three-point functions under consideration, the results obtained for 3D superconformal field theory are analogous to those in 2D conformal field theory. In addition, we present a new supertwistor construction for compactified Minkowski superspace. It is suitable for developing superconformal field theory on 3D spacetimes other than Minkowski space, such as S{sup 1}×S{sup 2} and its universal covering space ℝ×S{sup 2}.

  11. Novel Approaches to Spectral Properties of Correlated Electron Materials: From Generalized Kohn-Sham Theory to Screened Exchange Dynamical Mean Field Theory

    Science.gov (United States)

    Delange, Pascal; Backes, Steffen; van Roekeghem, Ambroise; Pourovskii, Leonid; Jiang, Hong; Biermann, Silke

    2018-04-01

    The most intriguing properties of emergent materials are typically consequences of highly correlated quantum states of their electronic degrees of freedom. Describing those materials from first principles remains a challenge for modern condensed matter theory. Here, we review, apply and discuss novel approaches to spectral properties of correlated electron materials, assessing current day predictive capabilities of electronic structure calculations. In particular, we focus on the recent Screened Exchange Dynamical Mean-Field Theory scheme and its relation to generalized Kohn-Sham Theory. These concepts are illustrated on the transition metal pnictide BaCo2As2 and elemental zinc and cadmium.

  12. Mathematical correlation of modal-parameter-identification methods via system-realization theory

    Science.gov (United States)

    Juang, Jer-Nan

    1987-01-01

    A unified approach is introduced using system-realization theory to derive and correlate modal-parameter-identification methods for flexible structures. Several different time-domain methods are analyzed and treated. A basic mathematical foundation is presented which provides insight into the field of modal-parameter identification for comparison and evaluation. The relation among various existing methods is established and discussed. This report serves as a starting point to stimulate additional research toward the unification of the many possible approaches for modal-parameter identification.

  13. Mathematical correlation of modal parameter identification methods via system realization theory

    Science.gov (United States)

    Juang, J. N.

    1986-01-01

    A unified approach is introduced using system realization theory to derive and correlate modal parameter identification methods for flexible structures. Several different time-domain and frequency-domain methods are analyzed and treated. A basic mathematical foundation is presented which provides insight into the field of modal parameter identification for comparison and evaluation. The relation among various existing methods is established and discussed. This report serves as a starting point to stimulate additional research towards the unification of the many possible approaches for modal parameter identification.

  14. T-odd correlations in radiative K+l3 decays and chiral perturbation theory

    International Nuclear Information System (INIS)

    Mueller, E.H.; Kubis, B.; Meissner, U.G.

    2006-01-01

    The charged kaon decay channel K + l3γ allows for studies of direct CP violation, possibly due to non-standard mechanisms, with the help of T-odd correlation variables. In order to be able to extract a CP-violating signal from experiment, it is necessary to understand all possible standard model phases that also produce T-odd asymmetries. We complement earlier studies by considering strong interaction phases in hadronic structure functions that appear at higher orders in chiral perturbation theory, and we compare our findings to other potential sources of asymmetries. (orig.)

  15. Local structure reconstruction in hydrogenated amorphous silicon from angular correlation and synchrotron diffraction studies

    International Nuclear Information System (INIS)

    Britton, D.T.; Minani, E.; Knoesen, D.; Schut, H.; Eijt, S.W.H.; Furlan, F.; Giles, C.; Haerting, M.

    2006-01-01

    Hydrogenated amorphous silicon (a-Si:H) is a widely used thin film semiconductor material which is still incompletely understood. It is generally assumed to form a continuous random network, with a high concentration of coordination defects (dangling bonds), which are hydrogen terminated. Neither the exact nature of these sites nor the degree of medium range order has been fully determined. In this paper, we present the first results for the local structure, from a combined study using angular correlation of positron annihilation radiation (ACAR) and synchrotron radiation diffraction. Reciprocal space information is obtained directly, for the mesoscale structure and the local defect structure, from the orientation dependent diffraction and 2D-ACAR patterns, respectively. Furthermore, inversion of both patterns yields a comparison of real space information through maps of the silicon-silicon pair correlation function and the electron-positron autocorrelation function B 2γ (r). From this information, it is possible to identify the dominant structural defect as a vacancy-size dangling bond cluster, around which the network strain is fully relaxed

  16. Local wavelet correlation: applicationto timing analysis of multi-satellite CLUSTER data

    Directory of Open Access Journals (Sweden)

    J. Soucek

    2004-12-01

    Full Text Available Multi-spacecraft space observations, such as those of CLUSTER, can be used to infer information about local plasma structures by exploiting the timing differences between subsequent encounters of these structures by individual satellites. We introduce a novel wavelet-based technique, the Local Wavelet Correlation (LWC, which allows one to match the corresponding signatures of large-scale structures in the data from multiple spacecraft and determine the relative time shifts between the crossings. The LWC is especially suitable for analysis of strongly non-stationary time series, where it enables one to estimate the time lags in a more robust and systematic way than ordinary cross-correlation techniques. The technique, together with its properties and some examples of its application to timing analysis of bow shock and magnetopause crossing observed by CLUSTER, are presented. We also compare the performance and reliability of the technique with classical discontinuity analysis methods. Key words. Radio science (signal processing – Space plasma physics (discontinuities; instruments and techniques

  17. φq-field theory for portfolio optimization: “fat tails” and nonlinear correlations

    Science.gov (United States)

    Sornette, D.; Simonetti, P.; Andersen, J. V.

    2000-08-01

    Physics and finance are both fundamentally based on the theory of random walks (and their generalizations to higher dimensions) and on the collective behavior of large numbers of correlated variables. The archetype examplifying this situation in finance is the portfolio optimization problem in which one desires to diversify on a set of possibly dependent assets to optimize the return and minimize the risks. The standard mean-variance solution introduced by Markovitz and its subsequent developments is basically a mean-field Gaussian solution. It has severe limitations for practical applications due to the strongly non-Gaussian structure of distributions and the nonlinear dependence between assets. Here, we present in details a general analytical characterization of the distribution of returns for a portfolio constituted of assets whose returns are described by an arbitrary joint multivariate distribution. In this goal, we introduce a non-linear transformation that maps the returns onto Gaussian variables whose covariance matrix provides a new measure of dependence between the non-normal returns, generalizing the covariance matrix into a nonlinear covariance matrix. This nonlinear covariance matrix is chiseled to the specific fat tail structure of the underlying marginal distributions, thus ensuring stability and good conditioning. The portfolio distribution is then obtained as the solution of a mapping to a so-called φq field theory in particle physics, of which we offer an extensive treatment using Feynman diagrammatic techniques and large deviation theory, that we illustrate in details for multivariate Weibull distributions. The interaction (non-mean field) structure in this field theory is a direct consequence of the non-Gaussian nature of the distribution of asset price returns. We find that minimizing the portfolio variance (i.e. the relatively “small” risks) may often increase the large risks, as measured by higher normalized cumulants. Extensive

  18. Correlates of Protective Motivation Theory (PMT) to adolescents' drug use intention.

    Science.gov (United States)

    Wu, Cynthia Sau Ting; Wong, Ho Ting; Chou, Lai Yan; To, Bobby Pak Wai; Lee, Wai Lok; Loke, Alice Yuen

    2014-01-03

    Early onset and increasing proliferation of illicit adolescent drug-use poses a global health concern. This study aimed to examine the correlation between Protective Motivation Theory (PMT) measures and the intention to use drugs among adolescents. An exploratory quantitative correlation design and convenience sampling were adopted. A total of 318 students completed a self-reported questionnaire that solicited information related to their demographics and activities, measures of threat appraisal and coping appraisal, and the intention to use drugs. Logistic regression analysis showed that intrinsic and extrinsic rewards were significant predictors of intention. The odds ratios were equal to 2.90 (p < 0.05) and 8.04 (p < 0.001), respectively. The logistic regression model analysis resulted in a high Nagelkerke R2 of 0.49, which suggests that PMT related measures could be used in predicting drug use intention among adolescents. Further research should be conducted with non-school adolescents to confirm the application.

  19. Subsystem density functional theory with meta-generalized gradient approximation exchange-correlation functionals.

    Science.gov (United States)

    Śmiga, Szymon; Fabiano, Eduardo; Laricchia, Savio; Constantin, Lucian A; Della Sala, Fabio

    2015-04-21

    We analyze the methodology and the performance of subsystem density functional theory (DFT) with meta-generalized gradient approximation (meta-GGA) exchange-correlation functionals for non-bonded molecular systems. Meta-GGA functionals depend on the Kohn-Sham kinetic energy density (KED), which is not known as an explicit functional of the density. Therefore, they cannot be directly applied in subsystem DFT calculations. We propose a Laplacian-level approximation to the KED which overcomes this limitation and provides a simple and accurate way to apply meta-GGA exchange-correlation functionals in subsystem DFT calculations. The so obtained density and energy errors, with respect to the corresponding supermolecular calculations, are comparable with conventional approaches, depending almost exclusively on the approximations in the non-additive kinetic embedding term. An embedding energy error decomposition explains the accuracy of our method.

  20. Outcome after neoadjuvant chemoradiation and correlation with nutritional status in patients with locally advanced pancreatic cancer

    International Nuclear Information System (INIS)

    Naumann, P.; Habermehl, D.; Welzel, T.; Combs, S.E.

    2013-01-01

    Background: Cancer patients commonly suffer from weight loss since rapid tumor growth can cause catabolic metabolism and depletion of energy stores such as abdominal fat. In locally advanced pancreatic cancer this is even more pronounced due to abdominal pain, fatigue, nausea or malnutrition. In the present article, we quantify this frequently observed weight loss and assess its impact on outcome and survival. Methods: Data on demographics, biometrics, toxicity and survival were collected for the last 100 patients treated with neoadjuvant chemoradiation for locally advanced pancreatic cancer at our department (45.0 Gy and boost up to 54.0 Gy plus concurrent and subsequent gemcitabine), and the subcutaneous fat area at the umbilicus level was measured by computer tomography before and after chemoradiation. Results: After chemoradiation, patients showed a highly statistically significant weight loss and reduction of the subcutaneous fat area. We could determine a very strong correlation of subcutaneous fat area to patient BMI. By categorizing patients according to their BMI based on the WHO classification as slender, normal, overweight and obese, we found improved but not statistically significant survival among obese patients. Accordingly, patients who showed less weight loss tended to survive longer. Conclusions: In this study, patients with pancreatic cancer lost weight during chemoradiation and their subcutaneous fat diminished. Changes in subcutaneous fat area were highly correlated with patients' BMI. Moreover, obese patients and patients who lost less weight had an improved outcome after treatment. Although the extent of weight loss was not significantly correlated with survival, the observed trend warrants greater attention to nutritional status in the future. (orig.)

  1. Outcome after neoadjuvant chemoradiation and correlation with nutritional status in patients with locally advanced pancreatic cancer

    Energy Technology Data Exchange (ETDEWEB)

    Naumann, P.; Habermehl, D.; Welzel, T.; Combs, S.E. [University Clinic Heidelberg (Germany). Dept. of Radiation Oncology; Debus, J. [University Clinic Heidelberg (Germany). Dept. of Radiation Oncology; Deutsches Krebsforschungszentrum, Heidelberg (Germany)

    2013-09-15

    Background: Cancer patients commonly suffer from weight loss since rapid tumor growth can cause catabolic metabolism and depletion of energy stores such as abdominal fat. In locally advanced pancreatic cancer this is even more pronounced due to abdominal pain, fatigue, nausea or malnutrition. In the present article, we quantify this frequently observed weight loss and assess its impact on outcome and survival. Methods: Data on demographics, biometrics, toxicity and survival were collected for the last 100 patients treated with neoadjuvant chemoradiation for locally advanced pancreatic cancer at our department (45.0 Gy and boost up to 54.0 Gy plus concurrent and subsequent gemcitabine), and the subcutaneous fat area at the umbilicus level was measured by computer tomography before and after chemoradiation. Results: After chemoradiation, patients showed a highly statistically significant weight loss and reduction of the subcutaneous fat area. We could determine a very strong correlation of subcutaneous fat area to patient BMI. By categorizing patients according to their BMI based on the WHO classification as slender, normal, overweight and obese, we found improved but not statistically significant survival among obese patients. Accordingly, patients who showed less weight loss tended to survive longer. Conclusions: In this study, patients with pancreatic cancer lost weight during chemoradiation and their subcutaneous fat diminished. Changes in subcutaneous fat area were highly correlated with patients' BMI. Moreover, obese patients and patients who lost less weight had an improved outcome after treatment. Although the extent of weight loss was not significantly correlated with survival, the observed trend warrants greater attention to nutritional status in the future. (orig.)

  2. Correlation coefficient based supervised locally linear embedding for pulmonary nodule recognition.

    Science.gov (United States)

    Wu, Panpan; Xia, Kewen; Yu, Hengyong

    2016-11-01

    Dimensionality reduction techniques are developed to suppress the negative effects of high dimensional feature space of lung CT images on classification performance in computer aided detection (CAD) systems for pulmonary nodule detection. An improved supervised locally linear embedding (SLLE) algorithm is proposed based on the concept of correlation coefficient. The Spearman's rank correlation coefficient is introduced to adjust the distance metric in the SLLE algorithm to ensure that more suitable neighborhood points could be identified, and thus to enhance the discriminating power of embedded data. The proposed Spearman's rank correlation coefficient based SLLE (SC(2)SLLE) is implemented and validated in our pilot CAD system using a clinical dataset collected from the publicly available lung image database consortium and image database resource initiative (LICD-IDRI). Particularly, a representative CAD system for solitary pulmonary nodule detection is designed and implemented. After a sequential medical image processing steps, 64 nodules and 140 non-nodules are extracted, and 34 representative features are calculated. The SC(2)SLLE, as well as SLLE and LLE algorithm, are applied to reduce the dimensionality. Several quantitative measurements are also used to evaluate and compare the performances. Using a 5-fold cross-validation methodology, the proposed algorithm achieves 87.65% accuracy, 79.23% sensitivity, 91.43% specificity, and 8.57% false positive rate, on average. Experimental results indicate that the proposed algorithm outperforms the original locally linear embedding and SLLE coupled with the support vector machine (SVM) classifier. Based on the preliminary results from a limited number of nodules in our dataset, this study demonstrates the great potential to improve the performance of a CAD system for nodule detection using the proposed SC(2)SLLE. Copyright © 2016 Elsevier Ireland Ltd. All rights reserved.

  3. Plasma balls in large-N gauge theories and localized black holes

    International Nuclear Information System (INIS)

    Aharony, Ofer; Minwalla, Shiraz; Wiseman, Toby

    2006-01-01

    We argue for the existence of plasma balls-metastable, nearly homogeneous lumps of gluon plasma at just above the deconfinement energy density-in a class of large-N confining gauge theories that undergo first-order deconfinement transitions. Plasma balls decay over a time scale of order N 2 by thermally radiating hadrons at the deconfinement temperature. In gauge theories that have a dual description that is well approximated by a theory of gravity in a warped geometry, we propose that plasma balls map to a family of classically stable finite-energy black holes localized in the IR. We present a conjecture for the qualitative nature of large-mass black holes in such backgrounds and numerically construct these black holes in a particular class of warped geometries. These black holes have novel properties; in particular, their temperature approaches a nonzero constant value at large mass. Black holes dual to plasma balls shrink as they decay by Hawking radiation; towards the end of this process, they resemble ten-dimensional Schwarzschild black holes, which we propose are dual to small plasma balls. Our work may find practical applications in the study of the physics of localized black holes from a dual viewpoint

  4. Testing the non-locality of quantum theory in two-kaon systems

    Energy Technology Data Exchange (ETDEWEB)

    Eberhard, P.H. (California Univ., Berkeley (United States). Lawrence Berkeley Lab.)

    1993-06-07

    An idea for testing the non-local character of quantum theory in systems made of two neutral kaons is suggested. Such tests require detecting two long-lived or two short-lived neutral kaons in coincidence, when copper slabs are either interposed on or removed from their paths. They may be performed at an asymmetric [Phi][sup 0]-factory. They could answer some questions raised by the EPR paradox and Bell's inequalities. If such tests are performed and if predictions of quantum mechanics and standard theory of kaon regeneration are verified experimentally, all descriptions of the relevant phenomena in terms of local interactions will be ruled out in principle with the exception of very peculiar ones, which imply the existence of hidden variables, of different kinds of kaons corresponding to different values of the hidden variables, and, for some of these kaons, of regeneration probabilities enhanced by a factor of the order of 400 or more over the average. Of course, the experiment may also reveal a break down of quantum theory. (orig.)

  5. Coexistence in neutral theories: interplay of criticality and mild local preferences

    International Nuclear Information System (INIS)

    Borile, Claudio; Molina-Garcia, Daniel; Muñoz, Miguel A; Maritan, Amos

    2015-01-01

    Neutral theories have played a crucial and revolutionary role in fields such as population genetics and biogeography. These theories are critical by definition, in the sense that the overall growth rate of each single allele/species/type vanishes. Thus each species in a neutral model sits at the edge between invasion and extinction, allowing for the coexistence of symmetric/neutral types. However, in finite systems, mono-dominated states are ineluctably reached in relatively short times owing to demographic fluctuations, thus leaving us with an unsatisfactory framework to rationalize empirically-observed long-term coexistence. Here, we scrutinize the effect of heterogeneity in quasi-neutral theories, in which there can be a local mild preference for some of the competing species at some sites, even if the overall species symmetry is maintained. As we show here, mild biases at a small fraction of locations suffice to induce overall robust and durable species coexistence, even in regions arbitrarily far apart from the biased locations. This result stems from the long-range nature of the underlying critical bulk dynamics and has a number of implications, for example, in conservation ecology as it suggests that constructing local specific ‘sanctuaries’ for different competing species can result in global enhancement of biodiversity, even in regions arbitrarily distant from the protected refuges. (paper)

  6. The effects of local correlations on the electronic structure of FeSe

    Science.gov (United States)

    Watson, Matthew; Kim, Timur; Haghighirad, Amir; Coldea, Amalia

    FeSe is structurally the simplest of Fe-based superconductors, but its complex and unique properties pose important theoretical questions. One important aspect of the physics of FeSe is the understanding of the strength and effects of electronic correlations. In order to explore this, we have performed angle-resolved photo-emission spectroscopy (ARPES) measurements on high quality bulk single crystals of FeSe over a wide range of binding energies, in different scattering geometries and with varying incident photon energies, analysing the quasiparticle renormalisations, scattering rates and degree of coherence. We find that FeSe exhibits moderately strong, orbital-dependent correlation effects which are understood to arise primarily due to local electron-electron interactions on the Fe sites. We conclude that electronic correlations constitute a key ingredient in understanding the electronic structure of FeSe. Part of this work was supported by EPSRC, UK (EP/I004475/1, EP/I017836/1). We thank Diamond Light Source for access to Beamline I05.

  7. Derivative discontinuity and exchange-correlation potential of meta-GGAs in density-functional theory

    International Nuclear Information System (INIS)

    Eich, F. G.; Hellgren, Maria

    2014-01-01

    We investigate fundamental properties of meta-generalized-gradient approximations (meta-GGAs) to the exchange-correlation energy functional, which have an implicit density dependence via the Kohn-Sham kinetic-energy density. To this purpose, we construct the most simple meta-GGA by expressing the local exchange-correlation energy per particle as a function of a fictitious density, which is obtained by inverting the Thomas-Fermi kinetic-energy functional. This simple functional considerably improves the total energy of atoms as compared to the standard local density approximation. The corresponding exchange-correlation potentials are then determined exactly through a solution of the optimized effective potential equation. These potentials support an additional bound state and exhibit a derivative discontinuity at integer particle numbers. We further demonstrate that through the kinetic-energy density any meta-GGA incorporates a derivative discontinuity. However, we also find that for commonly used meta-GGAs the discontinuity is largely underestimated and in some cases even negative

  8. Derivative discontinuity and exchange-correlation potential of meta-GGAs in density-functional theory.

    Science.gov (United States)

    Eich, F G; Hellgren, Maria

    2014-12-14

    We investigate fundamental properties of meta-generalized-gradient approximations (meta-GGAs) to the exchange-correlation energy functional, which have an implicit density dependence via the Kohn-Sham kinetic-energy density. To this purpose, we construct the most simple meta-GGA by expressing the local exchange-correlation energy per particle as a function of a fictitious density, which is obtained by inverting the Thomas-Fermi kinetic-energy functional. This simple functional considerably improves the total energy of atoms as compared to the standard local density approximation. The corresponding exchange-correlation potentials are then determined exactly through a solution of the optimized effective potential equation. These potentials support an additional bound state and exhibit a derivative discontinuity at integer particle numbers. We further demonstrate that through the kinetic-energy density any meta-GGA incorporates a derivative discontinuity. However, we also find that for commonly used meta-GGAs the discontinuity is largely underestimated and in some cases even negative.

  9. Localization in fluids: A comparison of competing theories and their application to positron annihilation

    International Nuclear Information System (INIS)

    Miller, B.N.; Fan, Y.

    1990-01-01

    This paper addresses two central issues in our understanding of self-trapping, or localization, of a light particle (e.g., electron, positron, or positronium atom) in a fluid. The first concerns the relationship between the mean-field calculations of localized states carried out from the mid-1950s until the present, and the direct calculation of light-particle (LP) properties from the adiabatic model. The second concerns the universality of the ring polymer representation of the LP, which has proved to be extremely useful for computing the properties of localized electrons. We first demonstrate that the mean-field theories of localization, which are derived from density functionals, can be obtained from the adiabatic model by employing a Gutzwiller type of approximation. We then study the application of the adiabatic model, via the polymer representation, to the annihilation of positrons and positronium atoms in a fluid. Expressions for the decay rate and its variance are derived in terms of the two- and three-point distribution functions for the polymer sites and positions of the atomic nuclei. The momentum distribution of the localized LP is shown to be proportional to the Fourier transform of the distribution function for the displacement between the ends of a broken polymer

  10. Quantum field theories coupled to supergravity. AdS/CFT and local couplings

    International Nuclear Information System (INIS)

    Grosse, J.

    2006-01-01

    This dissertation is devoted to the investigation of the interplay of supersymmetric Yang-Mills theories (SYM) and supergravity (SUGRA). The topic is studied from two points of view: Firstly from the point of view of AdS/CFT correspondence, which realises the coupling of four dimensional superconformal N=4 SYM theory and ten dimensional type IIB SUGRA in a holographic way. In order to arrive at theories that resemble quantum chromodynamics (QCD) more closely, fundamental fields are introduced using probe D7-branes and nontrivial background configuration are considered. In particular supergravity solutions that are only asymptotically anti-de Sitter and break supersymmetry are used. This allows the description of spontaneous chiral symmetry breaking. The meson spectrum is calculated and the existence of an associated Goldstone mode is demonstrated. Moreover it is shown that highly radially excited mesons are not degenerate. Additionally instanton configurations on the D7-branes are investigated, which lead to a holographic description of the dual field theory's Higgs branch. Finally a holographic description of heavy-light mesons is developed, which are mesons consisting of quarks with a large mass difference, such that a treatment of B mesons can be achieved. The second approach to the topic of this thesis is the technique of socalled space-time dependent couplings (also known as ''local couplings''), where coupling constants are promoted to external sources. This allows to explore the conformal anomaly of quantum field theories coupled to a classical gravity background. The technique is extended to the superfield description of N=1 supergravity, a complete basis for the anomaly is given and the consistency conditions that arise from a cohomological treatment are calculated. Possible implications for an extension of Zamolodchikov's c-theorem to four dimensional supersymmetric quantum field theories are discussed. (orig.)

  11. Quantum field theories coupled to supergravity. AdS/CFT and local couplings

    Energy Technology Data Exchange (ETDEWEB)

    Grosse, J.

    2006-08-03

    This dissertation is devoted to the investigation of the interplay of supersymmetric Yang-Mills theories (SYM) and supergravity (SUGRA). The topic is studied from two points of view: Firstly from the point of view of AdS/CFT correspondence, which realises the coupling of four dimensional superconformal N=4 SYM theory and ten dimensional type IIB SUGRA in a holographic way. In order to arrive at theories that resemble quantum chromodynamics (QCD) more closely, fundamental fields are introduced using probe D7-branes and nontrivial background configuration are considered. In particular supergravity solutions that are only asymptotically anti-de Sitter and break supersymmetry are used. This allows the description of spontaneous chiral symmetry breaking. The meson spectrum is calculated and the existence of an associated Goldstone mode is demonstrated. Moreover it is shown that highly radially excited mesons are not degenerate. Additionally instanton configurations on the D7-branes are investigated, which lead to a holographic description of the dual field theory's Higgs branch. Finally a holographic description of heavy-light mesons is developed, which are mesons consisting of quarks with a large mass difference, such that a treatment of B mesons can be achieved. The second approach to the topic of this thesis is the technique of socalled space-time dependent couplings (also known as ''local couplings''), where coupling constants are promoted to external sources. This allows to explore the conformal anomaly of quantum field theories coupled to a classical gravity background. The technique is extended to the superfield description of N=1 supergravity, a complete basis for the anomaly is given and the consistency conditions that arise from a cohomological treatment are calculated. Possible implications for an extension of Zamolodchikov's c-theorem to four dimensional supersymmetric quantum field theories are discussed. (orig.)

  12. Evaluation of Forming Limit by the 3 Dimensional Local Bifurcation Theory

    International Nuclear Information System (INIS)

    Nishimura, Ryuichi; Nakazawa, Yoshiaki; Ito, Koichi; Uemura, Gen; Mori, Naomichi

    2007-01-01

    A theoretical prediction and evaluation method for the sheet metal formability is developed on the basis of the three-dimensional local bifurcation theory previously proposed by authors. The forming limit diagram represented on the plane defined by the ratio of stress component to work-hardening rate is perfectly independent of plastic strain history. The upper and the lower limit of the sheet formability are indicated by the 3D critical line and the Stoeren-Rice's critical line on this plane, respectively. In order to verify the above mentioned behavior of the proposed forming limit diagram, the experimental research is also conducted. From the standpoint of the mechanical instability theory, a new concept called instability factor is introduced. It represents a degree of acceleration by current stress for developing the local bifurcation mode toward a fracture. The instability factor provides a method to evaluate a forming allowance which is useful to appropriate identification for a forming limit and to optimize the forming condition. The proposed criterion provides not only the moment to initiate the necking but also the local bifurcation mode vector and the direction of necking line

  13. Assessing Covalency in Cerium and Uranium Hexachlorides: A Correlated Wavefunction and Density Functional Theory Study

    Directory of Open Access Journals (Sweden)

    Reece Beekmeyer

    2015-11-01

    Full Text Available The electronic structure of a series of uranium and cerium hexachlorides in a variety of oxidation states was evaluated at both the correlated wavefunction and density functional (DFT levels of theory. Following recent experimental observations of covalency in tetravalent cerium hexachlorides, bonding character was studied using topological and integrated analysis based on the quantum theory of atoms in molecules (QTAIM. This analysis revealed that M–Cl covalency was strongly dependent on oxidation state, with greater covalency found in higher oxidation state complexes. Comparison of M–Cl delocalisation indices revealed a discrepancy between correlated wavefunction and DFT-derived values. Decomposition of these delocalisation indices demonstrated that the origin of this discrepancy lay in ungerade contributions associated with the f-manifold which we suggest is due to self-interaction error inherent to DFT-based methods. By all measures used in this study, extremely similar levels of covalency between complexes of U and Ce in the same oxidation state was found.

  14. Using Generalizability Theory to Disattenuate Correlation Coefficients for Multiple Sources of Measurement Error.

    Science.gov (United States)

    Vispoel, Walter P; Morris, Carrie A; Kilinc, Murat

    2018-05-02

    Over the years, research in the social sciences has been dominated by reporting of reliability coefficients that fail to account for key sources of measurement error. Use of these coefficients, in turn, to correct for measurement error can hinder scientific progress by misrepresenting true relationships among the underlying constructs being investigated. In the research reported here, we addressed these issues using generalizability theory (G-theory) in both traditional and new ways to account for the three key sources of measurement error (random-response, specific-factor, and transient) that affect scores from objectively scored measures. Results from 20 widely used measures of personality, self-concept, and socially desirable responding showed that conventional indices consistently misrepresented reliability and relationships among psychological constructs by failing to account for key sources of measurement error and correlated transient errors within occasions. The results further revealed that G-theory served as an effective framework for remedying these problems. We discuss possible extensions in future research and provide code from the computer package R in an online supplement to enable readers to apply the procedures we demonstrate to their own research.

  15. Extension of Hartree-Fock theory including tensor correlation in nuclear matter

    Science.gov (United States)

    Hu, Jinniu; Toki, Hiroshi; Ogawa, Yoko

    2013-10-01

    We study the properties of nuclear matter in the extension of Hartree-Fock theory including tensor correlation using a realistic nucleon-nucleon (NN) interaction. The nuclear wave function consists of the Hartree-Fock and two-particle-two-hole (2p-2h) states, following the concept of the tensor-optimized shell model (TOSM) for light nuclei. The short range repulsion and strong tensor force of realistic NN interaction provide high momentum components, which are taken into account in a many-body framework by introducing 2p-2h states. Single particle states are determined by the variational principle of the total energy with respect to 2p-2h amplitudes and Hartree-Fock (HF) single-particle states. The resulting differential equation is almost identical with that of Brueckner-Hartree-Fock (BHF) theory by taking two-body scattering terms only. We calculate the equation of state (EOS) of nuclear matter in this framework with the Bonn potential as a realistic NN interaction. We found similar results to BHF theory with slightly repulsive effects in the total energy. The relativistic effect is discussed for the EOSs of nuclear matter in both non-relativistic and relativistic frameworks. The momentum distribution has large components at high momenta due to 2p-2h excitations. We also obtain the EOSs of pure neutron matter, where the tensor effect is small in the iso-vector channel.

  16. Plasma heating by relativistic electron beams: correlations between experiment and theory

    International Nuclear Information System (INIS)

    Thode, L.E.; Godfrey, B.B.

    1975-01-01

    The streaming instability is the primary heating mechanism in most, if not all, experiments in which the beam is injected into partially or fully ionized gas. In plasma heating experiments, the relativistic beam must traverse an anode foil before interacting with the plasma. The linear theory for such a scattered beam is discussed, including a criterion for the onset of the kinetic interaction. A nonlinear model of the two-stream instability for a scattered beam is developed. Using this model, data from ten experiments are unfolded to obtain the following correlations: (i) for a fixed anode foil, the dependence of the plasma heating on the beam-to-plasma density ratio is due to anode foil scattering, (ii) for a fixed beam-to-plasma density ratio, the predicted change in the magnitude of plasma heating as a function of the anode foil is in agreement with experiment, and (iii) the plasma heating tentatively appears to be proportional to the beam kinetic energy density and beam pulse length. For a fixed anode foil, theory also predicts that the energy deposition is improved by increasing the beam electron energy γmc 2 . Presently, no experiment has been performed to confirm this aspect of the theory

  17. Lattice relaxation theory of localized excitations in quasi-one-dimensional systems

    International Nuclear Information System (INIS)

    Wang Chuilin; Su Zhaobin; Yu Lu.

    1993-04-01

    The lattice relaxation theory developed earlier by Su and Yu for solitons and polarons in conducting polymers is applied to systems with both electron-phonon and electron-electron interactions, described by a single band Peierls-Hubbard model. The localized excitations in the competing bond-order-wave (BOW), charge-density-wave (CDW) and spin-density-wave (SDW) systems show interesting new features in their dynamics. In particular, a non-monotonic dependence of the relaxation rate on the coupling strength is predicted from the theory. The possible connection of this effect with photo-luminescence experiments is discussed. Similar phenomena may occur in other quasi-one-dimensional systems as well. (author). 21 refs, 4 figs

  18. Adolescent Peer Relations and Socioemotional Development in Latin America: Translating International Theory into Local Research.

    Science.gov (United States)

    Berger, Christian; Lisboa, Carolina; Cuadros, Olga; de Tezanos-Pinto, Pablo

    2016-06-01

    Peer relations constitute a main developmental context for adolescents. Peers offer an instance for identity definition and set the norms of acceptable and valued characteristics, behaviors, and attitudes, representing a societal model that allows and restrains avenues for adolescents' socioemotional development. The present article departs from these considerations to review research on adolescents' peer relations in Latin America from a socioemotional perspective. First, approaches to adolescence are discussed, with a main focus on attachment and identity theories, based on a bioecological framework. Then, a review of research in Latin America on friendships, school climate, and intergroup relations is presented. The discussion addresses the tension between theories and evidence generated in developed societies and highlights the particularities of Latin American youth, stressing the need for collecting local data. © 2016 Wiley Periodicals, Inc.

  19. Current Issues in Finite-T Density-Functional Theory and Warm-Correlated Matter †

    Directory of Open Access Journals (Sweden)

    M. W. C. Dharma-wardana

    2016-03-01

    Full Text Available Finite-temperature density functional theory (DFT has become of topical interest, partly due to the increasing ability to create novel states of warm-correlated matter (WCM.Warm-dense matter (WDM, ultra-fast matter (UFM, and high-energy density matter (HEDM may all be regarded as subclasses of WCM. Strong electron-electron, ion-ion and electron-ion correlation effects and partial degeneracies are found in these systems where the electron temperature Te is comparable to the electron Fermi energy EF. Thus, many electrons are in continuum states which are partially occupied. The ion subsystem may be solid, liquid or plasma, with many states of ionization with ionic charge Zj. Quasi-equilibria with the ion temperature Ti ≠ Te are common. The ion subsystem in WCM can no longer be treated as a passive “external potential”, as is customary in T = 0 DFT dominated by solid-state theory or quantum chemistry. Many basic questions arise in trying to implement DFT for WCM. Hohenberg-Kohn-Mermin theory can be adapted for treating these systems if suitable finite-T exchange-correlation (XC functionals can be constructed. They are functionals of both the one-body electron density ne and the one-body ion densities ρj. Here, j counts many species of nuclei or charge states. A method of approximately but accurately mapping the quantum electrons to a classical Coulomb gas enables one to treat electron-ion systems entirely classically at any temperature and arbitrary spin polarization, using exchange-correlation effects calculated in situ, directly from the pair-distribution functions. This eliminates the need for any XC-functionals. This classical map has been used to calculate the equation of state of WDM systems, and construct a finite-T XC functional that is found to be in close agreement with recent quantum path-integral simulation data. In this review, current developments and concerns in finite-T DFT, especially in the context of non-relativistic warm

  20. Comparison of subset-based local and FE-based global digital image correlation: Theoretical error analysis and validation

    KAUST Repository

    Pan, B.; Wang, Bo; Lubineau, Gilles

    2016-01-01

    Subset-based local and finite-element-based (FE-based) global digital image correlation (DIC) approaches are the two primary image matching algorithms widely used for full-field displacement mapping. Very recently, the performances

  1. The correlation between selenium adsorption and the mineral and chemical composition of Taiwan local granite samples

    Energy Technology Data Exchange (ETDEWEB)

    Wang, TsingHai; Chiang, Chu-Ling; Wang, Chu-Fang [National Tsing Hua Univ., Hsinchu, Taiwan (China). Biomedical Engineering and Environmental Sciences

    2015-07-01

    Selenium-79 (Se-79) is a radioactive isotope of selenium, which is considered as one of the highly mobile nuclides since Se-79 would be presented in an anion species when dissolving into the intruded groundwater. Being an anionic species, the transport of Se-79 would be regulated by the metal oxides relevant minerals such as goethite and hematite (Jan et al., 2008). This is true that the transport of selenium in the shallow surface environment could be relatively easy to estimate by considering the amount of these metal oxides presenting in the soils and sediments. However, when dealing with deep geological repository, the transport of Se-79 becomes less predictable because of the much less content of metal oxide residing in the host rock such as granite. In order to conduct a reliable performance assessment of repository, it is very important to establish the correlation between selenium adsorption and the properties of potential host rock, in this study, the mineral and chemical compositions of Taiwan local granite. From this point of view, selenium adsorption experiments were conducted with 54 different Taiwan local granite samples collected from the depth ranging from 100 ∝ 400 meters below the surface. These granite samples represent a variety of deep geological environments, including the intact rock, groundwater intruded zones, and some weathered samples. Based upon our preliminary results, several solid conclusions could be made. First, the correlation coefficients between the Kd values and the mineral and chemical compositions are rather low (R-square values are often < 0.2). This points out the complexity of these geological samples and strongly suggests more efforts should be put into to acquire more relevant information. Second, the correlation between the selenium Kd values and the content of iron oxide (R-square 0.110) is much higher than that between the CEC of these granite samples (R-square 0.001). This clearly indicates that the minerals that

  2. On the treatment of nonlinear local feedbacks within advanced nodal generalized perturbation theory

    International Nuclear Information System (INIS)

    Maldonado, G.I.; Turinsky, P.J.; Kropaczek, D.J.

    1993-01-01

    Recent efforts to upgrade the underlying neutronics formulations within the in-core nuclear fuel management optimization code FORMOSA (Ref. 1) have produced two important developments; first, a computationally efficient and second-order-accurate advanced nodal generalized perturbation theory (GPT) model [derived from the nonlinear iterative nodal expansion method (NEM)] for evaluating core attributes (i.e., k eff and power distribution versus cycle burnup), and second, an equally efficient and accurate treatment of local thermal-hydraulic and fission product feedbacks embedded within NEM GPT. The latter development is the focus of this paper

  3. On the local theory of resonant inelastic collisions of slow electrons with carbon dioxide

    International Nuclear Information System (INIS)

    Kazansky, A.K.; Sergeeva, L.Yu.

    1994-01-01

    A method of calculating the cross sections of inelastic vibronic transitions in collisions of slow electrons with polyatomic molecules in the framework of the local theory (the 'boomerang' model) is proposed. The method is based on the study of the time evolution of the initial vibronic wavefunction; the evolution is governed by the (complex valued) Hamiltonian of the intermediate anion state. The method has been applied to the consideration of inelastic electron collisions with the CO 2 molecule in the two-mode approximation (symmetrical stretching and bending). The results obtained demonstrate the importance of the two-mode description for the system which can undergo the Renner transition. (Author)

  4. Constraints for anomalous dimensions of local light-cone operators in [φ3]6 theory

    International Nuclear Information System (INIS)

    Mueller, D.

    1991-01-01

    Using the MS scheme, we derive in [φ 3 ] 6 theory the collinear conformal Ward identity for the Green's functions of local light-cone operators of leading twist. The Ward identity for special collinear conformal transformations and renormalization group invariance give constraints for the off-diagonal part of the anomalous dimension matrix for the general case of β≠0. We compute the anomaly of special conformal tranformation in lowest loop order and obtain from the constraints the off-diagonal part of the anomalous dimension in 2-loop order. (orig.)

  5. Investigation of the local component of power-reactor noise via diffusion theory

    International Nuclear Information System (INIS)

    Kosaly, G.

    1975-03-01

    The aim of the paper is to provide a theoretical background for the phenomenological model, which postulates the existence of a local component in the neutron noise of a light water cooled boiling water reactor. After the introductory review of the phenomenological model, noise calculation are performed by help of the one-group and two-group diffusion theory. Only in the two-group diffusion model it is succeeded to find a term in the response to a propagating disturbance of density which results in a small volume of neutrons physical sensivity around the point of observation. The problem, whether this local component can be a dominating term in the solution or not, is investigated in the Appenix. (Sz.Z.)

  6. Crack phantoms: localized damage correlations and failure in network models of disordered materials

    International Nuclear Information System (INIS)

    Zaiser, M; Moretti, P; Lennartz-Sassinek, S

    2015-01-01

    We study the initiation of failure in network models of disordered materials such as random fuse and spring models, which serve as idealized representations of fracture processes in quasi-two-dimensional, disordered material systems. We consider two different geometries, namely rupture of thin sheets and delamination of thin films, and demonstrate that irrespective of geometry and implementation of the disorder (random failure thresholds versus dilution disorder) failure initiation is associated with the emergence of typical localized correlation structures in the damage patterns. These structures (‘crack phantoms’) exhibit well-defined characteristic lengths, which relate to the failure stress by scaling relations that are typical for critical crack nuclei in disorder-free materials. We discuss our findings in view of the fundamental nature of failure processes in materials with random microstructural heterogeneity. (paper)

  7. Measurements of atmospheric aerosol in the Salentum Peninsula and its correlation with local meteorology

    International Nuclear Information System (INIS)

    Belosi, F.; Prodi, F.; Contini, D.; Donateo, A.

    2006-01-01

    In this paper the results of measurements of Total Suspended Particles (TSP), PM10 and PM2.5 and their correlation with meteorological parameters are presented. The samplings were carried out with a mobile laboratory in seven locations in the Salentum Peninsula located in the southeastern part of Italy in Puglia. Measurements were taken discontinuously during the period 2002-2005. Up to now no systematic analyses of aerosol concentrations in the Salentum Peninsula have been presented in the scientific literature. This study is therefore a useful basis for assessing the local situation and for planning future monitoring. Measurements have been performed, on a daily basis, using standard European inlet (CEN-EN12341, 1998) and successive gravimetric detection of aerosol deposited on filters. The measurement sites can be considered representative of urban background for all the cases investigated. An analysis of the random uncertainties (LOQ and LOD) for the different types of filters used is reported. Results show concentrations in good agreement with lognormal distributions, indicating that the PM10 fraction is about 66% of TSP and PM2.5 is about 67% of PM10, which has allowed to evaluate that the fraction of PM2.5 is about 44% of TSP. Concentration levels were correlated with local meteorological parameters, especially with wind velocity and precipitations. Results indicate that during rainy days the average concentration is reduced of about 70% and the reduction is larger for TSP and PM10 with respect to PM2.5. There is, on average, a substantial decrease of concentration levels in high wind conditions. Results also suggest the possibility of a significant contribution of African dust to PM10 and TSP, especially in the spring and summer season, which could be responsible for some days with concentrations above the threshold imposed by the European legislation on PM10

  8. Image-defined Risk Factors Correlate with Surgical Radicality and Local Recurrence in Patients with Neuroblastoma.

    Science.gov (United States)

    Pohl, A; Erichsen, M; Stehr, M; Hubertus, J; Bergmann, F; Kammer, B; von Schweinitz, D

    2016-04-01

    Neuroblastoma is the second most common solid pediatric tumor and the most common cancer to be detected in children younger than 12 months of age. To date, 2 different staging systems describe the extent of the disease: the International Neuroblastoma Staging System (INSS) and the International Neuroblastoma Risk Group Staging System (INRGSS). The INRGSS-system is characterized by the presence or absence of so called image-defined risk factors (IDRFs), which are described as surgical risk factors. We hypothesized that IDRFs correlate with surgical complications, surgical radicality, local recurrence and overall survival (OS). Between 2003 and 2010, 102 patients had neuroblastoma surgery performed in our department. We analyzed medical records for IDRF-status and above named data. 16 patients were IDRF-negative, whereas 86 patients showed one or more IDRF. Intra- or postoperative complications have been reported in 21 patients (21%). 19 of them showed one or more IDRF and 2 patients were IDRF-negative (p=n.s.). Patients who suffered from intra- or postoperative complications demonstrated a decreased OS (p=0.011). Statistical analysis revealed an inverse correlation between the extent of macroscopical removal and IDRF-status (p=0.001). Furthermore, the number of IDRFs were associated with a decreased likelihood of radical tumor resection (p<0.001). 19 patients had local recurrence; all of them were IDRF-positive (p=0.037). Pediatric surgeons should consider IDRFs as a useful tool for risk assessment and therefore planning for neuroblastoma surgery. © Georg Thieme Verlag KG Stuttgart · New York.

  9. Application of time-dependent current-density-functional theory to nonlocal exchange-correlation effects in polymers

    NARCIS (Netherlands)

    van Faassen, M; de Boeij, PL; van Leeuwen, R; Berger, JA; Snijders, JG

    2003-01-01

    We provide a successful approach towards the solution of the longstanding problem of the large overestimation of the static polarizability of conjugated oligomers obtained using the local density approximation within density-functional theory. The local approximation is unable to describe the highly

  10. To the theory of spin-charge separation in one-dimensional correlated electron systems

    International Nuclear Information System (INIS)

    Zvyagin, A.A.

    2004-01-01

    Spin-charge separation is considered to be one of the key properties that distinguish low-dimensional electron systems from others. Three-dimensional correlated electron systems are described by the Fermi liquid theory. There, low-energy excitations (quasiparticles) are reminiscent of noninteracting electrons: They carry charges -e and spins 1/2 . It is believed that for any one-dimensional correlated electron system, low-lying electron excitations carry either only spin and no charge, or only charge without spin. That is why recent experiments looked for such low-lying collective electron excitations, one of which carries only spin, and the other carries only charge. Here we show that despite the fact that for exactly solvable one-dimensional correlated electron models there exist excitations which carry only spin and only charge, in all these models with short-range interactions the low-energy physics is described by low-lying collective excitations, one of which carries both spin and charge

  11. General solution of an exact correlation function factorization in conformal field theory

    International Nuclear Information System (INIS)

    Simmons, Jacob J H; Kleban, Peter

    2009-01-01

    The correlation function factorization with K a boundary operator product expansion coefficient, is known to hold for certain scaling operators at the two-dimensional percolation point and in a few other cases. Here the correlation functions are evaluated in the upper half-plane (or any conformally equivalent region) with x 1 and x 2 arbitrary points on the real axis, and z an arbitrary point in the interior. This type of result is of interest because it is both exact and universal, relates higher-order correlation functions to lower-order ones and has a simple interpretation in terms of cluster or loop probabilities in several statistical models. This motivated us to use the techniques of conformal field theory to determine the general conditions for its validity. Here, we discover that either (see display) factorizes in this way for any central charge c, generalizing previous results. In particular, the factorization holds for either FK (Fortuin–Kasteleyn) or spin clusters in the Q-state Potts models; it also applies to either the dense or dilute phases of the O(n) loop models. Further, only one other non-trivial set of highest-weight operators (in an irreducible Verma module) factorizes in this way. In this case the operators have negative dimension (for c<1) and do not seem to have a physical realization

  12. A time correlation function theory describing static field enhanced third order optical effects at interfaces.

    Science.gov (United States)

    Neipert, Christine; Space, Brian

    2006-12-14

    Sum vibrational frequency spectroscopy, a second order optical process, is interface specific in the dipole approximation. At charged interfaces, there exists a static field, and as a direct consequence, the experimentally detected signal is a combination of enhanced second and static field induced third order contributions. There is significant evidence in the literature of the importance/relative magnitude of this third order contribution, but no previous molecularly detailed approach existed to separately calculate the second and third order contributions. Thus, for the first time, a molecularly detailed time correlation function theory is derived here that allows for the second and third order contributions to sum frequency vibrational spectra to be individually determined. Further, a practical, molecular dynamics based, implementation procedure for the derived correlation functions that describe the third order phenomenon is also presented. This approach includes a novel generalization of point atomic polarizability models to calculate the hyperpolarizability of a molecular system. The full system hyperpolarizability appears in the time correlation functions responsible for third order contributions in the presence of a static field.

  13. Modular structure of the local algebras associated with the free massless scalar field theory

    International Nuclear Information System (INIS)

    Hislop, P.D.; Longo, R.

    1982-01-01

    The modular structure of the von Neuman algebra of local observables associated with a double cone in the vacuum representation of the free massless scalar field theory of any number of dimensions is described. The modular automorphism group is induced by the unitary implementation of a family of generalized fractional linear transformations on Minkowski space and is a subgroup of the conformal group. The modular conjugation operator is the anti-unitary impementation of a product of time reversal and relativistic ray inversion. The group generated by the modular conjugation operators for the local algebras associated with the family of double cone regions is the group of proper conformal transformations. A theorem is presented asserting the unitary equivalence of local algebras associated with lightcones, double cones and wedge regions. For the double cone algebras, this provides an explicitly realization of spacelike duality and establishes the known type III 1 factor property. It is shown that the timelike duality property of the lightcone algebras does not hold for the double cone algebras. A different definition of the von Neumann algebras associated with a region is introduced which agrees with the standard one for a lightcone or a double cone region but which allows the timelike duality property for the double cone algebras. In the case of one spatial dimension, the standard local algebras associated with the double cone regions satisfy both specelike and timelike duality. (orig.)

  14. Local and linear chemical reactivity response functions at finite temperature in density functional theory

    International Nuclear Information System (INIS)

    Franco-Pérez, Marco; Ayers, Paul W.; Gázquez, José L.; Vela, Alberto

    2015-01-01

    We explore the local and nonlocal response functions of the grand canonical potential density functional at nonzero temperature. In analogy to the zero-temperature treatment, local (e.g., the average electron density and the local softness) and nonlocal (e.g., the softness kernel) intrinsic response functions are defined as partial derivatives of the grand canonical potential with respect to its thermodynamic variables (i.e., the chemical potential of the electron reservoir and the external potential generated by the atomic nuclei). To define the local and nonlocal response functions of the electron density (e.g., the Fukui function, the linear density response function, and the dual descriptor), we differentiate with respect to the average electron number and the external potential. The well-known mathematical relationships between the intrinsic response functions and the electron-density responses are generalized to nonzero temperature, and we prove that in the zero-temperature limit, our results recover well-known identities from the density functional theory of chemical reactivity. Specific working equations and numerical results are provided for the 3-state ensemble model

  15. CD146 expression on primary nonhematopoietic bone marrow stem cells is correlated with in situ localization

    Science.gov (United States)

    Tormin, Ariane; Li, Ou; Brune, Jan Claas; Walsh, Stuart; Schütz, Birgit; Ehinger, Mats; Ditzel, Nicholas; Kassem, Moustapha

    2011-01-01

    Nonhematopoietic bone marrow mesenchymal stem cells (BM-MSCs) are of central importance for bone marrow stroma and the hematopoietic environment. However, the exact phenotype and anatomical distribution of specified MSC populations in the marrow are unknown. We characterized the phenotype of primary human BM-MSCs and found that all assayable colony-forming units-fibroblast (CFU-Fs) were highly and exclusively enriched not only in the lin−/CD271+/CD45−/CD146+ stem-cell fraction, but also in lin−/CD271+/CD45−/CD146−/low cells. Both populations, regardless of CD146 expression, shared a similar phenotype and genotype, gave rise to typical cultured stromal cells, and formed bone and hematopoietic stroma in vivo. Interestingly, CD146 was up-regulated in normoxia and down-regulated in hypoxia. This was correlated with in situ localization differences, with CD146 coexpressing reticular cells located in perivascular regions, whereas bone-lining MSCs expressed CD271 alone. In both regions, CD34+ hematopoietic stem/progenitor cells were located in close proximity to MSCs. These novel findings show that the expression of CD146 differentiates between perivascular versus endosteal localization of non-hematopoietic BM-MSC populations, which may be useful for the study of the hematopoietic environment. PMID:21415267

  16. Local Th17/IgA immunity correlate with protection against intranasal infection with Streptococcus pyogenes.

    Directory of Open Access Journals (Sweden)

    Rasmus Mortensen

    Full Text Available Streptococcus pyogenes (group A streptococcus, GAS is responsible for a wide array of infections. Respiratory transmission via droplets is the most common mode of transmission but it may also infect the host via other routes such as lesions in the skin. To advance the development of a future vaccine against GAS, it is therefore important to investigate how protective immunity is related to the route of vaccine administration. To explore this, we examined whether a parenterally administered anti-GAS vaccine could protect against an intranasal GAS infection or if this would require locally primed immunity. We foundd that a parenteral CAF01 adjuvanted GAS vaccine offered no protection against intranasal infection despite inducing strong systemic Th1/Th17/IgG immunity that efficiently protected against an intraperitoneal GAS infection. However, the same vaccine administered via the intranasal route was able to induce protection against repeated intranasal GAS infections in a murine challenge model. The lack of intranasal protection induced by the parenteral vaccine correlated with a reduced mucosal recall response at the site of infection. Taken together, our results demonstrate that locally primed immunity is important for the defense against intranasal infection with Streptococcus pyogenes.

  17. A Spalart-Allmaras local correlation-based transition model for Thermo-fuid dynamics

    Science.gov (United States)

    D'Alessandro, V.; Garbuglia, F.; Montelpare, S.; Zoppi, A.

    2017-11-01

    The study of innovative energy systems often involves complex fluid flows problems and the Computational Fluid-Dynamics (CFD) is one of the main tools of analysis. It is important to put in evidence that in several energy systems the flow field experiences the laminar-to-turbulent transition. Direct Numerical Simulations (DNS) or Large Eddy Simulation (LES) are able to predict the flow transition but they are still inapplicable to the study of real problems due to the significant computational resources requirements. Differently standard Reynolds Averaged Navier Stokes (RANS) approaches are not always reliable since they assume a fully turbulent regime. In order to overcome this drawback in the recent years some locally formulated transition RANS models have been developed. In this work, we present a local correlation-based transition approach adding two equations that control the laminar-toturbulent transition process -γ and \\[\\overset{}{\\mathop{{{\\operatorname{Re}}θ, \\text{t}}}} \\] - to the well-known Spalart-Allmaras (SA) turbulence model. The new model was implemented within OpenFOAM code. The energy equation is also implemented in order to evaluate the model performance in thermal-fluid dynamics applications. In all the considered cases a very good agreement between numerical and experimental data was observed.

  18. Quantifying spatial scaling patterns and their local and regional correlates in headwater streams: implications for resilience

    Directory of Open Access Journals (Sweden)

    Emma Göthe

    2014-09-01

    Full Text Available The distribution of functional traits within and across spatiotemporal scales has been used to quantify and infer the relative resilience across ecosystems. We use explicit spatial modeling to evaluate within- and cross-scale redundancy in headwater streams, an ecosystem type with a hierarchical and dendritic network structure. We assessed the cross-scale distribution of functional feeding groups of benthic invertebrates in Swedish headwater streams during two seasons. We evaluated functional metrics, i.e., Shannon diversity, richness, and evenness, and the degree of redundancy within and across modeled spatial scales for individual feeding groups. We also estimated the correlates of environmental versus spatial factors of both functional composition and the taxonomic composition of functional groups for each spatial scale identified. Measures of functional diversity and within-scale redundancy of functions were similar during both seasons, but both within- and cross-scale redundancy were low. This apparent low redundancy was partly attributable to a few dominant taxa explaining the spatial models. However, rare taxa with stochastic spatial distributions might provide additional information and should therefore be considered explicitly for complementing future resilience assessments. Otherwise, resilience may be underestimated. Finally, both environmental and spatial factors correlated with the scale-specific functional and taxonomic composition. This finding suggests that resilience in stream networks emerges as a function of not only local conditions but also regional factors such as habitat connectivity and invertebrate dispersal.

  19. Quantifying spatial scaling patterns and their local and regional correlates in headwater streams: Implications for resilience

    Science.gov (United States)

    Gothe, Emma; Sandin, Leonard; Allen, Craig R.; Angeler, David G.

    2014-01-01

    The distribution of functional traits within and across spatiotemporal scales has been used to quantify and infer the relative resilience across ecosystems. We use explicit spatial modeling to evaluate within- and cross-scale redundancy in headwater streams, an ecosystem type with a hierarchical and dendritic network structure. We assessed the cross-scale distribution of functional feeding groups of benthic invertebrates in Swedish headwater streams during two seasons. We evaluated functional metrics, i.e., Shannon diversity, richness, and evenness, and the degree of redundancy within and across modeled spatial scales for individual feeding groups. We also estimated the correlates of environmental versus spatial factors of both functional composition and the taxonomic composition of functional groups for each spatial scale identified. Measures of functional diversity and within-scale redundancy of functions were similar during both seasons, but both within- and cross-scale redundancy were low. This apparent low redundancy was partly attributable to a few dominant taxa explaining the spatial models. However, rare taxa with stochastic spatial distributions might provide additional information and should therefore be considered explicitly for complementing future resilience assessments. Otherwise, resilience may be underestimated. Finally, both environmental and spatial factors correlated with the scale-specific functional and taxonomic composition. This finding suggests that resilience in stream networks emerges as a function of not only local conditions but also regional factors such as habitat connectivity and invertebrate dispersal.

  20. Correlation induced localization of lattice trapped bosons coupled to a Bose–Einstein condensate

    Science.gov (United States)

    Keiler, Kevin; Krönke, Sven; Schmelcher, Peter

    2018-03-01

    We investigate the ground state properties of a lattice trapped bosonic system coupled to a Lieb–Liniger type gas. Our main goal is the description and in depth exploration and analysis of the two-species many-body quantum system including all relevant correlations beyond the standard mean-field approach. To achieve this, we use the multi-configuration time-dependent Hartree method for mixtures (ML-MCTDHX). Increasing the lattice depth and the interspecies interaction strength, the wave function undergoes a transition from an uncorrelated to a highly correlated state, which manifests itself in the localization of the lattice atoms in the latter regime. For small interspecies couplings, we identify the process responsible for this cross-over in a single-particle-like picture. Moreover, we give a full characterization of the wave function’s structure in both regimes, using Bloch and Wannier states of the lowest band, and we find an order parameter, which can be exploited as a corresponding experimental signature. To deepen the understanding, we use an effective Hamiltonian approach, which introduces an induced interaction and is valid for small interspecies interaction. We finally compare the ansatz of the effective Hamiltonian with the results of the ML-MCTDHX simulations.

  1. Relation between 'no broadcasting' for noncommuting states and 'no local broadcasting' for quantum correlations

    International Nuclear Information System (INIS)

    Luo Shunlong; Li Nan; Cao Xuelian

    2009-01-01

    The no-broadcasting theorem, first established by Barnum et al. [Phys. Rev. Lett. 76, 2818 (1996)], states that a set of quantum states can be broadcast if and only if it constitutes a commuting family. Quite recently, Piani et al. [Phys. Rev. Lett. 100, 090502 (2008)] showed, by using an ingenious and sophisticated method, that the correlations in a single bipartite state can be locally broadcast if and only if the state is effectively a classical one (i.e., the correlations therein are classical). In this Brief Report, under the condition of nondegenerate spectrum, we provide an alternative and significantly simpler proof of the latter result based on the original no-broadcasting theorem and the monotonicity of the quantum relative entropy. This derivation motivates us to conjecture the equivalence between these two elegant yet formally different no-broadcasting theorems and indicates a subtle and fundamental issue concerning spectral degeneracy which also lies at the heart of the conflict between the von Neumann projection postulate and the Lueders ansatz for quantum measurements. This relation not only offers operational interpretations for commutativity and classicality but also illustrates the basic significance of noncommutativity in characterizing quantumness from the informational perspective.

  2. Radioguided breast surgery for occult lesion localizationcorrelation between two methods

    Directory of Open Access Journals (Sweden)

    Gutfilen Bianca

    2008-08-01

    Full Text Available Abstract Background The detection of sub-clinical breast lesions has increased with screening mammography. Biopsy techniques can offer precision and agility in its execution, as well as patient comfort. This trial compares radioguided occult lesion localization (ROLL and wire-guided localization (WL of breast lesions. We investigate if a procedure at the ambulatorial level (ROLL could lead to a better aesthetic result and less postoperative pain. In addition, we intend to demonstrate the efficacy of radioguided localization and removal of occult breast lesions using radiopharmaceuticals injected directly into the lesions and correlate radiological and histopathological findings. Methods One hundred and twenty patients were randomized into two groups (59 WL and 61 ROLL. The patients were requested to score the cosmetic appearance of their breast after surgery, and a numerical rating scale was used to measure pain on the first postoperative day. Clearance margins were considered at ≥ 10 mm for invasive cancer, ≥ 5 mm for ductal carcinoma in situ, and ≥ 1 mm for benign disease. Patients were subsequently treated according to the definitive histological result. When appropriate, different statistical tests were used in order to test the significance between the two groups, considering a P value Results WL and ROLL located all the occult breast lesions successfully. In the ROLL group, the specimen volume was smaller and there were more cases with clear margins (P Conclusion ROLL is an effective method for the excision of non-palpable breast lesions. It enables more careful planning of the cutaneous incision, leading to better aesthetic results, less postoperative symptoms, and smaller volumes of excised tissue.

  3. Non-local exchange correlation functionals impact on the structural, electronic and optical properties of III-V arsenides

    KAUST Repository

    Anua, N. Najwa

    2013-08-20

    Exchange correlation (XC) energy functionals play a vital role in the efficiency of density functional theory (DFT) calculations, more soundly in the calculation of fundamental electronic energy bandgap. In the present DFT study of III-arsenides, we investigate the implications of XC-energy functional and corresponding potential on the structural, electronic and optical properties of XAs (X = B, Al, Ga, In). Firstly we report and discuss the optimized structural lattice parameters and the band gap calculations performed within different non-local XC functionals as implemented in the DFT-packages: WIEN2k, CASTEP and SIESTA. These packages are representative of the available code in ab initio studies. We employed the LDA, GGA-PBE, GGA-WC and mBJ-LDA using WIEN2k. In CASTEP, we employed the hybrid functional, sX-LDA. Furthermore LDA, GGA-PBE and meta-GGA were employed using SIESTA code. Our results point to GGA-WC as a more appropriate approximation for the calculations of structural parameters. However our electronic bandstructure calculations at the level of mBJ-LDA potential show considerable improvements over the other XC functionals, even the sX-LDA hybrid functional. We report also the optical properties within mBJ potential, which show a nice agreement with the experimental measurements in addition to other theoretical results. © 2013 IOP Publishing Ltd.

  4. Long-time tails of the heat-conductivity time correlation functions for a magnetized plasma - a kinetic theory approach

    NARCIS (Netherlands)

    Schoolderman, A.J.; Suttorp, L.G.

    1989-01-01

    The long-time behaviour of the longitudinal and the transverse heat conductivity time correlation functions for a magnetized one-component plasma is studied by means of kinetic theory. To that end these correlation functions, which are defined as the inverse Laplace transforms of the dynamic heat

  5. Global hybrids from the semiclassical atom theory satisfying the local density linear response.

    Science.gov (United States)

    Fabiano, Eduardo; Constantin, Lucian A; Cortona, Pietro; Della Sala, Fabio

    2015-01-13

    We propose global hybrid approximations of the exchange-correlation (XC) energy functional which reproduce well the modified fourth-order gradient expansion of the exchange energy in the semiclassical limit of many-electron neutral atoms and recover the full local density approximation (LDA) linear response. These XC functionals represent the hybrid versions of the APBE functional [Phys. Rev. Lett. 2011, 106, 186406] yet employing an additional correlation functional which uses the localization concept of the correlation energy density to improve the compatibility with the Hartree-Fock exchange as well as the coupling-constant-resolved XC potential energy. Broad energetic and structural testing, including thermochemistry and geometry, transition metal complexes, noncovalent interactions, gold clusters and small gold-molecule interfaces, as well as an analysis of the hybrid parameters, show that our construction is quite robust. In particular, our testing shows that the resulting hybrid, including 20% of Hartree-Fock exchange and named hAPBE, performs remarkably well for a broad palette of systems and properties, being generally better than popular hybrids (PBE0 and B3LYP). Semiempirical dispersion corrections are also provided.

  6. The role of local theories: teacher knowledge and its impact on engaging students with challenging tasks

    Science.gov (United States)

    Choppin, Jeffrey

    2011-03-01

    This study explores the extent to which a teacher elicited students' mathematical reasoning through the use of challenging tasks and the role her knowledge played in doing so. I characterised the teacher's knowledge in terms of a local theory of instruction, a form of pedagogical content knowledge that involves an empirically tested set of conjectures situated within a mathematical domain. Video data were collected and analysed and used to stimulate the teacher's reflection on her enactments of an instructional sequence. The teacher, chosen for how she consistently elicited student reasoning, showed evidence of possessing a local theory in that she articulated the ways student thinking developed over time, the processes by which that thinking developed, and the resources that facilitated the development of student thinking. Her knowledge informed how she revised and enacted challenging tasks in ways that elicited and refined student thinking around integer addition and subtraction. Furthermore, her knowledge and practices emphasised the progressive formalisation of students' ideas as a key learning process. A key implication of this study is that teachers are able to develop robust knowledge from enacting challenging tasks, knowledge that organises how they elicit and refine student reasoning from those tasks.

  7. A quantal transport theory for nuclear collective motion: the merits of a locally harmonic approximation

    International Nuclear Information System (INIS)

    Hofmann, H.

    1997-01-01

    A transport theory is developed for collective motion of systems such as an atomic nucleus, which may be considered as a typical representative of a self-bound micro-system. Albeit for pragmatic reasons, collective variables are introduced as shape parameters, self-consistency with respect to the nucleonic degrees of freedom has been implemented at various important stages. This feature leads to subsidiary conditions which are obeyed locally for both the average motion as well as for the quantized Hamiltonian constructed through a Bohm-Pines procedure. Furthermore, self-consistency governs the definition of the transport coefficients appearing in the equations for collective motion. The latter is associated to the time evolution of the density in collective phase space, for which the concept of the Wigner function is employed. Global motion is described by propagating the system in successive time laps which are macroscopically small, but microscopically large. This enables one to exploit linearization procedures and to take advantage of the benefits of linear response theory. A microscopic damping mechanism is introduced by dressing the energies of the independent particle model by complex self-energies, the parameters of which are determined from optical model considerations. Numerical evaluations of transport coefficients are described and tested for the case of fission in the light of recent experimental findings. The theory allows one to extend both Kramers' picture of this process as well as his equation for the density distribution into the quantum regime. (orig.)

  8. Equations for the gravitational field and local conserved quantities in the general theory of relativity

    International Nuclear Information System (INIS)

    Manoff, S.

    1979-07-01

    By utilization of the method of Lagrangians with covariant derivatives (MLCD) the different energy-momentum tensors (canonical, generalized canonical, symmetrical) and the relations between them are considered. On this basis, Einstein's theory of gravitation is studied as a field theory with a Lagrangian density of the type Lsub(g)=√-g.Lsub(g)(gsub(ij),Rsub(A)), (Rsub(A)=Rsub(ijkl)). It is shown that the energy-momentum tensors of the gravitational field can be defined for this theory. The symmetrical energy-momentum tensor of the gravitational field sub(gs)Tsub(k)sup(i), which in the general case is not a local conserved quantity (sub(gs)Tsub(k)sup(i)sub(;i) unequal 0) (in contrast to the material fields satisfying condition sub(Ms)Tsub(k)sup(i)sub(;i) = 0), is equal to zero for the gravitational field in vacuum (cosmological constant Λ = 0). Equations of the gravitational field of a new type are suggested, leading to equations of motion (sub(Ms)Tsub(k)sup(i) + sub(gs)Tsub(k)sup(i))sub(;i) = 0. The equations corresponding to the Lagrangian density Lsub(g)=(√-g/kappasub(o)) (R - lambda approximately), lambda approximately = const., are considered. The equations of Einstein Rsub(ij) = 0 are obtained in the case of gravitational field in vacuum. Some particular cases are examined as an illustration to material fields and the corresponding gravitational equations. (author)

  9. Site-occupation embedding theory using Bethe ansatz local density approximations

    Science.gov (United States)

    Senjean, Bruno; Nakatani, Naoki; Tsuchiizu, Masahisa; Fromager, Emmanuel

    2018-06-01

    Site-occupation embedding theory (SOET) is an alternative formulation of density functional theory (DFT) for model Hamiltonians where the fully interacting Hubbard problem is mapped, in principle exactly, onto an impurity-interacting (rather than a noninteracting) one. It provides a rigorous framework for combining wave-function (or Green function)-based methods with DFT. In this work, exact expressions for the per-site energy and double occupation of the uniform Hubbard model are derived in the context of SOET. As readily seen from these derivations, the so-called bath contribution to the per-site correlation energy is, in addition to the latter, the key density functional quantity to model in SOET. Various approximations based on Bethe ansatz and perturbative solutions to the Hubbard and single-impurity Anderson models are constructed and tested on a one-dimensional ring. The self-consistent calculation of the embedded impurity wave function has been performed with the density-matrix renormalization group method. It has been shown that promising results are obtained in specific regimes of correlation and density. Possible further developments have been proposed in order to provide reliable embedding functionals and potentials.

  10. VECTOR THEORY AND OPTIMAL CHOICE OF ANTIMICROBIAL DRUG FOR LOCAL WOUND TREATMENT

    Directory of Open Access Journals (Sweden)

    Boyko N. N

    2016-12-01

    Full Text Available Introduction. One of important problems in the field of medicine and pharmacy is an optimal choice among several alternatives. For example, the choice of drugs for treatment among several analogs, selection of excipients among analogs for development of pharmaceutical forms with optimal pharmacological, technological and economical parameters, etc.The aim of the work is to show the possibility of vector theory use for optimal choice of antimicrobial drugs for local wound treatment among analogs taking into account several criteria at the same time. Materials and methods. For our investigation we have chosen ten drugs with antimicrobial properties for local wound treatment in different pharmaceutical forms (ointment, liniment, water and glycerin solution, tincture. We have determined antibacterial activity of drugs by agar well diffusion method on six test-stain microorganisms: Staphylococcus aureus ATCC 25923, Escherichia coli ATCC 25922, Pseudomonas aeruginosa ATCC 27853, Proteus vulgaris ATCC 4636, Bacillus subtilis ATCC 6633, and Candida albicans ATCC 885-653. Well diameter was 10 mm, the volume of drug in the well was 0.27±0.02 ml, microbial burden of agar upper layer was 107 CFU/ml, and total layer height in Petri dish was 4.0±0.5 mm. In order to integrate various qualitative and quantitative parameters into one index (vector object in multidimensional factors’ space we modify these parameters to non-dimensional normalized values. For this purpose we use a desirability theory. We have chosen the following criteria for optimal choice of the drug: antimicrobial activity (integrated index of drug’s antimicrobial activity, drug’s price, pharmacological and technological index, spectrum of drug’s action on test strains of microorganisms studied. Results and their discussions. Using vector and desirability theory, we have obtained the following range of drugs in decreasing order: Laevomecol ointment, Ioddicerinum, Tincture of Sophora

  11. Liquid direct correlation function, singlet densities and the theory of freezing

    International Nuclear Information System (INIS)

    March, N.H.; Tosi, M.P.

    1981-04-01

    We have examined the solutions for the singlet density rho(r) in the hierarchical equation connecting rho(r) with the liquid direct correlation function c(r). In addition to the homogeneous solution rho(r)=rhosub(liquid), we exhibit a periodic solution which can co-exist with the liquid solution. If the defining equation for this is linearized, we recover the bifurcation condition of Lovett and Buff. We stress the difference between the two treatments as that between first and second-order transitions. It turns out that the treatment presented here leads to the same periodic density as that derived, using the hypernetted chain approximation, by Ramakrishnan and Yussouff in their theory of freezing. Invoking that approximation is shown thereby to be inessential. (author)

  12. Localized multi-scale energy and vorticity analysis. II. Finite-amplitude instability theory and validation

    Science.gov (United States)

    San Liang, X.; Robinson, Allan R.

    2007-12-01

    Reynolds stress framework. Using the techniques of marginalization and localization, this work sets up an example for the generalization of certain geophysical fluid dynamics theories for more generic purposes.

  13. Calculation of generalized Lorenz-Mie theory based on the localized beam models

    International Nuclear Information System (INIS)

    Jia, Xiaowei; Shen, Jianqi; Yu, Haitao

    2017-01-01

    It has been proved that localized approximation (LA) is the most efficient way to evaluate the beam shape coefficients (BSCs) in generalized Lorenz-Mie theory (GLMT). The numerical calculation of relevant physical quantities is a challenge for its practical applications due to the limit of computer resources. The study presents an improved algorithm of the GLMT calculation based on the localized beam models. The BSCs and the angular functions are calculated by multiplying them with pre-factors so as to keep their values in a reasonable range. The algorithm is primarily developed for the original localized approximation (OLA) and is further extended to the modified localized approximation (MLA). Numerical results show that the algorithm is efficient, reliable and robust. - Highlights: • In this work, we introduce the proper pre-factors to the Bessel functions, BSCs and the angular functions. With this improvement, all the quantities involved in the numerical calculation are scaled into a reasonable range of values so that the algorithm can be used for computing the physical quantities of the GLMT. • The algorithm is not only an improvement in numerical technique, it also implies that the set of basic functions involved in the electromagnetic scattering (and sonic scattering) can be reasonably chosen. • The algorithms of the GLMT computations introduced in previous references suggested that the order of the n and m sums is interchanged. In this work, the sum of azimuth modes is performed for each partial wave. This offers the possibility to speed up the computation, since the sum of partial waves can be optimized according to the illumination conditions and the sum of azimuth modes can be truncated by selecting a criterion discussed in . • Numerical results show that the algorithm is efficient, reliable and robust, even in very exotic cases. The algorithm presented in this paper is based on the original localized approximation and it can also be used for the

  14. Heterogeneity of miRNA expression in localized prostate cancer with clinicopathological correlations.

    Directory of Open Access Journals (Sweden)

    Ahmed Hussein Zedan

    Full Text Available In the last decade microRNAs (miRNAs have been widely investigated in prostate cancer (PCa and have shown to be promising biomarkers in diagnostic, prognostic and predictive settings. However, tumor heterogeneity may influence miRNA expression. The aims of this study were to assess the impact of tumor heterogeneity, as demonstrated by a panel of selected miRNAs in PCa, and to correlate miRNA expression with risk profile and patient outcome.Prostatectomy specimens and matched, preoperative needle biopsies from a retrospective cohort of 49 patients, who underwent curatively intended surgery for localized PCa, were investigated with a panel of 6 miRNAs (miRNA-21, miRNA-34a, miRNA-125b, miRNA-126, miRNA-143, and miRNA-145 using tissue micro-array (TMA and in situ hybridization (ISH. Inter- and intra-patient variation was assessed using intra-class correlation (ICC.Four miRNAs (miRNA-21, miRNA-34a, miRNA-125, and miRNA-126 were significantly upregulated in PCa compared to benign prostatic hyperplasia (BPH, and except for miRNA-21 these miRNAs documented a positive correlation between the expression level in PCa cores and their matched BPH cores, (r > 0.72. The ICC varied from 0.451 to 0.764, with miRNA-34a showing an intra-tumoral heterogeneity accounting for less than 50% of the total variation. Regarding clinicopathological outcomes, only miRNA-143 showed potential as a prognostic marker with a higher expression correlating with longer relapse-free survival (p = 0.016.The present study documents significant upregulation of the expression of miRNA-21, miRNA-34a, miRNA-125, and miRNA-126 in PCa compared to BPH and suggests a possible prognostic value associated with the expression of miRNA-143. The results, however, document intra-tumoral heterogeneity in the expression of various miRNAs calling for caution when using these tumor tissue biomarkers in prognostic and predictive settings.

  15. Correlation of Theory and Function in Well-Defined Bimetallic Electrocatalysts - Final Report

    Energy Technology Data Exchange (ETDEWEB)

    Crooks, Richard M.

    2014-06-05

    The objective of this research proposal was to correlate the structure of nanoparticles that are comprised of ~100-200 atoms to their electrocatalytic function. This objective was based on the growing body of evidence suggesting that catalytic properties can be tailored through controlled synthesis of nanoparticles. What has been missing from many of these studies, and what we are contributing, is a model catalyst that is sufficiently small, structurally well-defined, and well-characterized that its function can be directly predicted by theory. Specifically, our work seeks to develop a fundamental and detailed understanding of the relationship between the structure of nanoscopic oxygen-reduction catalysts and their function. We assembled a team with expertise in theory, synthesis, and advanced characterization methods to address the primary objective of this project. We anticipated the outcomes of the study to be: (1) a better theoretical understanding of how nanoparticle structure affects catalytic properties; (2) the development of advanced, in-situ and ex-situ, atomic-scale characterization methods that are appropriate for particles containing about 100 atoms; and (3) improved synthetic methods that produce unique nanoparticle structures that can be used to test theoretical predictions. During the project period, we have made excellent progress on all three fronts.

  16. Weyl consistency conditions and a local renormalisation group equation for general renormalisable field theories

    International Nuclear Information System (INIS)

    Osborn, H.

    1991-01-01

    A local renormalisation group equation which realises infinitesimal Weyl rescalings of the metric and which is an extension of the usual Callan-Symanzik equation is described. In order to ensure that any local composite operators, with dimensions so that on addition to the basic lagrangian they preserve renormalisability, are well defined for arbitrarily many insertions into correlation functions the couplings are assumed to depend on χ. Local operators are then defined by functional differentiation with respect to the couplings just as the energy-momentum tensor is given by functional differentiation with respect to the metric. The local renormalisation group equation contains terms depending on derivatives of the couplings as well as the curvature tensor formed from the metric, constrained by power counting. Various consistency relations arising from the commutativity of Weyl transformations are derived, extending previous one-loop results for the trace anomaly to all orders. In two dimensions the relations give an alternative derivation of the c-theorem and similar extensions are obtained in four dimensions. The equations are applied in detail to general renormalisable σ-models in two dimensions. The Curci-Paffuti relation is derived without any commitment to a particular regularisation scheme and further equations used to construct an action for the vanishing of the β-functions are also obtained. The discussion is also extended to σ-models with a boundary, as appropriate for open strings, and relations for the additional β-functions present in such models are obtained. (orig.)

  17. Local random configuration-tree theory for string repetition and facilitated dynamics of glass

    Science.gov (United States)

    Lam, Chi-Hang

    2018-02-01

    We derive a microscopic theory of glassy dynamics based on the transport of voids by micro-string motions, each of which involves particles arranged in a line hopping simultaneously displacing one another. Disorder is modeled by a random energy landscape quenched in the configuration space of distinguishable particles, but transient in the physical space as expected for glassy fluids. We study the evolution of local regions with m coupled voids. At a low temperature, energetically accessible local particle configurations can be organized into a random tree with nodes and edges denoting configurations and micro-string propagations respectively. Such trees defined in the configuration space naturally describe systems defined in two- or three-dimensional physical space. A micro-string propagation initiated by a void can facilitate similar motions by other voids via perturbing the random energy landscape, realizing path interactions between voids or equivalently string interactions. We obtain explicit expressions of the particle diffusion coefficient and a particle return probability. Under our approximation, as temperature decreases, random trees of energetically accessible configurations exhibit a sequence of percolation transitions in the configuration space, with local regions containing fewer coupled voids entering the non-percolating immobile phase first. Dynamics is dominated by coupled voids of an optimal group size, which increases as temperature decreases. Comparison with a distinguishable-particle lattice model (DPLM) of glass shows very good quantitative agreements using only two adjustable parameters related to typical energy fluctuations and the interaction range of the micro-strings.

  18. An asymptotic theory for cross-correlation between auto-correlated sequences and its application on neuroimaging data.

    Science.gov (United States)

    Zhou, Yunyi; Tao, Chenyang; Lu, Wenlian; Feng, Jianfeng

    2018-04-20

    Functional connectivity is among the most important tools to study brain. The correlation coefficient, between time series of different brain areas, is the most popular method to quantify functional connectivity. Correlation coefficient in practical use assumes the data to be temporally independent. However, the time series data of brain can manifest significant temporal auto-correlation. A widely applicable method is proposed for correcting temporal auto-correlation. We considered two types of time series models: (1) auto-regressive-moving-average model, (2) nonlinear dynamical system model with noisy fluctuations, and derived their respective asymptotic distributions of correlation coefficient. These two types of models are most commonly used in neuroscience studies. We show the respective asymptotic distributions share a unified expression. We have verified the validity of our method, and shown our method exhibited sufficient statistical power for detecting true correlation on numerical experiments. Employing our method on real dataset yields more robust functional network and higher classification accuracy than conventional methods. Our method robustly controls the type I error while maintaining sufficient statistical power for detecting true correlation in numerical experiments, where existing methods measuring association (linear and nonlinear) fail. In this work, we proposed a widely applicable approach for correcting the effect of temporal auto-correlation on functional connectivity. Empirical results favor the use of our method in functional network analysis. Copyright © 2018. Published by Elsevier B.V.

  19. Complete conformal field theory solution of a chiral six-point correlation function

    International Nuclear Information System (INIS)

    Simmons, Jacob J H; Kleban, Peter

    2011-01-01

    Using conformal field theory, we perform a complete analysis of the chiral six-point correlation function C(z)= 1,2 φ 1,2 Φ 1/2,0 (z, z-bar )φ 1,2 φ 1,2 >, with the four φ 1,2 operators at the corners of an arbitrary rectangle, and the point z = x + iy in the interior. We calculate this for arbitrary central charge (equivalently, SLE parameter κ > 0). C is of physical interest because for percolation (κ = 6) and many other two-dimensional critical points, it specifies the density at z of critical clusters conditioned to touch either or both vertical ends of the rectangle, with these ends 'wired', i.e. constrained to be in a single cluster, and the horizontal ends free. The correlation function may be written as the product of an algebraic prefactor f and a conformal block G, where f = f(x, y, m), with m a cross-ratio specified by the corners (m determines the aspect ratio of the rectangle). By appropriate choice of f and using coordinates that respect the symmetry of the problem, the conformal block G is found to be independent of either y or x, and given by an Appell function.

  20. Quantum correlated cluster mean-field theory applied to the transverse Ising model.

    Science.gov (United States)

    Zimmer, F M; Schmidt, M; Maziero, Jonas

    2016-06-01

    Mean-field theory (MFT) is one of the main available tools for analytical calculations entailed in investigations regarding many-body systems. Recently, there has been a surge of interest in ameliorating this kind of method, mainly with the aim of incorporating geometric and correlation properties of these systems. The correlated cluster MFT (CCMFT) is an improvement that succeeded quite well in doing that for classical spin systems. Nevertheless, even the CCMFT presents some deficiencies when applied to quantum systems. In this article, we address this issue by proposing the quantum CCMFT (QCCMFT), which, in contrast to its former approach, uses general quantum states in its self-consistent mean-field equations. We apply the introduced QCCMFT to the transverse Ising model in honeycomb, square, and simple cubic lattices and obtain fairly good results both for the Curie temperature of thermal phase transition and for the critical field of quantum phase transition. Actually, our results match those obtained via exact solutions, series expansions or Monte Carlo simulations.

  1. Information Theory for Correlation Analysis and Estimation of Uncertainty Reduction in Maps and Models

    Directory of Open Access Journals (Sweden)

    J. Florian Wellmann

    2013-04-01

    Full Text Available The quantification and analysis of uncertainties is important in all cases where maps and models of uncertain properties are the basis for further decisions. Once these uncertainties are identified, the logical next step is to determine how they can be reduced. Information theory provides a framework for the analysis of spatial uncertainties when different subregions are considered as random variables. In the work presented here, joint entropy, conditional entropy, and mutual information are applied for a detailed analysis of spatial uncertainty correlations. The aim is to determine (i which areas in a spatial analysis share information, and (ii where, and by how much, additional information would reduce uncertainties. As an illustration, a typical geological example is evaluated: the case of a subsurface layer with uncertain depth, shape and thickness. Mutual information and multivariate conditional entropies are determined based on multiple simulated model realisations. Even for this simple case, the measures not only provide a clear picture of uncertainties and their correlations but also give detailed insights into the potential reduction of uncertainties at each position, given additional information at a different location. The methods are directly applicable to other types of spatial uncertainty evaluations, especially where multiple realisations of a model simulation are analysed. In summary, the application of information theoretic measures opens up the path to a better understanding of spatial uncertainties, and their relationship to information and prior knowledge, for cases where uncertain property distributions are spatially analysed and visualised in maps and models.

  2. Operator theory of angular momentum nad orientational auto-correlation functions

    International Nuclear Information System (INIS)

    Evans, M.W.

    1982-01-01

    The rigorous relation between the orientational auto-correlation function and the angular momentum autocorrelation function is described in two cases of interest. First when description of the complete zero THz- spectrum is required from the Mori continued fraction expansion for the angular momentum autocorrelation function and second when rotation/translation effects are important. The Mori-Evans theory of 1976, relying on the simple Shimizu relation is found to be essentially unaffected by the higher order corrections recently worked out by Ford and co-workers in the Markov limit. The mutual interaction of rotation and translation is important in determining the details of both the orientational and angular momentum auto-correlation function's (a.c.f.'s) in the presence of sample anisotropy or a symmetry breaking field. In this case it is essential to regard the angular momentum a.c.f. as non-Markovian and methods are developed to relate this to the orientational a.c.f. in the presence of rotation/translation coupling. (author)

  3. Correlates of Protective Motivation Theory (PMT to Adolescents’ Drug Use Intention

    Directory of Open Access Journals (Sweden)

    Cynthia Sau Ting Wu

    2014-01-01

    Full Text Available Early onset and increasing proliferation of illicit adolescent drug-use poses a global health concern. This study aimed to examine the correlation between Protective Motivation Theory (PMT measures and the intention to use drugs among adolescents. An exploratory quantitative correlation design and convenience sampling were adopted. A total of 318 students completed a self-reported questionnaire that solicited information related to their demographics and activities, measures of threat appraisal and coping appraisal, and the intention to use drugs. Logistic regression analysis showed that intrinsic and extrinsic rewards were significant predictors of intention. The odds ratios were equal to 2.90 (p < 0.05 and 8.04 (p < 0.001, respectively. The logistic regression model analysis resulted in a high Nagelkerke R2 of 0.49, which suggests that PMT related measures could be used in predicting drug use intention among adolescents. Further research should be conducted with non-school adolescents to confirm the application.

  4. Irreducible Greens' Functions method in the theory of highly correlated systems

    International Nuclear Information System (INIS)

    Kuzemsky, A.L.

    1994-09-01

    The self-consistent theory of the correlation effects in Highly Correlated Systems (HCS) is presented. The novel Irreducible Green's Function (IGF) method is discussed in detail for the Hubbard model and random Hubbard model. The interpolation solution for the quasiparticle spectrum, which is valid for both the atomic and band limit is obtained. The (IGF) method permits to calculate the quasiparticle spectra of many-particle systems with the complicated spectra and strong interaction in a very natural and compact way. The essence of the method deeply related to the notion of the Generalized Mean Fields (GMF), which determine the elastic scattering corrections. The inelastic scattering corrections leads to the damping of the quasiparticles and are the main topic of the present consideration. The calculation of the damping has been done in a self-consistent way for both limits. For the random Hubbard model the weak coupling case has been considered and the self-energy operator has been calculated using the combination of the IGF method and Coherent Potential Approximation (CPA). The other applications of the method to the s-f model, Anderson model, Heisenberg antiferromagnet, electron-phonon interaction models and quasiparticle tunneling are discussed briefly. (author). 79 refs

  5. Life satisfaction and its correlates among college students in China: a test of social reference theory.

    Science.gov (United States)

    Zhang, Jie; Zhao, Sibo; Lester, David; Zhou, Chengchao

    2014-08-01

    To study life satisfaction and to test the role of social reference in determining the degree of life satisfaction, we examined a large sample of undergraduate students in China for the correlates of campus life satisfaction. A questionnaire survey was administered at a university and the final sample consisted of 439 respondents aged between 17 and 24 years, from all over the country, and studying different subjects. It was found that freshman students tended to score higher on their life satisfaction than students in other grades and the college students' life satisfaction was positively related to female gender, self-esteem, social support, and the liberal attitudes on female gender roles, but negatively correlated with depression and suicidal ideation. Contrary to common beliefs, students from an urban area or from better-off families were not necessarily more satisfied with current life than those students coming from the countryside or low income families. The findings were accounted for by the social reference theory and in this case college students' campus life satisfaction is basically affected by their pre-college life quality as a reference. Copyright © 2013 Elsevier B.V. All rights reserved.

  6. Temporal epilepsy seizures monitoring and prediction using cross-correlation and chaos theory.

    Science.gov (United States)

    Haddad, Tahar; Ben-Hamida, Naim; Talbi, Larbi; Lakhssassi, Ahmed; Aouini, Sadok

    2014-01-01

    Temporal seizures due to hippocampal origins are very common among epileptic patients. Presented is a novel seizure prediction approach employing correlation and chaos theories. The early identification of seizure signature allows for various preventive measures to be undertaken. Electro-encephalography signals are spectrally broken down into the following sub-bands: delta; theta; alpha; beta; and gamma. The proposed approach consists of observing a high correlation level between any pair of electrodes for the lower frequencies and a decrease in the Lyapunov index (chaos or entropy) for the higher frequencies. Power spectral density and statistical analysis tools were used to determine threshold levels for the lower frequencies. After studying all five sub-bands, the analysis has revealed that the seizure signature can be extracted from the delta band and the high frequencies. High frequencies are defined as both the gamma band and the ripples occurring within the 60-120 Hz sub-band. To validate the proposed approach, six patients from both sexes and various age groups with temporal epilepsies originating from the hippocampal area were studied using the Freiburg database. An average seizure prediction of 30 min, an anticipation accuracy of 72%, and a false-positive rate of 0% were accomplished throughout 200 h of recording time.

  7. Theory of mind correlates with clinical insight but not cognitive insight in patients with schizophrenia.

    Science.gov (United States)

    Zhang, Qi; Li, Xu; Parker, Giverny J; Hong, Xiao-Hong; Wang, Yi; Lui, Simon S Y; Neumann, David L; Cheung, Eric F C; Shum, David H K; Chan, Raymond C K

    2016-03-30

    Research on the relationship between insight and social cognition, in particular Theory of Mind (ToM), in schizophrenia has yielded mixed findings to date. Very few studies, however, have assessed both clinical insight and cognitive insight when examining their relationships with ToM in schizophrenia. The current study thus investigated the relationship between clinical insight, cognitive insight, and ToM in a sample of 56 patients with schizophrenia and 30 healthy controls. Twenty-seven patients were classified as low in clinical insight according to their scores on the 'insight' item (G12) of the Positive and Negative Syndrome Scale (PANSS). Moreover, cognitive insight and ToM were assessed with the Beck Cognitive Insight Scale (BCIS) and the Yoni task, respectively. The results indicated that patients with poor clinical insight performed worse on tasks of second-order cognitive and affective ToM, while the ToM performance of patients with high clinical insight was equivalent to that of healthy controls. Furthermore, while clinical insight was correlated with ToM and clinical symptoms, cognitive insight did not correlate with clinical insight, ToM, or clinical symptoms. Clinical insight thus appears to be an important factor related to ToM in schizophrenia. Copyright © 2016 Elsevier Ireland Ltd. All rights reserved.

  8. Local Magnetism in Strongly Correlated Electron Systems with Orbital Degrees of Freedom

    Science.gov (United States)

    Ducatman, Samuel Charles

    The central aim of my research is to explain the connection between the macroscopic behavior and the microscopic physics of strongly correlated electron systems with orbital degrees of freedom through the use of effective models. My dissertation focuses on the sub-class of these materials where electrons appear to be localized by interactions, and magnetic ions have well measured magnetic moments. This suggests that we can capture the low-energy physics of the material by employing a minimal model featuring localized spins which interact with each other through exchange couplings. I describe Fe1+y Te and beta-Li2IrO3 with effective models primarily focusing on the spins of the magnetic ions, in this case Fe and Ir, respectively. The goal with both materials is to gain insight and make predictions for experimentalists. In chapter 2, I focus on Fe1+yTe. I describe why we believe the magnetic ground state of this material, with an observed Bragg peak at Q +/- pi/2, pi/2), can be described by a Heisenberg model with 1st, 2nd, and 3rd neighbor interactions. I present two possible ground states of this model in the small J1 limit, the bicollinear and plaquette states. In order to predict which ground state the model prefers, I calculate the spin wave spectrum with 1/S corrections, and I find the model naturally selects the "plaquette state." I give a brief description of the ways this result could be tested using experimental techniques such as polarized neutron scattering. In chapter 3, I extend the model used in chapter 2. This is necessary because the Heisenberg model we employed cannot explain why Fe1+yTe undergoes a phase transition as y is increased. We add an additional elements to our calculation; we assume that electrons in some of the Fe 3D orbitals have selectively localized while others remain itinerant. We write a new Hamiltonian, where localized moments acquire a new long-range RKKY-like interaction from interactions with the itinerant electrons. We are

  9. Correlation between response to neoadjuvant chemotherapy and survival in locally advanced breast cancer patients.

    Science.gov (United States)

    Romero, A; García-Sáenz, J A; Fuentes-Ferrer, M; López Garcia-Asenjo, J A; Furió, V; Román, J M; Moreno, A; de la Hoya, M; Díaz-Rubio, E; Martín, M; Caldés, T

    2013-03-01

    Measurement of residual disease following neoadjuvant chemotherapy that accurately predicts long-term survival in locally advanced breast cancer (LABC) is an essential requirement for clinical trials development. Several methods to assess tumor response have been described. However, the agreement between methods and correlation with survival in independent cohorts has not been reported. We report survival and tumor response according to the measurement of residual breast cancer burden (RCB), the Miller and Payne classification and the Response Evaluation Criteria in Solid Tumors (RECIST) criteria, in 151 LABC patients. Kappa Cohen's coefficient (К) was used to test the agreement between methods. We assessed the correlation between the treatment outcome and overall survival (OS) and relapse-free survival (RFS) by calculating Harrell's C-statistic (c). The agreement between Miller and Payne classification and RCB classes was very high (К = 0.82). In contrast, we found a moderate-to-fair agreement between the Miller and Payne classification and RECIST criteria (К = 0.52) and RCB classes and RECIST criteria (К = 0.38). The adjusted C-statistic to predict OS for RCB index (0.77) and RCB classes (0.75) was superior to that of RECIST criteria (0.69) (P = 0.007 and P = 0.035, respectively). Also, RCB index (c = 0.71), RCB classes (c = 0.71) and Miller and Payne classification (c = 0.67) predicted better RFS than RECIST criteria (c = 0.61) (P = 0.005, P = 0.006 and P = 0.028, respectively). The pathological assessment of tumor response might provide stronger prognostic information in LABC patients.

  10. Theory of corticothalamic brain activity in a spherical geometry: Spectra, coherence, and correlation

    Science.gov (United States)

    Mukta, K. N.; MacLaurin, J. N.; Robinson, P. A.

    2017-11-01

    Corticothalamic neural field theory is applied to a spherical geometry to better model neural activity in the human brain and is also compared with planar approximations. The frequency power spectrum, correlation, and coherence functions are computed analytically and numerically. The effects of cortical boundary conditions and resulting modal aspects of spherical corticothalamic dynamics are explored, showing that the results of spherical and finite planar geometries converge to those for the infinite planar geometry in the limit of large brain size. Estimates are made of the point at which modal series can be truncated and it is found that for physiologically plausible parameters only the lowest few spatial eigenmodes are needed for an accurate representation of macroscopic brain activity. A difference between the geometries is that there is a low-frequency 1 /f spectrum in the infinite planar geometry, whereas in the spherical geometry it is 1 /f2 . Another difference is that the alpha peak in the spherical geometry is sharper and stronger than in the planar geometry. Cortical modal effects can lead to a double alpha peak structure in the power spectrum, although the main determinant of the alpha peak is corticothalamic feedback. In the spherical geometry, the cross spectrum between two points is found to only depend on their relative distance apart. At small spatial separations the low-frequency cross spectrum is stronger than for an infinite planar geometry and the alpha peak is sharper and stronger due to the partitioning of the energy into discrete modes. In the spherical geometry, the coherence function between points decays monotonically as their separation increases at a fixed frequency, but persists further at resonant frequencies. The correlation between two points is found to be positive, regardless of the time lag and spatial separation, but decays monotonically as the separation increases at fixed time lag. At fixed distance the correlation has peaks

  11. Exchange-Correlation Effects for Noncovalent Interactions in Density Functional Theory.

    Science.gov (United States)

    Otero-de-la-Roza, A; DiLabio, Gino A; Johnson, Erin R

    2016-07-12

    In this article, we develop an understanding of how errors from exchange-correlation functionals affect the modeling of noncovalent interactions in dispersion-corrected density-functional theory. Computed CCSD(T) reference binding energies for a collection of small-molecule clusters are decomposed via a molecular many-body expansion and are used to benchmark density-functional approximations, including the effect of semilocal approximation, exact-exchange admixture, and range separation. Three sources of error are identified. Repulsion error arises from the choice of semilocal functional approximation. This error affects intermolecular repulsions and is present in all n-body exchange-repulsion energies with a sign that alternates with the order n of the interaction. Delocalization error is independent of the choice of semilocal functional but does depend on the exact exchange fraction. Delocalization error misrepresents the induction energies, leading to overbinding in all induction n-body terms, and underestimates the electrostatic contribution to the 2-body energies. Deformation error affects only monomer relaxation (deformation) energies and behaves similarly to bond-dissociation energy errors. Delocalization and deformation errors affect systems with significant intermolecular orbital interactions (e.g., hydrogen- and halogen-bonded systems), whereas repulsion error is ubiquitous. Many-body errors from the underlying exchange-correlation functional greatly exceed in general the magnitude of the many-body dispersion energy term. A functional built to accurately model noncovalent interactions must contain a dispersion correction, semilocal exchange, and correlation components that minimize the repulsion error independently and must also incorporate exact exchange in such a way that delocalization error is absent.

  12. Correlated electron dynamics and memory in time-dependent density functional theory

    International Nuclear Information System (INIS)

    Thiele, Mark

    2009-01-01

    Time-dependent density functional theory (TDDFT) is an exact reformulation of the time-dependent many-electron Schroedinger equation, where the problem of many interacting electrons is mapped onto the Kohn-Sham system of noninteracting particles which reproduces the exact electronic density. In the Kohn-Sham system all non-classical many-body effects are incorporated in the exchange-correlation potential which is in general unknown and needs to be approximated. It is the goal of this thesis to investigate the connection between memory effects and correlated electron dynamics in strong and weak fields. To this end one-dimensional two-electron singlet systems are studied. At the same time these systems include the onedimensional helium atom model, which is an established system to investigate the crucial effects of correlated electron dynamics in external fields. The studies presented in this thesis show that memory effects are negligible for typical strong field processes. Here the approximation of the spatial nonlocality is of primary importance. For the photoabsorption spectra on the other hand the neglect of memory effects leads to qualitative and quantitative errors, which are shown to be connected to transitions of double excitation character. To develop a better understanding of the conditions under which memory effects become important quantum fluid dynamics has been found to be especially suitable. It represents a further exact reformulation of the quantum mechanic many-body problem which is based on hydrodynamic quantities such as density and velocity. Memory effects are shown to be important whenever the velocity field develops strong gradients and dissipative effects contribute. (orig.)

  13. Correlated electron dynamics and memory in time-dependent density functional theory

    Energy Technology Data Exchange (ETDEWEB)

    Thiele, Mark

    2009-07-28

    Time-dependent density functional theory (TDDFT) is an exact reformulation of the time-dependent many-electron Schroedinger equation, where the problem of many interacting electrons is mapped onto the Kohn-Sham system of noninteracting particles which reproduces the exact electronic density. In the Kohn-Sham system all non-classical many-body effects are incorporated in the exchange-correlation potential which is in general unknown and needs to be approximated. It is the goal of this thesis to investigate the connection between memory effects and correlated electron dynamics in strong and weak fields. To this end one-dimensional two-electron singlet systems are studied. At the same time these systems include the onedimensional helium atom model, which is an established system to investigate the crucial effects of correlated electron dynamics in external fields. The studies presented in this thesis show that memory effects are negligible for typical strong field processes. Here the approximation of the spatial nonlocality is of primary importance. For the photoabsorption spectra on the other hand the neglect of memory effects leads to qualitative and quantitative errors, which are shown to be connected to transitions of double excitation character. To develop a better understanding of the conditions under which memory effects become important quantum fluid dynamics has been found to be especially suitable. It represents a further exact reformulation of the quantum mechanic many-body problem which is based on hydrodynamic quantities such as density and velocity. Memory effects are shown to be important whenever the velocity field develops strong gradients and dissipative effects contribute. (orig.)

  14. Orbital-dependent exchange-correlation functionals in density-functional theory realized by the FLAPW method

    Energy Technology Data Exchange (ETDEWEB)

    Betzinger, Markus

    2011-12-14

    In this thesis, we extended the applicability of the full-potential linearized augmented-plane-wave (FLAPW) method, one of the most precise, versatile and generally applicable electronic structure methods for solids working within the framework of density-functional theory (DFT), to orbital-dependent functionals for the exchange-correlation (xc) energy. Two different schemes that deal with orbital-dependent functionals, the Kohn-Sham (KS) and the generalized Kohn-Sham (gKS) formalism, have been realized. Hybrid functionals, combining some amount of the orbital-dependent exact exchange energy with local or semi-local functionals of the density, are implemented within the gKS scheme. We work in particular with the PBE0 hybrid of Perdew, Burke, and Ernzerhof. Our implementation relies on a representation of the non-local exact exchange potential - its calculation constitutes the most time consuming step in a practical calculation - by an auxiliary mixed product basis (MPB). In this way, the matrix elements of the Hamiltonian corresponding to the non-local potential become a Brillouin-zone (BZ) sum over vector-matrix-vector products. Several techniques are developed and explored to further accelerate our numerical scheme. We show PBE0 results for a variety of semiconductors and insulators. In comparison with experiment, the PBE0 functional leads to improved band gaps and an improved description of localized states. Even for the ferromagnetic semiconductor EuO with localized 4f electrons, the electronic and magnetic properties are correctly described by the PBE0 functional. Subsequently, we discuss the construction of the local, multiplicative exact exchange (EXX) potential from the non-local, orbital-dependent exact exchange energy. For this purpose we employ the optimized effective potential (OEP) method. Central ingredients of the OEP equation are the KS wave-function response and the single-particle density response function. We show that a balance between the LAPW

  15. Orbital-dependent exchange-correlation functionals in density-functional theory realized by the FLAPW method

    International Nuclear Information System (INIS)

    Betzinger, Markus

    2011-01-01

    In this thesis, we extended the applicability of the full-potential linearized augmented-plane-wave (FLAPW) method, one of the most precise, versatile and generally applicable electronic structure methods for solids working within the framework of density-functional theory (DFT), to orbital-dependent functionals for the exchange-correlation (xc) energy. Two different schemes that deal with orbital-dependent functionals, the Kohn-Sham (KS) and the generalized Kohn-Sham (gKS) formalism, have been realized. Hybrid functionals, combining some amount of the orbital-dependent exact exchange energy with local or semi-local functionals of the density, are implemented within the gKS scheme. We work in particular with the PBE0 hybrid of Perdew, Burke, and Ernzerhof. Our implementation relies on a representation of the non-local exact exchange potential - its calculation constitutes the most time consuming step in a practical calculation - by an auxiliary mixed product basis (MPB). In this way, the matrix elements of the Hamiltonian corresponding to the non-local potential become a Brillouin-zone (BZ) sum over vector-matrix-vector products. Several techniques are developed and explored to further accelerate our numerical scheme. We show PBE0 results for a variety of semiconductors and insulators. In comparison with experiment, the PBE0 functional leads to improved band gaps and an improved description of localized states. Even for the ferromagnetic semiconductor EuO with localized 4f electrons, the electronic and magnetic properties are correctly described by the PBE0 functional. Subsequently, we discuss the construction of the local, multiplicative exact exchange (EXX) potential from the non-local, orbital-dependent exact exchange energy. For this purpose we employ the optimized effective potential (OEP) method. Central ingredients of the OEP equation are the KS wave-function response and the single-particle density response function. We show that a balance between the LAPW

  16. Thermal properties of UO2 from density functional theory: role of strong correlations

    International Nuclear Information System (INIS)

    Panigrahi, Puspamitra; Kaur Gurpreet; Valsakumar, M.C.

    2011-01-01

    We report a study of ground state magnetic structure of Uranium-dioxide (UO 2 ) using ab initio calculations employing PAW pseudopotentials and Dudarev's version of GGA+U formalism as implemented in VASP to take into account the strong on-site Coulomb correlation among the localized Uranium-5f electrons. By choosing the value of the Hubbard parameter U eff to be 4.0 eV, we have confirmed the experimental observation that the ground state of UO 2 is an insulator with an anti-ferromagnetic (AFM) ordering. We study systematically the ground state structural, electronic, and magnetic properties of UO 2 and focus on the structure sensitive thermal properties such as specific heat, thermal expansion and comment on the calculation of thermal conductivity. (author)

  17. Dynamics of tripartite quantum correlations and decoherence in flux qubit systems under local and non-local static noise

    Science.gov (United States)

    Arthur, Tsamouo Tsokeng; Martin, Tchoffo; Fai, Lukong Cornelius

    2018-06-01

    We investigate the dynamics of entanglement, decoherence and quantum discord in a system of three non-interacting superconducting flux qubits (fqubits) initially prepared in a Greenberger-Horne-Zeilinger (GHZ) state and subject to static noise in different, bipartite and common environments, since it is recognized that different noise configurations generally lead to completely different dynamical behavior of physical systems. The noise is modeled by randomizing the single fqubit transition amplitude. Decoherence and quantum correlations dynamics are strongly affected by the purity of the initial state, type of system-environment interaction and the system-environment coupling strength. Specifically, quantum correlations can persist when the fqubits are commonly coupled to a noise source, and reaches a saturation value respective to the purity of the initial state. As the number of decoherence channels increases (bipartite and different environments), decoherence becomes stronger against quantum correlations that decay faster, exhibiting sudden death and revival phenomena. The residual entanglement can be successfully detected by means of suitable entanglement witness, and we derive a necessary condition for entanglement detection related to the tunable and non-degenerated energy levels of fqubits. In accordance with the current literature, our results further suggest the efficiency of fqubits over ordinary ones, as far as the preservation of quantum correlations needed for quantum processing purposes is concerned.

  18. Prediction of essential proteins based on subcellular localization and gene expression correlation.

    Science.gov (United States)

    Fan, Yetian; Tang, Xiwei; Hu, Xiaohua; Wu, Wei; Ping, Qing

    2017-12-01

    Essential proteins are indispensable to the survival and development process of living organisms. To understand the functional mechanisms of essential proteins, which can be applied to the analysis of disease and design of drugs, it is important to identify essential proteins from a set of proteins first. As traditional experimental methods designed to test out essential proteins are usually expensive and laborious, computational methods, which utilize biological and topological features of proteins, have attracted more attention in recent years. Protein-protein interaction networks, together with other biological data, have been explored to improve the performance of essential protein prediction. The proposed method SCP is evaluated on Saccharomyces cerevisiae datasets and compared with five other methods. The results show that our method SCP outperforms the other five methods in terms of accuracy of essential protein prediction. In this paper, we propose a novel algorithm named SCP, which combines the ranking by a modified PageRank algorithm based on subcellular compartments information, with the ranking by Pearson correlation coefficient (PCC) calculated from gene expression data. Experiments show that subcellular localization information is promising in boosting essential protein prediction.

  19. Local correlations for flap gap oscillatory blowing active flow control technology

    Directory of Open Access Journals (Sweden)

    Cătălin NAE

    2010-09-01

    Full Text Available Active technology for oscillatory blowing in the flap gap has been tested at INCAS subsonic wind tunnel in order to evaluate this technology for usage in high lift systems with active flow control. The main goal for this investigation was to validate TRL level 4 for this technology and to extend towards flight testing. CFD analysis was performed in order to identify local correlations with experimental data and to better formulate a design criteria so that a maximum increase in lift is possible under given geometrical constraints. Reference to a proposed metric for noise evaluation is also given. This includes basic 2D flow cases and also 2.5D configurations. In 2.5D test cases this work has been extended so that the proposed system may be selected as a mature technology in the JTI Clean Sky, Smart Fixed Wing Aircraft ITD. Complex post-processing of the experimental and CFD data was mainly oriented towards system efficiency and TRL evaluation for this active technology.

  20. TURBULENT DYNAMICS IN SOLAR FLARE SHEET STRUCTURES MEASURED WITH LOCAL CORRELATION TRACKING

    Energy Technology Data Exchange (ETDEWEB)

    McKenzie, D. E., E-mail: mckenzie@physics.montana.edu [Department of Physics, Montana State University, P.O. Box 173840, Bozeman, MT 59717-3840 (United States)

    2013-03-20

    High-resolution observations of the Sun's corona in extreme ultraviolet and soft X-rays have revealed a new world of complexity in the sheet-like structures connecting coronal mass ejections (CMEs) to the post-eruption flare arcades. This article presents initial findings from an exploration of dynamic flows in two flares observed with Hinode/XRT and SDO/AIA. The flows are observed in the hot ({approx}> 10 MK) plasma above the post-eruption arcades and measured with local correlation tracking. The observations demonstrate significant shears in velocity, giving the appearance of vortices and stagnations. Plasma diagnostics indicate that the plasma {beta} exceeds unity in at least one of the studied events, suggesting that the coronal magnetic fields may be significantly affected by the turbulent flows. Although reconnection models of eruptive flares tend to predict a macroscopic current sheet in the region between the CME and the flare arcade, it is not yet clear whether the observed sheet-like structures are identifiable as the current sheets or 'thermal halos' surrounding the current sheets. Regardless, the relationship between the turbulent motions and the embedded magnetic field is likely to be complicated, involving dynamic fluid processes that produce small length scales in the current sheet. Such processes may be crucial for triggering, accelerating, and/or prolonging reconnection in the corona.

  1. Extending Local Canonical Correlation Analysis to Handle General Linear Contrasts for fMRI Data

    Directory of Open Access Journals (Sweden)

    Mingwu Jin

    2012-01-01

    Full Text Available Local canonical correlation analysis (CCA is a multivariate method that has been proposed to more accurately determine activation patterns in fMRI data. In its conventional formulation, CCA has several drawbacks that limit its usefulness in fMRI. A major drawback is that, unlike the general linear model (GLM, a test of general linear contrasts of the temporal regressors has not been incorporated into the CCA formalism. To overcome this drawback, a novel directional test statistic was derived using the equivalence of multivariate multiple regression (MVMR and CCA. This extension will allow CCA to be used for inference of general linear contrasts in more complicated fMRI designs without reparameterization of the design matrix and without reestimating the CCA solutions for each particular contrast of interest. With the proper constraints on the spatial coefficients of CCA, this test statistic can yield a more powerful test on the inference of evoked brain regional activations from noisy fMRI data than the conventional t-test in the GLM. The quantitative results from simulated and pseudoreal data and activation maps from fMRI data were used to demonstrate the advantage of this novel test statistic.

  2. Increasing the applicability of density functional theory. IV. Consequences of ionization-potential improved exchange-correlation potentials.

    Science.gov (United States)

    Verma, Prakash; Bartlett, Rodney J

    2014-05-14

    This paper's objective is to create a "consistent" mean-field based Kohn-Sham (KS) density functional theory (DFT) meaning the functional should not only provide good total energy properties, but also the corresponding KS eigenvalues should be accurate approximations to the vertical ionization potentials (VIPs) of the molecule, as the latter condition attests to the viability of the exchange-correlation potential (VXC). None of the prominently used DFT approaches show these properties: the optimized effective potential VXC based ab initio dft does. A local, range-separated hybrid potential cam-QTP-00 is introduced as the basis for a "consistent" KS DFT approach. The computed VIPs as the negative of KS eigenvalue have a mean absolute error of 0.8 eV for an extensive set of molecule's electron ionizations, including the core. Barrier heights, equilibrium geometries, and magnetic properties obtained from the potential are in good agreement with experiment. A similar accuracy with less computational efforts can be achieved by using a non-variational global hybrid variant of the QTP-00 approach.

  3. Towards a resolution of the cosmological singularity in non-local higher derivative theories of gravity

    International Nuclear Information System (INIS)

    Biswas, Tirthabir; Koivisto, Tomi; Mazumdar, Anupam

    2010-01-01

    One of the greatest problems of standard cosmology is the Big Bang singularity. Previously it has been shown that non-local ghostfree higher-derivative modifications of Einstein gravity in the ultra-violet regime can admit non-singular bouncing solutions. In this paper we study in more details the dynamical properties of the equations of motion for these theories of gravity in presence of positive and negative cosmological constants and radiation. We find stable inflationary attractor solutions in the presence of a positive cosmological constant which renders inflation geodesically complete, while in the presence of a negative cosmological constant a cyclic universe emerges. We also provide an algorithm for tracking the super-Hubble perturbations during the bounce and show that the bouncing solutions are free from any perturbative instability

  4. Multifractality and quantum diffusion from self-consistent theory of localization

    Energy Technology Data Exchange (ETDEWEB)

    Suslov, I. M., E-mail: suslov@kapitza.ras.ru [Kapitza Institute for Physical Problems (Russian Federation)

    2015-11-15

    Multifractal properties of wave functions in a disordered system can be derived from self-consistent theory of localization by Vollhardt and Wölfle. A diagrammatic interpretation of results allows to obtain all scaling relations used in numerical experiments. The arguments are given that the one-loop Wegner result for a space dimension d = 2 + ϵ is exact, so the multifractal spectrum is strictly parabolical. The σ-models are shown to be deficient at the four-loop level and the possible reasons of that are discussed. The extremely slow convergence to the thermodynamic limit is demonstrated. The open question on the relation between multifractality and a spatial dispersion of the diffusion coefficient D(ω, q) is resolved in the compromise manner due to ambiguity of the D(ω, q) definition. Comparison is made with the extensive numerical material.

  5. Nonadiabatic dynamics in the semiclassical Liouville representation: Locality, transformation theory, and the energy budget

    Energy Technology Data Exchange (ETDEWEB)

    Martens, Craig C., E-mail: cmartens@uci.edu

    2016-12-20

    In this paper, we revisit the semiclassical Liouville approach to describing molecular dynamics with electronic transitions using classical trajectories. Key features of the formalism are highlighted. The locality in phase space and presence of nonclassical terms in the generalized Liouville equations are emphasized and discussed in light of trajectory surface hopping methodology. The representation dependence of the coupled semiclassical Liouville equations in the diabatic and adiabatic bases are discussed and new results for the transformation theory of the Wigner functions representing the corresponding density matrix elements given. We show that the diagonal energies of the state populations are not conserved during electronic transitions, as energy is stored in the electronic coherence. We discuss the implications of this observation for the validity of imposing strict energy conservation in trajectory based methods for simulating nonadiabatic processes.

  6. Calculating the anomalous supersymmetry breaking in super Yang-Mills theories with local coupling

    International Nuclear Information System (INIS)

    Kraus, E.

    2002-01-01

    Supersymmetric Yang-Mills theories with local gauge coupling have a new type of anomalous breaking, which appears as a breaking of supersymmetry in the Wess-Zumino gauge. The anomalous breaking generates the two-loop order of the gauge β function in terms of the one-loop β function and the anomaly coefficient. We determine the anomaly coefficient in the Wess-Zumino gauge by solving the relevant supersymmetry identities. For this purpose we use a background gauge and show that the anomaly coefficient is uniquely determined by convergent one-loop integrals. When evaluating the one-loop diagrams in the background gauge, it is seen that the anomaly coefficient is determined by the Feynman-gauge value of the one-loop vertex function to G μν G-tilde μν at vanishing momenta

  7. Translation-invariant global charges in a local scattering theory of massless particles

    International Nuclear Information System (INIS)

    Strube, D.

    1989-01-01

    The present thesis is dedicated to the study for specifically translation-invariant charges in the framework of a Wightman field theory without mass gap. The aim consists thereby in the determination of the effect of the charge operator on asymptotic scattering states of massless particles. In the first section the most important results in the massive case and of the present thesis in the massless case are presented. The object of the second section is the construction of asymptotic scattering states. In the third section the charge operator, which is first only defined on strictly local vectors, is extended to these scattering states, on which it acts additively. Finally an infinitesimal transformation of scalar asymptotic fields is determined. By this for the special case of translation-invariant generators and scalar massless asymptotic fields the same results is present as in the massive case. (orig./HSI) [de

  8. Feasibility of testing local hidden variable theories in a Charm factory

    International Nuclear Information System (INIS)

    Li Junli; Qiao Congfeng

    2006-01-01

    It is commonly believed that the local hidden variable theories (LHVTs) can be tested through measuring the Bell inequalities. This scheme, for the massive particle system, was originally set up for the entangled K 0 K 0 pair system from the φ factory. In this paper we show that the J/Ψ→K 0 K 0 process is even more realistic for this goal. We analyze the unique properties of J/Ψ in the detection of basic quantum effects, and find that it is possible to use J/Ψ decay as a test of LHVTs in the future τ-charm factory. Our analyses and conclusions are generally also true for other heavy onium decays

  9. China’s Institutional Architecture: A New Institutional Economics and Organization Theory Perspective on the Links between Local Governance and Local Enterprises

    NARCIS (Netherlands)

    B. Krug (Barbara); H. Hendrischke (Hans)

    2008-01-01

    textabstractWe start our exploration of China’s institutional change by asking what the China experience can tell us about institutional economics and organization theory. We point to under-researched areas such as the formation of firms and the interplay between firms and local politics. Our

  10. Quantum computation via local control theory: Direct sum vs. direct product Hilbert spaces

    International Nuclear Information System (INIS)

    Sklarz, Shlomo E.; Tannor, David J.

    2006-01-01

    The central objective in any quantum computation is the creation of a desired unitary transformation; the mapping that this unitary transformation produces between the input and output states is identified with the computation. In [S.E. Sklarz, D.J. Tannor, arXiv:quant-ph/0404081 (submitted to PRA) (2004)] it was shown that local control theory can be used to calculate fields that will produce such a desired unitary transformation. In contrast with previous strategies for quantum computing based on optimal control theory, the local control scheme maintains the system within the computational subspace at intermediate times, thereby avoiding unwanted decay processes. In [S.E. Sklarz et al.], the structure of the Hilbert space had a direct sum structure with respect to the computational register and the mediating states. In this paper, we extend the formalism to the important case of a direct product Hilbert space. The final equations for the control algorithm for the two cases are remarkably similar in structure, despite the fact that the derivations are completely different and that in one case the dynamics is in a Hilbert space and in the other case the dynamics is in a Liouville space. As shown in [S.E. Sklarz et al.], the direct sum implementation leads to a computational mechanism based on virtual transitions, and can be viewed as an extension of the principles of Stimulated Raman Adiabatic Passage from state manipulation to evolution operator manipulation. The direct product implementation developed here leads to the intriguing concept of virtual entanglement - computation that exploits second-order transitions that pass through entangled states but that leaves the subsystems nearly separable at all intermediate times. Finally, we speculate on a connection between the algorithm developed here and the concept of decoherence free subspaces

  11. Analysis of correlation functions in Toda theory and the Alday-Gaiotto-Tachikawa-Wyllard relation for SU(3) quiver

    International Nuclear Information System (INIS)

    Kanno, Shoichi; Matsuo, Yutaka; Shiba, Shotaro

    2010-01-01

    We give some evidences of the Alday-Gaiotto-Tachikawa-Wyllard relation between SU(3) quiver gauge theories and A 2 Toda theory. In particular, we derive the explicit form of 5-point correlation functions in the lower orders and confirm the agreement with Nekrasov's partition function for SU(3)xSU(3) quiver gauge theory. The algorithm to derive the correlation functions can be applied to a general n-point function in A 2 Toda theory, which will be useful to establish the relation for more generic quivers. Partial analysis is also given for the SU(3)xSU(2) case, and we comment on some technical issues that need clarification before establishing the relation.

  12. Theory of pairwise coupling embedded in more general local dispersion relations

    International Nuclear Information System (INIS)

    Fuchs, V.; Bers, A.; Harten, L.

    1985-01-01

    Earlier work on the mode conversion theory by Fuchs, Ko, and Bers is detailed and expanded upon, and its relation to energy conservation is discussed. Given a local dispersion relation, D(ω; k, z) = 0, describing stable waves excited at an externally imposed frequency ω, a pairwise mode-coupling event embedded therein is extracted by expanding D(k, z) around a contour k = k/sub c/(z) given by partialD/partialk = 0. The branch points of D(k, z) = 0 are the turning points of a second-order differential-equation representation. In obtaining the fraction of mode-converted energy, the connection formula and conservation of energy must be used together. Also, proper attention must be given to distinguish cases for which the coupling disappears or persists upon confluence of the branches, a property which is shown to depend on the forward (v/sub g/v/sub ph/>0) or backward (v/sub g/v/sub ph/<0) nature of the waves. Examples occurring in ion-cyclotron and lower-hybrid heating are presented, illustrating the use of the theory

  13. arXiv Algebraic Cycles and Local Anomalies in F-Theory

    CERN Document Server

    Bies, Martin; Weigand, Timo

    2017-11-16

    We introduce a set of identities in the cohomology ring of elliptic fibrations which are equivalent to the cancellation of gauge and mixed gauge-gravitational anomalies in F-theory compactifications to four and six dimensions. The identities consist in (co)homological relations between complex codimension-two cycles. The same set of relations, once evaluated on elliptic Calabi-Yau three-folds and four-folds, is shown to universally govern the structure of anomalies and their Green-Schwarz cancellation in six- and four-dimensional F-theory vacua, respectively. We furthermore conjecture that these relations hold not only within the cohomology ring, but even at the level of the Chow ring, i.e. as relations among codimension-two cycles modulo rational equivalence. We verify this conjecture in non-trivial examples with Abelian and non-Abelian gauge groups factors. Apart from governing the structure of local anomalies, the identities in the Chow ring relate different types of gauge backgrounds on elliptically fibre...

  14. Bond breaking and bond formation: how electron correlation is captured in many-body perturbation theory and density-functional theory.

    Science.gov (United States)

    Caruso, Fabio; Rohr, Daniel R; Hellgren, Maria; Ren, Xinguo; Rinke, Patrick; Rubio, Angel; Scheffler, Matthias

    2013-04-05

    For the paradigmatic case of H(2) dissociation, we compare state-of-the-art many-body perturbation theory in the GW approximation and density-functional theory in the exact-exchange plus random-phase approximation (RPA) for the correlation energy. For an unbiased comparison and to prevent spurious starting point effects, both approaches are iterated to full self-consistency (i.e., sc-RPA and sc-GW). The exchange-correlation diagrams in both approaches are topologically identical, but in sc-RPA they are evaluated with noninteracting and in sc-GW with interacting Green functions. This has a profound consequence for the dissociation region, where sc-RPA is superior to sc-GW. We argue that for a given diagrammatic expansion, sc-RPA outperforms sc-GW when it comes to bond breaking. We attribute this to the difference in the correlation energy rather than the treatment of the kinetic energy.

  15. Global solutions of restricted open-shell Hartree-Fock theory from semidefinite programming with applications to strongly correlated quantum systems.

    Science.gov (United States)

    Veeraraghavan, Srikant; Mazziotti, David A

    2014-03-28

    We present a density matrix approach for computing global solutions of restricted open-shell Hartree-Fock theory, based on semidefinite programming (SDP), that gives upper and lower bounds on the Hartree-Fock energy of quantum systems. While wave function approaches to Hartree-Fock theory yield an upper bound to the Hartree-Fock energy, we derive a semidefinite relaxation of Hartree-Fock theory that yields a rigorous lower bound on the Hartree-Fock energy. We also develop an upper-bound algorithm in which Hartree-Fock theory is cast as a SDP with a nonconvex constraint on the rank of the matrix variable. Equality of the upper- and lower-bound energies guarantees that the computed solution is the globally optimal solution of Hartree-Fock theory. The work extends a previously presented method for closed-shell systems [S. Veeraraghavan and D. A. Mazziotti, Phys. Rev. A 89, 010502-R (2014)]. For strongly correlated systems the SDP approach provides an alternative to the locally optimized Hartree-Fock energies and densities with a certificate of global optimality. Applications are made to the potential energy curves of C2, CN, Cr2, and NO2.

  16. Analysis, Design and Implementation of an Embedded Realtime Sound Source Localization System Based on Beamforming Theory

    Directory of Open Access Journals (Sweden)

    Arko Djajadi

    2009-12-01

    Full Text Available This project is intended to analyze, design and implement a realtime sound source localization system by using a mobile robot as the media. The implementated system uses 2 microphones as the sensors, Arduino Duemilanove microcontroller system with ATMega328p as the microprocessor, two permanent magnet DC motors as the actuators for the mobile robot and a servo motor as the actuator to rotate the webcam directing to the location of the sound source, and a laptop/PC as the simulation and display media. In order to achieve the objective of finding the position of a specific sound source, beamforming theory is applied to the system. Once the location of the sound source is detected and determined, the choice is either the mobile robot will adjust its position according to the direction of the sound source or only webcam will rotate in the direction of the incoming sound simulating the use of this system in a video conference. The integrated system has been tested and the results show the system could localize in realtime a sound source placed randomly on a half circle area (0 - 1800 with a radius of 0.3m - 3m, assuming the system is the center point of the circle. Due to low ADC and processor speed, achievable best angular resolution is still limited to 25o.

  17. Exact Local Correlations and Full Counting Statistics for Arbitrary States of the One-Dimensional Interacting Bose Gas

    Science.gov (United States)

    Bastianello, Alvise; Piroli, Lorenzo; Calabrese, Pasquale

    2018-05-01

    We derive exact analytic expressions for the n -body local correlations in the one-dimensional Bose gas with contact repulsive interactions (Lieb-Liniger model) in the thermodynamic limit. Our results are valid for arbitrary states of the model, including ground and thermal states, stationary states after a quantum quench, and nonequilibrium steady states arising in transport settings. Calculations for these states are explicitly presented and physical consequences are critically discussed. We also show that the n -body local correlations are directly related to the full counting statistics for the particle-number fluctuations in a short interval, for which we provide an explicit analytic result.

  18. Detection and localization of deep endometriosis by means of MRI and correlation with the ENZIAN score

    International Nuclear Information System (INIS)

    Di Paola, V.; Manfredi, R.; Castelli, F.; Negrelli, R.; Mehrabi, S.; Pozzi Mucelli, R.

    2015-01-01

    %, 95%, 99%, 86%, respectively. The highest accuracy was for adenomyosis (100%) and endometriosis of utero-sacral ligaments (USLs) (98%), slightly lower for vagina-rectovaginal septum an colo-rectal walls (96%), and the lowest for bladder endometriosis (92%). The concordance between histopathological and MRI ENZIAN score was excellent (k = 0.824); in particular it was 0.812 for lesions in vagina-rectovaginal space, 0.890 for lesions in USL, 0.822 for lesions in rectum–sigmoid colon, 1.000 for uterine adenomyosis, and 0.367 for lesions located in the bladder wall. Conclusion: MRI correlates with the ENZIAN score and has an accuracy of 95% in the detection and localization of deep endometriosis, allowing to minimize false negative results (4%) in patients with deep endometriosis and to obtain a correct preoperative staging

  19. Detection and localization of deep endometriosis by means of MRI and correlation with the ENZIAN score

    Energy Technology Data Exchange (ETDEWEB)

    Di Paola, V., E-mail: dipaola.valerio@libero.it; Manfredi, R.; Castelli, F.; Negrelli, R.; Mehrabi, S.; Pozzi Mucelli, R.

    2015-04-15

    %, 95%, 99%, 86%, respectively. The highest accuracy was for adenomyosis (100%) and endometriosis of utero-sacral ligaments (USLs) (98%), slightly lower for vagina-rectovaginal septum an colo-rectal walls (96%), and the lowest for bladder endometriosis (92%). The concordance between histopathological and MRI ENZIAN score was excellent (k = 0.824); in particular it was 0.812 for lesions in vagina-rectovaginal space, 0.890 for lesions in USL, 0.822 for lesions in rectum–sigmoid colon, 1.000 for uterine adenomyosis, and 0.367 for lesions located in the bladder wall. Conclusion: MRI correlates with the ENZIAN score and has an accuracy of 95% in the detection and localization of deep endometriosis, allowing to minimize false negative results (4%) in patients with deep endometriosis and to obtain a correct preoperative staging.

  20. Spatially resolved vertical vorticity in solar supergranulation using helioseismology and local correlation tracking

    Science.gov (United States)

    Langfellner, J.; Gizon, L.; Birch, A. C.

    2015-09-01

    Flow vorticity is a fundamental property of turbulent convection in rotating systems. Solar supergranules exhibit a preferred sense of rotation, which depends on the hemisphere. This is due to the Coriolis force acting on the diverging horizontal flows. We aim to spatially resolve the vertical flow vorticity of the average supergranule at different latitudes, both for outflow and inflow regions. To measure the vertical vorticity, we use two independent techniques: time-distance helioseismology (TD) and local correlation tracking of granules in intensity images (LCT) using data from the Helioseismic and Magnetic Imager (HMI) on board the Solar Dynamics Observatory (SDO). Both maps are corrected for center-to-limb systematic errors. We find that 8 h TD and LCT maps of vertical vorticity are highly correlated at large spatial scales. Associated with the average supergranule outflow, we find tangential (vortical) flows that reach about 10 m s-1 in the clockwise direction at 40° latitude. In average inflow regions, the tangential flow reaches the same magnitude, but in the anticlockwise direction. These tangential velocities are much smaller than the radial (diverging) flow component (300 m s-1 for the average outflow and 200 m s-1 for the average inflow). The results for TD and LCT as measured from HMI are in excellent agreement for latitudes between -60° and 60°. From HMI LCT, we measure the vorticity peak of the average supergranule to have a full width at half maximum of about 13 Mm for outflows and 8 Mm for inflows. This is larger than the spatial resolution of the LCT measurements (about 3 Mm). On the other hand, the vorticity peak in outflows is about half the value measured at inflows (e.g., 4 × 10-6 s-1 clockwise compared to 8 × 10-6 s-1 anticlockwise at 40° latitude). Results from the Michelson Doppler Imager (MDI) on board the Solar and Heliospheric Observatory (SOHO) obtained in 2010 are biased compared to the HMI/SDO results for the same period