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Sample records for dipositronium path integral

  1. Hamiltonian path integrals

    International Nuclear Information System (INIS)

    Prokhorov, L.V.

    1982-01-01

    The properties of path integrals associated with the allowance for nonstandard terms reflecting the operator nature of the canonical variables are considered. Rules for treating such terms (''equivalence rules'') are formulated. Problems with a boundary, the behavior of path integrals under canonical transformations, and the problem of quantization of dynamical systems with constraints are considered in the framework of the method

  2. Path integration quantization

    International Nuclear Information System (INIS)

    DeWitt-Morette, C.

    1983-01-01

    Much is expected of path integration as a quantization procedure. Much more is possible if one recognizes that path integration is at the crossroad of stochastic and differential calculus and uses the full power of both stochastic and differential calculus in setting up and computing path integrals. In contrast to differential calculus, stochastic calculus has only comparatively recently become an instrument of thought. It has nevertheless already been used in a variety of challenging problems, for instance in the quantization problem. The author presents some applications of the stochastic scheme. (Auth.)

  3. Feynman's path integrals and Bohm's particle paths

    International Nuclear Information System (INIS)

    Tumulka, Roderich

    2005-01-01

    Both Bohmian mechanics, a version of quantum mechanics with trajectories, and Feynman's path integral formalism have something to do with particle paths in space and time. The question thus arises how the two ideas relate to each other. In short, the answer is, path integrals provide a re-formulation of Schroedinger's equation, which is half of the defining equations of Bohmian mechanics. I try to give a clear and concise description of the various aspects of the situation. (letters and comments)

  4. Hamiltonian path integrals

    International Nuclear Information System (INIS)

    Prokhorov, L.V.

    1982-01-01

    Problems related to consideration of operator nonpermutability in Hamiltonian path integral (HPI) are considered in the review. Integrals are investigated using trajectories in configuration space (nonrelativistic quantum mechanics). Problems related to trajectory integrals in HPI phase space are discussed: the problem of operator nonpermutability consideration (extra terms problem) and corresponding equivalence rules; ambiguity of HPI usual recording; transition to curvilinear coordinates. Problem of quantization of dynamical systems with couplings has been studied. As in the case of canonical transformations, quantization of the systems with couplings of the first kind requires the consideration of extra terms

  5. Path integral in Snyder space

    International Nuclear Information System (INIS)

    Mignemi, S.; Štrajn, R.

    2016-01-01

    The definition of path integrals in one- and two-dimensional Snyder space is discussed in detail both in the traditional setting and in the first-order formalism of Faddeev and Jackiw. - Highlights: • The definition of the path integral in Snyder space is discussed using phase space methods. • The same result is obtained in the first-order formalism of Faddeev and Jackiw. • The path integral formulation of the two-dimensional Snyder harmonic oscillator is outlined.

  6. Path integral in Snyder space

    Energy Technology Data Exchange (ETDEWEB)

    Mignemi, S., E-mail: smignemi@unica.it [Dipartimento di Matematica e Informatica, Università di Cagliari, Viale Merello 92, 09123 Cagliari (Italy); INFN, Sezione di Cagliari, Cittadella Universitaria, 09042 Monserrato (Italy); Štrajn, R. [Dipartimento di Matematica e Informatica, Università di Cagliari, Viale Merello 92, 09123 Cagliari (Italy); INFN, Sezione di Cagliari, Cittadella Universitaria, 09042 Monserrato (Italy)

    2016-04-29

    The definition of path integrals in one- and two-dimensional Snyder space is discussed in detail both in the traditional setting and in the first-order formalism of Faddeev and Jackiw. - Highlights: • The definition of the path integral in Snyder space is discussed using phase space methods. • The same result is obtained in the first-order formalism of Faddeev and Jackiw. • The path integral formulation of the two-dimensional Snyder harmonic oscillator is outlined.

  7. Path integrals and quantum processes

    CERN Document Server

    Swanson, Marc S

    1992-01-01

    In a clearly written and systematic presentation, Path Integrals and Quantum Processes covers all concepts necessary to understand the path integral approach to calculating transition elements, partition functions, and source functionals. The book, which assumes only a familiarity with quantum mechanics, is ideal for use as a supplemental textbook in quantum mechanics and quantum field theory courses. Graduate and post-graduate students who are unfamiliar with the path integral will also benefit from this contemporary text. Exercise sets are interspersed throughout the text to facilitate self-

  8. Path integrals as discrete sums

    Science.gov (United States)

    Bitar, Khalil; Khuri, N. N.; Ren, H. C.

    1991-08-01

    We present a new formulation of Feynman's path integral, based on Voronin's theorems on the universality of the Riemann zeta function. The result is a discrete sum over ``paths,'' each given by a zeta function. A new measure which leads to the correct quantum mechanics is explicitly given.

  9. Path integrals in curvilinear coordinates

    International Nuclear Information System (INIS)

    Prokhorov, L.V.

    1984-01-01

    Integration limits are studied for presenting the path integral curvilinear coordinates. For spherical (and topoloqically equivalent) coordinates it is shown that in formulas involving classical action in the exponent integration over all variables should be carried out within infinite limits. Another peculiarity is associated with appearance of the operator q which provides a complete definition of the wave functions out of the physical region. arguments are given upporting the validity of the cited statament in the general case

  10. Path Integrals in Quantum Mechanics

    International Nuclear Information System (INIS)

    Louko, J

    2005-01-01

    Jean Zinn-Justin's textbook Path Integrals in Quantum Mechanics aims to familiarize the reader with the path integral as a calculational tool in quantum mechanics and field theory. The emphasis is on quantum statistical mechanics, starting with the partition function Tr exp(-β H) and proceeding through the diffusion equation to barrier penetration problems and their semiclassical limit. The 'real time' path integral is defined via analytic continuation and used for the path-integral representation of the nonrelativistic S-matrix and its perturbative expansion. Holomorphic and Grassmannian path integrals are introduced and applied to nonrelativistic quantum field theory. There is also a brief discussion of path integrals in phase space. The introduction includes a brief historical review of path integrals, supported by a bibliography with some 40 entries. As emphasized in the introduction, mathematical rigour is not a central issue in the book. This allows the text to present the calculational techniques in a very readable manner: much of the text consists of worked-out examples, such as the quartic anharmonic oscillator in the barrier penetration chapter. At the end of each chapter there are exercises, some of which are of elementary coursework type, but the majority are more in the style of extended examples. Most of the exercises indeed include the solution or a sketch thereof. The book assumes minimal previous knowledge of quantum mechanics, and some basic quantum mechanical notation is collected in an appendix. The material has a large overlap with selected chapters in the author's thousand-page textbook Quantum Field Theory and Critical Phenomena (2002 Oxford: Clarendon). The stand-alone scope of the present work has, however, allowed a more focussed organization of this material, especially in the chapters on, respectively, holomorphic and Grassmannian path integrals. In my view the book accomplishes its aim admirably and is eminently usable as a textbook

  11. Path Integrals in Quantum Mechanics

    International Nuclear Information System (INIS)

    Chetouani, L

    2005-01-01

    By treating path integrals the author, in this book, places at the disposal of the reader a modern tool for the comprehension of standard quantum mechanics. Thus the most important applications, such as the tunnel effect, the diffusion matrix, etc, are presented from an original point of view on the action S of classical mechanics while having it play a central role in quantum mechanics. What also emerges is that the path integral describes these applications more richly than are described traditionally by differential equations, and consequently explains them more fully. The book is certainly of high quality in all aspects: original in presentation, rigorous in the demonstrations, judicious in the choice of exercises and, finally, modern, for example in the treatment of the tunnel effect by the method of instantons. Moreover, the correspondence that exists between classical and quantum mechanics is well underlined. I thus highly recommend this book (the French version being already available) to those who wish to familiarize themselves with formulation by path integrals. They will find, in addition, interesting topics suitable for exploring further. (book review)

  12. Nonperturbative path integral expansion II

    International Nuclear Information System (INIS)

    Kaiser, H.J.

    1976-05-01

    The Feynman path integral representation of the 2-point function for a self-interacting Bose field is investigated using an expansion ('Path Integral Expansion', PIE) of the exponential of the kinetic term of the Lagrangian. This leads to a series - illustrated by a graph scheme - involving successively a coupling of more and more points of the lattice space commonly employed in the evaluation of path integrals. The values of the individual PIE graphs depend of course on the lattice constant. Two methods - Pade approximation and Borel-type extrapolation - are proposed to extract information about the continuum limit from a finite-order PIE. A more flexible PIE is possible by expanding besides the kinetic term a suitably chosen part of the interaction term too. In particular, if the co-expanded part is a mass term the calculation becomes only slightly more complicated than in the original formulation and the appearance of the graph scheme is unchanged. A significant reduction of the number of graphs and an improvement of the convergence of the PIE can be achieved by performing certain sums over an infinity of graph elements. (author)

  13. Path integrals on causal sets

    International Nuclear Information System (INIS)

    Johnston, Steven

    2009-01-01

    We describe a quantum mechanical model for particle propagation on a causal set. The model involves calculating a particle propagator by summing amplitudes assigned to trajectories within the causal set. This 'discrete path integral' is calculated using a matrix geometric series. Amplitudes are given which, when the causal set is generated by sprinkling points into 1+1 or 3+1 Minkowski spacetime, ensure the particle propagator agrees in a suitable sense, with the retarded causal propagator for the Klein-Gordon equation.

  14. Path Integral Formulation of Anomalous Diffusion Processes

    OpenAIRE

    Friedrich, Rudolf; Eule, Stephan

    2011-01-01

    We present the path integral formulation of a broad class of generalized diffusion processes. Employing the path integral we derive exact expressions for the path probability densities and joint probability distributions for the class of processes under consideration. We show that Continuous Time Random Walks (CTRWs) are included in our framework. A closed expression for the path probability distribution of CTRWs is found in terms of their waiting time distribution as the solution of a Dyson ...

  15. Path integrals and geometry of trajectories

    International Nuclear Information System (INIS)

    Blau, M.; Keski-Vakkuri, E.; Niemi, A.J.

    1990-01-01

    A geometrical interpretation of path integrals is developed in the space of trajectories. This yields a supersymmetric formulation of a generic path integral, with the supersymmetry resembling the BRST supersymmetry of a first class constrained system. If the classical equation of motion is a Killing vector field in the space of trajectories, the supersymmetry localizes the path integral to classical trajectories and the WKB approximation becomes exact. This can be viewed as a path integral generalization of the Duistermaat-Heckman theorem, which states the conditions for the exactness of the WKB approximation for integrals in a compact phase space. (orig.)

  16. Integrated assignment and path planning

    Science.gov (United States)

    Murphey, Robert A.

    2005-11-01

    A surge of interest in unmanned systems has exposed many new and challenging research problems across many fields of engineering and mathematics. These systems have the potential of transforming our society by replacing dangerous and dirty jobs with networks of moving machines. This vision is fundamentally separate from the modern view of robotics in that sophisticated behavior is realizable not by increasing individual vehicle complexity, but instead through collaborative teaming that relies on collective perception, abstraction, decision making, and manipulation. Obvious examples where collective robotics will make an impact include planetary exploration, space structure assembly, remote and undersea mining, hazardous material handling and clean-up, and search and rescue. Nonetheless, the phenomenon driving this technology trend is the increasing reliance of the US military on unmanned vehicles, specifically, aircraft. Only a few years ago, following years of resistance to the use of unmanned systems, the military and civilian leadership in the United States reversed itself and have recently demonstrated surprisingly broad acceptance of increasingly pervasive use of unmanned platforms in defense surveillance, and even attack. However, as rapidly as unmanned systems have gained acceptance, the defense research community has discovered the technical pitfalls that lie ahead, especially for operating collective groups of unmanned platforms. A great deal of talent and energy has been devoted to solving these technical problems, which tend to fall into two categories: resource allocation of vehicles to objectives, and path planning of vehicle trajectories. An extensive amount of research has been conducted in each direction, yet, surprisingly, very little work has considered the integrated problem of assignment and path planning. This dissertation presents a framework for studying integrated assignment and path planning and then moves on to suggest an exact

  17. New framework for the Feynman path integral

    International Nuclear Information System (INIS)

    Shaharir, M.Z.

    1986-01-01

    The well-known Fourier integral solution of the free diffusion equation in an arbitrary Euclidean space is reduced to Feynmannian integrals using the method partly contained in the formulation of the Fresnelian integral. By replacing the standard Hilbert space underlying the present mathematical formulation of the Feynman path integral by a new Hilbert space, the space of classical paths on the tangent bundle to the Euclidean space (and more general to an arbitrary Riemannian manifold) equipped with a natural inner product, we show that our Feynmannian integral is in better agreement with the qualitative features of the original Feynman path integral than the previous formulations of the integral

  18. Path integrals for arbitrary canonical transformations

    International Nuclear Information System (INIS)

    Oliveira, L.A.R. de.

    1980-01-01

    Some aspects of the path integral formulation of quantum mechanics are studied. This formalism is generalized to arbitrary canonical transformations, by means of an association between path integral probalility amplitudes and classical generators of transformations, analogous to the usual Hamiltonian time development phase space expression. Such association turns out to be equivalent to the Weyl quantization rule, and it is also shown that this formalism furnishes a path integral representation for a Lie algebra of a given set of classical generators. Some physical considerations about the path integral quantization procedure and about the relationship between classical and quantum dynamical structures are also discussed. (Author) [pt

  19. Techniques and applications of path integration

    CERN Document Server

    Schulman, L S

    2005-01-01

    A book of techniques and applications, this text defines the path integral and illustrates its uses by example. It is suitable for advanced undergraduates and graduate students in physics; its sole prerequisite is a first course in quantum mechanics. For applications requiring specialized knowledge, the author supplies background material.The first part of the book develops the techniques of path integration. Topics include probability amplitudes for paths and the correspondence limit for the path integral; vector potentials; the Ito integral and gauge transformations; free particle and quadra

  20. Integrating path dependency and path creation in a general understanding of path constitution

    OpenAIRE

    Meyer, Uli; Schubert, Cornelius

    2007-01-01

    Path dependency as it is described by Arthur and David portrays technological developments as historically embedded, emergent processes. In contrast, Garud and Karnøe's notion of path creation emphasises the role of strategic change and deliberate action for the development of new technologies. In this article, we integrate both concepts into a general understanding of path processes which accounts for emergent as well as deliberate modes of path constitution. In addition, we distinguish betw...

  1. Dissociable cognitive mechanisms underlying human path integration.

    Science.gov (United States)

    Wiener, Jan M; Berthoz, Alain; Wolbers, Thomas

    2011-01-01

    Path integration is a fundamental mechanism of spatial navigation. In non-human species, it is assumed to be an online process in which a homing vector is updated continuously during an outward journey. In contrast, human path integration has been conceptualized as a configural process in which travelers store working memory representations of path segments, with the computation of a homing vector only occurring when required. To resolve this apparent discrepancy, we tested whether humans can employ different path integration strategies in the same task. Using a triangle completion paradigm, participants were instructed either to continuously update the start position during locomotion (continuous strategy) or to remember the shape of the outbound path and to calculate home vectors on basis of this representation (configural strategy). While overall homing accuracy was superior in the configural condition, participants were quicker to respond during continuous updating, strongly suggesting that homing vectors were computed online. Corroborating these findings, we observed reliable differences in head orientation during the outbound path: when participants applied the continuous updating strategy, the head deviated significantly from straight ahead in direction of the start place, which can be interpreted as a continuous motor expression of the homing vector. Head orientation-a novel online measure for path integration-can thus inform about the underlying updating mechanism already during locomotion. In addition to demonstrating that humans can employ different cognitive strategies during path integration, our two-systems view helps to resolve recent controversies regarding the role of the medial temporal lobe in human path integration.

  2. The transformation techniques in path integration

    International Nuclear Information System (INIS)

    Inomata, A.

    1989-01-01

    In this paper general remarks are made concerning the time transformation techniques in path integration and their implementations. Time transformations may be divided into two classes: global (integrable) time transformations and local (nonintegrable) time transformations. Although a brief account of global time transformations is given, attention is focused on local transformations. First, time transformations in the classical Kepler problem are reviewed. Then, problems encountered in implementing a local time transformation in quantum mechanics are analyzed. A several propositions pertinent to the implementation of local time transformations, particularly basic to the local time rescaling trick in a discretized path integral, are presented

  3. Path-integral derivation of the complex ABCD Huygens integral

    International Nuclear Information System (INIS)

    Wright, E.M.; Garrison, J.C.

    1987-01-01

    The Huygens integral, or Green's function, for paraxial beam propagation in a generalized lenslike medium is derived as a Feynman path integral involving a summation over real rays. This formulation provides a physically intuitive understanding of the structure of the Green's function. The path integral is evaluated by introducing in a consistent manner the notion of complex rays, and the familiar result for the Huygens integral in terms of the complex ABCD matrix of the medium is obtained

  4. Integrated robust controller for vehicle path following

    International Nuclear Information System (INIS)

    Mashadi, Behrooz; Ahmadizadeh, Pouyan; Majidi, Majid; Mahmoodi-Kaleybar, Mehdi

    2015-01-01

    The design of an integrated 4WS+DYC control system to guide a vehicle on a desired path is presented. The lateral dynamics of the path follower vehicle is formulated by considering important parameters. To reduce the effect of uncertainties in vehicle parameters, a robust controller is designed based on a μ-synthesis approach. Numerical simulations are performed using a nonlinear vehicle model in MATLAB environment in order to investigate the effectiveness of the designed controller. Results of simulations show that the controller has a profound ability to making the vehicle track the desired path in the presence of uncertainties

  5. Integrated robust controller for vehicle path following

    Energy Technology Data Exchange (ETDEWEB)

    Mashadi, Behrooz; Ahmadizadeh, Pouyan, E-mail: p-ahmadizadeh@iust.ac.ir; Majidi, Majid, E-mail: m-majidi@iust.ac.ir [Iran University of Science and Technology, School of Automotive Engineering (Iran, Islamic Republic of); Mahmoodi-Kaleybar, Mehdi, E-mail: m-mahmoodi-k@iust.ac.ir [Iran University of Science and Technology, School of Mechanical Engineering (Iran, Islamic Republic of)

    2015-02-15

    The design of an integrated 4WS+DYC control system to guide a vehicle on a desired path is presented. The lateral dynamics of the path follower vehicle is formulated by considering important parameters. To reduce the effect of uncertainties in vehicle parameters, a robust controller is designed based on a μ-synthesis approach. Numerical simulations are performed using a nonlinear vehicle model in MATLAB environment in order to investigate the effectiveness of the designed controller. Results of simulations show that the controller has a profound ability to making the vehicle track the desired path in the presence of uncertainties.

  6. Path integral quantization of gravitational interactions

    International Nuclear Information System (INIS)

    Fujikawa, Kazuo.

    1985-07-01

    Some of the local symmetry properties of quantum field theory in curved space-time and quantized gravitational interactions are discussed. We concentrate on local symmetry properties, and thus the asymptotically flat space-time is assumed, whenever necessary, in the hope that the precise boundary conditions will not modify the short distance structure in quantum theory. We adopt the DeWitt-Faddeev-Popov prescription of the Feynman path integral with a complete gauge fixing. The topics discussed include: (i) A brief review of the path integral derivation of chiral anomalies in flat space-time. (ii) The specification of the gravitational path integral measure, which avoids all the ''fake'' gravitational anomalies, and the applications of this path integral prescription to 1) effective potential in generalized Kaluza-Klein theory, 2) 4-dimensional conformal anomalies, 3) conformal symmetry in pure conformal gravity, 4) bosonic string theory as a gravitational theory in d = 2, 5) Virasoro condition and the Wheeler-DeWitt equation in the path integral formalism, 6) gravitational anomalies and the definition of the energy-momentum tensor. (author)

  7. The positronium and the dipositronium in a Hartree-Fock approximation of quantum electrodynamics

    DEFF Research Database (Denmark)

    Sok, Jérémy Vithya

    2016-01-01

    The Bogoliubov-Dirac-Fock (BDF) model is a no-photon approximation of quantum electrodynamics. It allows to study relativistic electrons in interaction with the Dirac sea. A state is fully characterized by its one-body density matrix, an infinite rank non-negative projector. We prove the existence...... of the para-positronium, the bound state of an electron and a positron with antiparallel spins, in the BDF model represented by a critical point of the energy functional in the absence of an external field. We also prove the existence of the dipositronium, a molecule made of two electrons and two positrons...... that also appears as a critical point. More generally, for any half integer j ∈ 1/2 + Z+, we prove the existence of a critical point of the energy functional made of 2j + 1 electrons and 2j + 1 positrons....

  8. Classical and quantum dynamics from classical paths to path integrals

    CERN Document Server

    Dittrich, Walter

    2016-01-01

    Graduate students who want to become familiar with advanced computational strategies in classical and quantum dynamics will find here both the fundamentals of a standard course and a detailed treatment of the time-dependent oscillator, Chern-Simons mechanics, the Maslov anomaly and the Berry phase, to name a few. Well-chosen and detailed examples illustrate the perturbation theory, canonical transformations, the action principle and demonstrate the usage of path integrals. This new edition has been revised and enlarged with chapters on quantum electrodynamics, high energy physics, Green’s functions and strong interaction.

  9. Which coordinate system for modelling path integration?

    Science.gov (United States)

    Vickerstaff, Robert J; Cheung, Allen

    2010-03-21

    Path integration is a navigation strategy widely observed in nature where an animal maintains a running estimate, called the home vector, of its location during an excursion. Evidence suggests it is both ancient and ubiquitous in nature, and has been studied for over a century. In that time, canonical and neural network models have flourished, based on a wide range of assumptions, justifications and supporting data. Despite the importance of the phenomenon, consensus and unifying principles appear lacking. A fundamental issue is the neural representation of space needed for biological path integration. This paper presents a scheme to classify path integration systems on the basis of the way the home vector records and updates the spatial relationship between the animal and its home location. Four extended classes of coordinate systems are used to unify and review both canonical and neural network models of path integration, from the arthropod and mammalian literature. This scheme demonstrates analytical equivalence between models which may otherwise appear unrelated, and distinguishes between models which may superficially appear similar. A thorough analysis is carried out of the equational forms of important facets of path integration including updating, steering, searching and systematic errors, using each of the four coordinate systems. The type of available directional cue, namely allothetic or idiothetic, is also considered. It is shown that on balance, the class of home vectors which includes the geocentric Cartesian coordinate system, appears to be the most robust for biological systems. A key conclusion is that deducing computational structure from behavioural data alone will be difficult or impossible, at least in the absence of an analysis of random errors. Consequently it is likely that further theoretical insights into path integration will require an in-depth study of the effect of noise on the four classes of home vectors. Copyright 2009 Elsevier Ltd

  10. Field theory a path integral approach

    CERN Document Server

    Das, Ashok

    2006-01-01

    This unique book describes quantum field theory completely within the context of path integrals. With its utility in a variety of fields in physics, the subject matter is primarily developed within the context of quantum mechanics before going into specialized areas.Adding new material keenly requested by readers, this second edition is an important expansion of the popular first edition. Two extra chapters cover path integral quantization of gauge theories and anomalies, and a new section extends the supersymmetry chapter, where singular potentials in supersymmetric systems are described.

  11. Canonical transformations and hamiltonian path integrals

    International Nuclear Information System (INIS)

    Prokhorov, L.V.

    1982-01-01

    Behaviour of the Hamiltonian path integrals under canonical transformations produced by a generator, is investigated. An exact form is determined for the kernel of the unitary operator realizing the corresponding quantum transformation. Equivalence rules are found (the Hamiltonian formalism, one-dimensional case) enabling one to exclude non-standard terms from the action. It is shown that the Hamiltonian path integral changes its form under cononical transformations: in the transformed expression besides the classical Hamiltonian function there appear some non-classical terms

  12. The Use of Path Integral Ideals: Deriving the Euler Summation Formula for Path Integrals

    International Nuclear Information System (INIS)

    Bogojevic, Aleksandar; Balaz, Antun; Belic, Aleksandar

    2006-01-01

    We present and comment on a new quantity that we have recently introduced: the path integral ideal. The new quantity governs the flow of a discrete quantum theory to its continuum limit. Path integral ideals satisfy a unique integral equation - the distinction between different quantum theories being in the boundary conditions. An asymptotic expansion of this equation has led to the derivation of a generalization of Euler's summation formula for path integrals. The new analytical method has brought about a systematic improvement of the convergence of path integrals. Applied to numerical procedures, the new analytical input has resulted in the speedup of numerical simulations by many orders of magnitude. On the analytical side, the integral equation for ideals may turn out to be a useful setting for extending the obtained results to a wider setting - e.g. to p-adic valued theories and theories on non-commuting space-times

  13. Hamiltonian path integral formalism with higher derivatives

    Energy Technology Data Exchange (ETDEWEB)

    Barcelos-Neto, J.; Natividade, C.P. (Rio de Janeiro Univ. (Brazil). Inst. de Fisica)

    1991-07-01

    We study the Hamiltonian path integral formalism for systems containing higher derivatives. First we show the consistency of the formalism in applications involving only scalar fields. Later we use the Maxwell electromagnetic theory with a higher order regularization term to show that the Batalin-Fradkin-Vilkovisky (BFV) theory can also be consistently described. (orig.).

  14. Path integral methods for stochastic differential equations.

    Science.gov (United States)

    Chow, Carson C; Buice, Michael A

    2015-01-01

    Stochastic differential equations (SDEs) have multiple applications in mathematical neuroscience and are notoriously difficult. Here, we give a self-contained pedagogical review of perturbative field theoretic and path integral methods to calculate moments of the probability density function of SDEs. The methods can be extended to high dimensional systems such as networks of coupled neurons and even deterministic systems with quenched disorder.

  15. Path Integrals and Anomalies in Curved Space

    Energy Technology Data Exchange (ETDEWEB)

    Louko, Jorma [University of Nottingham (United Kingdom)

    2007-04-07

    Bastianelli and van Nieuwenhuizen's monograph 'Path Integrals and Anomalies in Curved Space' collects in one volume the results of the authors' 15-year research programme on anomalies that arise in Feynman diagrams of quantum field theories on curved manifolds. The programme was spurred by the path-integral techniques introduced in Alvarez-Gaume and Witten's renowned 1983 paper on gravitational anomalies which, together with the anomaly cancellation paper by Green and Schwarz, led to the string theory explosion of the 1980s. The authors have produced a tour de force, giving a comprehensive and pedagogical exposition of material that is central to current research. The first part of the book develops from scratch a formalism for defining and evaluating quantum mechanical path integrals in nonlinear sigma models, using time slicing regularization, mode regularization and dimensional regularization. The second part applies this formalism to quantum fields of spin 0, 1/2, 1 and 3/2 and to self-dual antisymmetric tensor fields. The book concludes with a discussion of gravitational anomalies in 10-dimensional supergravities, for both classical and exceptional gauge groups. The target audience is researchers and graduate students in curved spacetime quantum field theory and string theory, and the aims, style and pedagogical level have been chosen with this audience in mind. Path integrals are treated as calculational tools, and the notation and terminology are throughout tailored to calculational convenience, rather than to mathematical rigour. The style is closer to that of an exceedingly thorough and self-contained review article than to that of a textbook. As the authors mention, the first part of the book can be used as an introduction to path integrals in quantum mechanics, although in a classroom setting perhaps more likely as supplementary reading than a primary class text. Readers outside the core audience, including this reviewer, will

  16. Classical and quantum dynamics from classical paths to path integrals

    CERN Document Server

    Dittrich, Walter

    2017-01-01

    Graduate students who wish to become familiar with advanced computational strategies in classical and quantum dynamics will find in this book both the fundamentals of a standard course and a detailed treatment of the time-dependent oscillator, Chern-Simons mechanics, the Maslov anomaly and the Berry phase, to name just a few topics. Well-chosen and detailed examples illustrate perturbation theory, canonical transformations and the action principle, and demonstrate the usage of path integrals. The fifth edition has been revised and enlarged to include chapters on quantum electrodynamics, in particular, Schwinger’s proper time method and the treatment of classical and quantum mechanics with Lie brackets and pseudocanonical transformations. It is shown that operator quantum electrodynamics can be equivalently described with c-numbers, as demonstrated by calculating the propagation function for an electron in a prescribed classical electromagnetic field.

  17. Path Integrals and Anomalies in Curved Space

    International Nuclear Information System (INIS)

    Louko, Jorma

    2007-01-01

    Bastianelli and van Nieuwenhuizen's monograph 'Path Integrals and Anomalies in Curved Space' collects in one volume the results of the authors' 15-year research programme on anomalies that arise in Feynman diagrams of quantum field theories on curved manifolds. The programme was spurred by the path-integral techniques introduced in Alvarez-Gaume and Witten's renowned 1983 paper on gravitational anomalies which, together with the anomaly cancellation paper by Green and Schwarz, led to the string theory explosion of the 1980s. The authors have produced a tour de force, giving a comprehensive and pedagogical exposition of material that is central to current research. The first part of the book develops from scratch a formalism for defining and evaluating quantum mechanical path integrals in nonlinear sigma models, using time slicing regularization, mode regularization and dimensional regularization. The second part applies this formalism to quantum fields of spin 0, 1/2, 1 and 3/2 and to self-dual antisymmetric tensor fields. The book concludes with a discussion of gravitational anomalies in 10-dimensional supergravities, for both classical and exceptional gauge groups. The target audience is researchers and graduate students in curved spacetime quantum field theory and string theory, and the aims, style and pedagogical level have been chosen with this audience in mind. Path integrals are treated as calculational tools, and the notation and terminology are throughout tailored to calculational convenience, rather than to mathematical rigour. The style is closer to that of an exceedingly thorough and self-contained review article than to that of a textbook. As the authors mention, the first part of the book can be used as an introduction to path integrals in quantum mechanics, although in a classroom setting perhaps more likely as supplementary reading than a primary class text. Readers outside the core audience, including this reviewer, will gain from the book a

  18. An alternative path integral for quantum gravity

    Energy Technology Data Exchange (ETDEWEB)

    Krishnan, Chethan; Kumar, K.V. Pavan; Raju, Avinash [Center for High Energy Physics, Indian Institute of Science,Bangalore 560012 (India)

    2016-10-10

    We define a (semi-classical) path integral for gravity with Neumann boundary conditions in D dimensions, and show how to relate this new partition function to the usual picture of Euclidean quantum gravity. We also write down the action in ADM Hamiltonian formulation and use it to reproduce the entropy of black holes and cosmological horizons. A comparison between the (background-subtracted) covariant and Hamiltonian ways of semi-classically evaluating this path integral in flat space reproduces the generalized Smarr formula and the first law. This “Neumann ensemble” perspective on gravitational thermodynamics is parallel to the canonical (Dirichlet) ensemble of Gibbons-Hawking and the microcanonical approach of Brown-York.

  19. Quantum gravitation the Feynman path integral approach

    CERN Document Server

    Hamber, Herbert W

    2009-01-01

    The book covers the theory of Quantum Gravitation from the point of view of Feynman path integrals. These provide a manifestly covariant approach in which fundamental quantum aspects of the theory such as radiative corrections and the renormalization group can be systematically and consistently addressed. The path integral method is suitable for both perturbative as well as non-perturbative studies, and is known to already provide a framework of choice for the theoretical investigation of non-abelian gauge theories, the basis for three of the four known fundamental forces in nature. The book thus provides a coherent outline of the present status of the theory gravity based on Feynman’s formulation, with an emphasis on quantitative results. Topics are organized in such a way that the correspondence to similar methods and results in modern gauge theories becomes apparent. Covariant perturbation theory are developed using the full machinery of Feynman rules, gauge fixing, background methods and ghosts. The ren...

  20. Which coordinate system for modelling path integration?

    OpenAIRE

    Vickerstaff, Robert J.; Cheung, Allen

    2012-01-01

    Path integration is a navigation strategy widely observed in nature where an animal maintains a running estimate of its location during an excursion. Evidence suggests it is both ancient and ubiquitous in nature. Over the past century or so, canonical and neural network models have flourished, based on a wide range of assumptions, justifications and supporting data. Despite the importance of the phenomenon, consensus and unifying principles appear lacking. A fundamental issue is the neural re...

  1. Anomaly extraction from the path integral

    International Nuclear Information System (INIS)

    Christos, G.A.

    1983-01-01

    Fujikawa's recently proposed derivation of the anomaly from the path integral is examined. It is attempted to give a better understanding of his work. In particular, evasions of his result are discussed; for example it is shown how chiral U(1) axial invariance can be maintained by employing a gauge variant regularization prescription. A brief connection with the point-splitting method is also made. (orig.)

  2. Path-integral simulation of solids

    OpenAIRE

    Herrero, Carlos P.; Ramirez, Rafael

    2014-01-01

    The path-integral formulation of the statistical mechanics of quantum many-body systems is described, with the purpose of introducing practicaltechniques for the simulation of solids. Monte Carlo and molecular dynamics methods for distinguishable quantum particles are presented, with particular attention to the isothermal-isobaric ensemble. Applications of these computational techniques to different types of solids are reviewed, including noble-gas solids (helium and heavier elements), group-...

  3. Path integral measure for gravitational interactions

    Directory of Open Access Journals (Sweden)

    Kazuo Fujikawa

    1983-10-01

    Full Text Available It is pointed out that the path-integral variables as well as the local measure for gravitational interactions are uniquely specified if one imposes the anomaly-free condition on the Becchi-Rouet-Stora supersymmetry associated with general coordinate transformations. This prescription is briefly illustrated for the Einstein gravity and supergravity in four space-time dimensions and the relativistic string theory in two dimensions.

  4. Path integral for gauge theories with fermions

    International Nuclear Information System (INIS)

    Fujikawa, K.

    1980-01-01

    The Atiyah-Singer index theorem indicates that a naive unitary transformation of basis vectors for fermions interacting with gauge fields is not allowed in general. On the basis of this observation, it was previously shown that the path-integral measure of a gauge-invariant fermion theory is transformed nontrivially under the chiral transformation, and thus leads to a simple derivation of ''anomalous'' chiral Ward-Takahashi identities. We here clarify some of the technical aspects associated with the discussion. It is shown that the Jacobian factor in the path-integral measure, which corresponds to the Adler-Bell-Jackiw anomaly, is independent of any smooth regularization procedure of large eigenvalues of D in Euclidean theory; this property holds in any even-dimensional space-time and also for the gravitational anomaly. The appearance of the anomaly and its connection with the index theorem are thus related to the fact that the primary importance is attached to the Lorentz-covariant ''energy'' operator D and that D and γ 5 do not commute. The abnormal behavior of the path-integral measure at the zero-frequency sector in the presence of instantons and its connection with spontaneous symmetry breaking is also clarified. We comment on several other problems associated with the anomaly and on the Pauli-Villars regularization method

  5. Path-integral computation of superfluid densities

    International Nuclear Information System (INIS)

    Pollock, E.L.; Ceperley, D.M.

    1987-01-01

    The normal and superfluid densities are defined by the response of a liquid to sample boundary motion. The free-energy change due to uniform boundary motion can be calculated by path-integral methods from the distribution of the winding number of the paths around a periodic cell. This provides a conceptually and computationally simple way of calculating the superfluid density for any Bose system. The linear-response formulation relates the superfluid density to the momentum-density correlation function, which has a short-ranged part related to the normal density and, in the case of a superfluid, a long-ranged part whose strength is proportional to the superfluid density. These facts are discussed in the context of path-integral computations and demonstrated for liquid 4 He along the saturated vapor-pressure curve. Below the experimental superfluid transition temperature the computed superfluid fractions agree with the experimental values to within the statistical uncertainties of a few percent in the computations. The computed transition is broadened by finite-sample-size effects

  6. Path integration on the upper half-plane

    International Nuclear Information System (INIS)

    Kubo, Reijiro.

    1987-06-01

    Feynman's path integral is considered on the Poincare upper half-plane. It is shown that the fundamental solution to the heat equation δf/δt = Δ H f can be expressed in terms of a path integral. A simple relation between the path integral and the Selberg trace formula is discussed briefly. (author)

  7. Path Integral Treatment for the Rabi Oscillations

    International Nuclear Information System (INIS)

    Aouachria, M.

    2009-01-01

    In this paper we studied the movement of two-level atom interacting with a time dependent nonuniform magnetic field using path integral formalism. The propagator is first of all written in the standard form by replacing the spin by two fermionic oscillators via the Schwinger's model; then it is determined exactly thanks to the introduction of a particular rotations in coherent state space which has eliminated the rotation angle of the magnetic field and has simplified the Hamiltonian of the considered system. The exactness of the result is displayed in the evaluation of the Rabi formula.

  8. On the simplified path integral on spheres

    Energy Technology Data Exchange (ETDEWEB)

    Bastianelli, Fiorenzo [Universita di Bologna, Dipartimento di Fisica ed Astronomia, Bologna (Italy); INFN, Sezione di Bologna, Bologna (Italy); Albert-Einstein-Institut, Max-Planck-Institut fuer Gravitationsphysik, Golm (Germany); Corradini, Olindo [Universita degli Studi di Modena e Reggio Emilia, Dipartimento di Scienze Fisiche, Informatiche e Matematiche, Modena (Italy); INFN, Sezione di Bologna, Bologna (Italy); Albert-Einstein-Institut, Max-Planck-Institut fuer Gravitationsphysik, Golm (Germany)

    2017-11-15

    We have recently studied a simplified version of the path integral for a particle on a sphere, and more generally on maximally symmetric spaces, and proved that Riemann normal coordinates allow the use of a quadratic kinetic term in the particle action. The emerging linear sigma model contains a scalar effective potential that reproduces the effects of the curvature. We present here further details of the construction, and extend its perturbative evaluation to orders high enough to read off the type-A trace anomalies of a conformal scalar in dimensions d = 14 and d = 16. (orig.)

  9. Path integral discussion for Smorodinsky-Winternitz potentials. Pt. 1

    International Nuclear Information System (INIS)

    Grosche, C.; Pogosyan, G.S.; Sissakian, A.N.

    1994-02-01

    Path integral formulations for the Smorodinsky-Winternitz potentials in two- and three-dimensional Euclidean space are presented. We mention all coordinate systems which separate the Smorodinsky-Winternitz potentials and state the corresponding path integral formulations. Whereas in many coordinate systems an explicit path integralformulation is not possible, we list in all soluble cases the path integral evaluations explicity in terms of the propagators and the spectral expansions into the wave-functions. (orig.)

  10. Path integral for spin: A new approach

    International Nuclear Information System (INIS)

    Aliev, T.M.; Fainberg, V.Ya.; Pak, N.K.

    1994-01-01

    The path integral representation for the propagator of a Dirac particle in an external electromagnetic field is derived using the functional derivative formalism with the help of Weyl symbol representation for the Grassmann vector part of the variables. The proposed method simplifies the proof of the path integral representation starting from the equation for the Green function significantly and automatically leads to a precise and unambiguous set of boundary conditions for the anticommuting variables and puts strong restrictions on the choice of the gauge conditions. The same problem is reconsidered using the Polyakov and Batalin-Fradkin-Vilkovisky methods together with the Weyl symbol method and it is shown to yield the same PIR. It is shown that in the last case, the non-trivial first class constraints algebra for a Dirac particle plays an important role in the derivation, and this algebra is the limiting case of the superconformal algebra for a Ramond open string when the width goes to zero. That the approach proposed here can be applied to any point-like particle is illustrated in the propagator for the nonrelativistic Pauli spinning particle in an external electromagnetic field. ((orig.))

  11. Quantum gravitation. The Feynman path integral approach

    International Nuclear Information System (INIS)

    Hamber, Herbert W.

    2009-01-01

    The book covers the theory of Quantum Gravitation from the point of view of Feynman path integrals. These provide a manifestly covariant approach in which fundamental quantum aspects of the theory such as radiative corrections and the renormalization group can be systematically and consistently addressed. The path integral method is suitable for both perturbative as well as non-perturbative studies, and is known to already provide a framework of choice for the theoretical investigation of non-abelian gauge theories, the basis for three of the four known fundamental forces in nature. The book thus provides a coherent outline of the present status of the theory gravity based on Feynman's formulation, with an emphasis on quantitative results. Topics are organized in such a way that the correspondence to similar methods and results in modern gauge theories becomes apparent. Covariant perturbation theory are developed using the full machinery of Feynman rules, gauge fixing, background methods and ghosts. The renormalization group for gravity and the existence of non-trivial ultraviolet fixed points are investigated, stressing a close correspondence with well understood statistical field theory models. Later the lattice formulation of gravity is presented as an essential tool towards an understanding of key features of the non-perturbative vacuum. The book ends with a discussion of contemporary issues in quantum cosmology such as scale dependent gravitational constants and quantum effects in the early universe. (orig.)

  12. Path integration: effect of curved path complexity and sensory system on blindfolded walking.

    Science.gov (United States)

    Koutakis, Panagiotis; Mukherjee, Mukul; Vallabhajosula, Srikant; Blanke, Daniel J; Stergiou, Nicholas

    2013-02-01

    Path integration refers to the ability to integrate continuous information of the direction and distance traveled by the system relative to the origin. Previous studies have investigated path integration through blindfolded walking along simple paths such as straight line and triangles. However, limited knowledge exists regarding the role of path complexity in path integration. Moreover, little is known about how information from different sensory input systems (like vision and proprioception) contributes to accurate path integration. The purpose of the current study was to investigate how sensory information and curved path complexity affect path integration. Forty blindfolded participants had to accurately reproduce a curved path and return to the origin. They were divided into four groups that differed in the curved path, circle (simple) or figure-eight (complex), and received either visual (previously seen) or proprioceptive (previously guided) information about the path before they reproduced it. The dependent variables used were average trajectory error, walking speed, and distance traveled. The results indicated that (a) both groups that walked on a circular path and both groups that received visual information produced greater accuracy in reproducing the path. Moreover, the performance of the group that received proprioceptive information and later walked on a figure-eight path was less accurate than their corresponding circular group. The groups that had the visual information also walked faster compared to the group that had proprioceptive information. Results of the current study highlight the roles of different sensory inputs while performing blindfolded walking for path integration. Copyright © 2012 Elsevier B.V. All rights reserved.

  13. Path integrals over phase space, their definition and simple properties

    International Nuclear Information System (INIS)

    Tarski, J.; Technische Univ. Clausthal, Clausthal-Zellerfeld

    1981-10-01

    Path integrals over phase space are defined in two ways. Some properties of these integrals are established. These properties concern the technique of integration and the quantization rule isup(-I)deltasub(q) p. (author)

  14. Polymer quantum mechanics some examples using path integrals

    International Nuclear Information System (INIS)

    Parra, Lorena; Vergara, J. David

    2014-01-01

    In this work we analyze several physical systems in the context of polymer quantum mechanics using path integrals. First we introduce the group averaging method to quantize constrained systems with path integrals and later we use this procedure to compute the effective actions for the polymer non-relativistic particle and the polymer harmonic oscillator. We analyze the measure of the path integral and we describe the semiclassical dynamics of the systems

  15. Path-integral simulation of solids.

    Science.gov (United States)

    Herrero, C P; Ramírez, R

    2014-06-11

    The path-integral formulation of the statistical mechanics of quantum many-body systems is described, with the purpose of introducing practical techniques for the simulation of solids. Monte Carlo and molecular dynamics methods for distinguishable quantum particles are presented, with particular attention to the isothermal-isobaric ensemble. Applications of these computational techniques to different types of solids are reviewed, including noble-gas solids (helium and heavier elements), group-IV materials (diamond and elemental semiconductors), and molecular solids (with emphasis on hydrogen and ice). Structural, vibrational, and thermodynamic properties of these materials are discussed. Applications also include point defects in solids (structure and diffusion), as well as nuclear quantum effects in solid surfaces and adsorbates. Different phenomena are discussed, as solid-to-solid and orientational phase transitions, rates of quantum processes, classical-to-quantum crossover, and various finite-temperature anharmonic effects (thermal expansion, isotopic effects, electron-phonon interactions). Nuclear quantum effects are most remarkable in the presence of light atoms, so that especial emphasis is laid on solids containing hydrogen as a constituent element or as an impurity.

  16. Quantum mechanics on the half-line using path integrals

    International Nuclear Information System (INIS)

    Clark, T.E.; Menikoff, R.; Sharp, D.H.

    1980-01-01

    We study the Feynman path-integral formalism for the constrained problem of a free particle moving on the half-line. It is shown that the effect of the boundary condition at the origin can be incorporated into the path integral by a simple modification of the action. The small-time behavior of the Green's function can be obtained from the stationary-phase evaluation of our expression for the path integral, which in this case includes contributions from both the direct and reflected classical paths

  17. Path integral and quasiclassical asymptotics of the Lie group

    International Nuclear Information System (INIS)

    Karasev, M.V.

    1977-01-01

    Solution of the Cauchy problem for the right-invariant differential operator on the Lie group is represented as a formal path integral. Finite-dimensional approximations of this integral and its quasiclassical asymptotics are written down

  18. Differential neural network configuration during human path integration

    Directory of Open Access Journals (Sweden)

    Aiden EGF Arnold

    2014-04-01

    Full Text Available Path integration is a fundamental skill for navigation in both humans and animals. Despite recent advances in unravelling the neural basis of path integration in animal models, relatively little is known about how path integration operates at a neural level in humans. Previous attempts to characterize the neural mechanisms used by humans to visually path integrate have suggested a central role of the hippocampus in allowing accurate performance, broadly resembling results from animal data. However, in recent years both the central role of the hippocampus and the perspective that animals and humans share similar neural mechanisms for path integration has come into question. The present study uses a data driven analysis to investigate the neural systems engaged during visual path integration in humans, allowing for an unbiased estimate of neural activity across the entire brain. Our results suggest that humans employ common task control, attention and spatial working memory systems across a frontoparietal network during path integration. However, individuals differed in how these systems are configured into functional networks. High performing individuals were found to more broadly express spatial working memory systems in prefrontal cortex, while low performing individuals engaged an allocentric memory system based primarily in the medial occipito-temporal region. These findings suggest that visual path integration in humans over short distances can operate through a spatial working memory system engaging primarily the prefrontal cortex and that the differential configuration of memory systems recruited by task control networks may help explain individual biases in spatial learning strategies.

  19. Path integral solution for some time-dependent potential

    International Nuclear Information System (INIS)

    Storchak, S.N.

    1989-12-01

    The quantum-mechanical problem with a time-dependent potential is solved by the path integral method. The solution is obtained by the application of the previously derived general formula for rheonomic homogeneous point transformation and reparametrization in the path integral. (author). 4 refs

  20. The star exponential and path integrals on compact groups

    Energy Technology Data Exchange (ETDEWEB)

    Cadavid, A.C. (Dept. of Physics and Astronomy, California State Univ., Northridge (United States)); Nakashima, M. (Dept. of Physics, TEP, UCLA, Los Angeles, CA (United States))

    1991-10-01

    Using the star exponential, a path integral is constructed for arbitrary compact Lie groups. This is a globalization of the results of Alcalde, Cadavid, and Nakashima, in which a path integral was constructed for SU(2) in terms of local coordinates. Also the phase factor encountered by Alcalde, Cadavid, and Nakashima is shown to be zero. (orig.).

  1. Homogeneous point canonical transformation in the path integral

    International Nuclear Information System (INIS)

    Storchak, S.N.

    1981-01-01

    For the homogeneous point canonical transformations in the path integral the method not based on discrete approximation is proposed. The way in which one must change the supplementary condition that fixes the self-adjoint extension of the Hamilton operator in the initial path integrals is shown [ru

  2. Space-time transformations in radial path integrals

    International Nuclear Information System (INIS)

    Steiner, F.

    1984-09-01

    Nonlinear space-time transformations in the radial path integral are discussed. A transformation formula is derived, which relates the original path integral to the Green's function of a new quantum system with an effective potential containing an observable quantum correction proportional(h/2π) 2 . As an example the formula is applied to spherical Brownian motion. (orig.)

  3. A Key Event Path Analysis Approach for Integrated Systems

    Directory of Open Access Journals (Sweden)

    Jingjing Liao

    2012-01-01

    Full Text Available By studying the key event paths of probabilistic event structure graphs (PESGs, a key event path analysis approach for integrated system models is proposed. According to translation rules concluded from integrated system architecture descriptions, the corresponding PESGs are constructed from the colored Petri Net (CPN models. Then the definitions of cycle event paths, sequence event paths, and key event paths are given. Whereafter based on the statistic results after the simulation of CPN models, key event paths are found out by the sensitive analysis approach. This approach focuses on the logic structures of CPN models, which is reliable and could be the basis of structured analysis for discrete event systems. An example of radar model is given to characterize the application of this approach, and the results are worthy of trust.

  4. From the superparticle path integral to superfield theory

    Science.gov (United States)

    Grundberg, J.; Lindström, U.; Nordström, H.

    1993-12-01

    We investigate the hitherto unexplored relation between the superparticle path integral and superfield theory. Requiring that the path integral has the global symmetries of the classical action and obeys the natural composition property of path integrals, and also that the discretized action has the correct naive continuum limit, we find a viable discretization of the ( D = 3, N = 2) free superparticle action. The resulting propagator is not the usual superfield one. We extend the discretization to include the coupling to an external gauge supermultiplet and use this to show the equivalence to superfield theory. This is possible since we are able to reformulate the superfield perturbation theory in terms of our new propagator.

  5. Path-integral approach to resonant electron-molecule scattering

    International Nuclear Information System (INIS)

    Winterstetter, M.; Domcke, W.

    1993-01-01

    A path-integral formulation of resonant electron-molecule scattering is developed within the framework of the projection-operator formalism of scattering theory. The formation and decay of resonances is treated in real time as a quantum-mechanical electronic-tunneling process, modified by the coupling of the electronic motion with the nuclear degrees of freedom. It is shown that the electronic continuum can be summed over in the path-integral formulation, resulting formally in the path integral for an effective two-state system with coupling to vibrations. The harmonic-oscillator approximation is adopted for the vibrational motion in the present work. Approximation methods are introduced which render the numerical evaluation of the sum over paths feasible for up to ∼10 3 elementary time slices. The theory is numerically realized for simple but nontrivial models representing the 2 Π g d-wave shape resonance in e - +N 2 collisions and the 2 Σ u + p-wave shape resonance in e - +H 2 collisions, respectively. The accuracy of the path-integral results is assessed by comparison with exact numerical reference data for these models. The essential virtue of the path-integral approach is the fact that the computational effort scales at most linearly with the number of vibrational degrees of freedom. The path-integral method is thus well suited to treat electron collisions with polyatomic molecules and molecular aggregates

  6. Purely geometric path integral for spin-foams

    International Nuclear Information System (INIS)

    Shirazi, Atousa Chaharsough; Engle, Jonathan

    2014-01-01

    Spin-foams are a proposal for defining the dynamics of loop quantum gravity via path integral. In order for a path integral to be at least formally equivalent to the corresponding canonical quantization, at each point in the space of histories it is important that the integrand have not only the correct phase—a topic of recent focus in spin-foams—but also the correct modulus, usually referred to as the measure factor. The correct measure factor descends from the Liouville measure on the reduced phase space, and its calculation is a task of canonical analysis. The covariant formulation of gravity from which spin-foams are derived is the Plebanski–Holst formulation, in which the basic variables are a Lorentz connection and a Lorentz-algebra valued 2-form, called the Plebanski 2-form. However, in the final spin-foam sum, one usually sums over only spins and intertwiners, which label eigenstates of the Plebanski 2-form alone. The spin-foam sum is therefore a discretized version of a Plebanski–Holst path integral in which only the Plebanski 2-form appears, and in which the connection degrees of freedom have been integrated out. We call this a purely geometric Plebanski–Holst path integral. In prior work in which one of the authors was involved, the measure factor for the Plebanski–Holst path integral with both connection and 2-form variables was calculated. Before one discretizes this measure and incorporates it into a spin-foam sum, however, one must integrate out the connection in order to obtain the purely geometric version of the path integral. To calculate this purely geometric path integral is the principal task of the present paper, and it is done in two independent ways. Background independence of the resulting path integral is discussed in the final section, and gauge-fixing is discussed in appendix B. (paper)

  7. Defect vectors and path integrals in fracture mechanics

    International Nuclear Information System (INIS)

    Roche, R.L.

    1979-01-01

    Several criteria have been proposed in Elastic Plastic Fracture Mechanics. One of the most interesting ones is the J 1 criterion where J 1 is a path integral surrounding the crack tip. Other path integrals (or surface integrals in 3D problems) can be used. But all these integrals are introduced on an elastic basis, though they are applied in plasticity. This paper shows that it is possible to introduce these integrals without any reference to the elastic behavior of the material. The method is based on the 'defect vector theory' which is an extension of the energy-momentum tensor theory. (orig.)

  8. An operator expansion technique for path integral analysis

    International Nuclear Information System (INIS)

    Tsvetkov, I.V.

    1995-01-01

    A new method of path integral analysis in the framework of a power series technique is presented. The method is based on the operator expansion of an exponential. A regular procedure to calculate the correction terms is found. (orig.)

  9. Remembered landmarks enhance the precision of path integration

    Directory of Open Access Journals (Sweden)

    Shannon O´Leary

    2005-01-01

    Full Text Available When navigating by path integration, knowledge of one’s position becomes increasingly uncertain as one walks from a known location. This uncertainty decreases if one perceives a known landmark location nearby. We hypothesized that remembering landmarks might serve a similar purpose for path integration as directly perceiving them. If this is true, walking near a remembered landmark location should enhance response consistency in path integration tasks. To test this, we asked participants to view a target and then attempt to walk to it without vision. Some participants saw the target plus a landmark during the preview. Compared with no-landmark trials, response consistency nearly doubled when participants passed near the remembered landmark location. Similar results were obtained when participants could audibly perceive the landmark while walking. A control experiment ruled out perceptual context effects during the preview. We conclude that remembered landmarks can enhance path integration even though they are not directly perceived.

  10. Path Integration Applied to Structural Systems with Uncertain Properties

    DEFF Research Database (Denmark)

    Nielsen, Søren R.K.; Köylüoglu, H. Ugur

    Path integration (cell-to-cell mapping) method is applied to evaluate the joint probability density function (jpdf) of the response of the structural systems, with uncertain properties, subject to white noise excitation. A general methodology to deal with uncertainties is outlined and applied to ...... to the friction controlled slip of a structure on a foundation where the friction coefficient is modelled as a random variable. Exact results derived using the total probability theorem are compared to the ones obtained via path integration....

  11. User's guide to Monte Carlo methods for evaluating path integrals

    Science.gov (United States)

    Westbroek, Marise J. E.; King, Peter R.; Vvedensky, Dimitri D.; Dürr, Stephan

    2018-04-01

    We give an introduction to the calculation of path integrals on a lattice, with the quantum harmonic oscillator as an example. In addition to providing an explicit computational setup and corresponding pseudocode, we pay particular attention to the existence of autocorrelations and the calculation of reliable errors. The over-relaxation technique is presented as a way to counter strong autocorrelations. The simulation methods can be extended to compute observables for path integrals in other settings.

  12. Some instructive examples of Mayer's interference in path integral

    International Nuclear Information System (INIS)

    Fiziev, P.P.

    1984-01-01

    A new technique of path integral evaluation by a discretization procedure is proposed. It is based on the requirement, found previously, to single out the set of classical trajectories over which the summation is performed. The notion of Mayer's interference is introduced and illustrated by a number of simple examples. The choice of the set of paths is shown to induce a corresponding quantization procedure and this line is followed to demonstrate its connection with the symmetries of the problem. The possibility of extracting information on the space of quantum states from path integrals has been reviewed. A class of paths has been found; the summation over these paths within the framework of the suggested approach produces the well known results for the motion in a homogeneous field and for the harmonic oscillator

  13. Path independent integrals in equilibrium electro-chemo-elasticity

    Science.gov (United States)

    Zhang, Min; Qu, Jianmin; Rice, James R.

    2017-10-01

    By using the Noether's first theorem, this paper constructed two types of path-independent integrals in equilibrium electro-chemo-elasticity and proved their uniqueness. These path-independent integrals are the electro-chemo-elastic extensions of the classical J- and L-integrals in elasticity. Similar to their elastic counterparts, the electro-chemo-elastic J- and L-integrals represent energy release when a crack or a cavity undergoes a translation and rotation, respectively. Also shown in this paper is that the M-integral in elasticity cannot be extended to electro-chemo-elasticity. Results of this study established a theoretical foundation for energy conservation laws in equilibrium electro-chemo-elasticity. Such conservation laws are useful in modeling various phenomena in electro-chemo-elastic systems. In addition, the path-independent integrals obtained here provide a theoretical tool for understanding and a practical tool for numerical evaluation of singular fields.

  14. Sensory feedback in a bump attractor model of path integration.

    Science.gov (United States)

    Poll, Daniel B; Nguyen, Khanh; Kilpatrick, Zachary P

    2016-04-01

    Mammalian spatial navigation systems utilize several different sensory information channels. This information is converted into a neural code that represents the animal's current position in space by engaging place cell, grid cell, and head direction cell networks. In particular, sensory landmark (allothetic) cues can be utilized in concert with an animal's knowledge of its own velocity (idiothetic) cues to generate a more accurate representation of position than path integration provides on its own (Battaglia et al. The Journal of Neuroscience 24(19):4541-4550 (2004)). We develop a computational model that merges path integration with feedback from external sensory cues that provide a reliable representation of spatial position along an annular track. Starting with a continuous bump attractor model, we explore the impact of synaptic spatial asymmetry and heterogeneity, which disrupt the position code of the path integration process. We use asymptotic analysis to reduce the bump attractor model to a single scalar equation whose potential represents the impact of asymmetry and heterogeneity. Such imperfections cause errors to build up when the network performs path integration, but these errors can be corrected by an external control signal representing the effects of sensory cues. We demonstrate that there is an optimal strength and decay rate of the control signal when cues appear either periodically or randomly. A similar analysis is performed when errors in path integration arise from dynamic noise fluctuations. Again, there is an optimal strength and decay of discrete control that minimizes the path integration error.

  15. Medial temporal lobe roles in human path integration.

    Directory of Open Access Journals (Sweden)

    Naohide Yamamoto

    Full Text Available Path integration is a process in which observers derive their location by integrating self-motion signals along their locomotion trajectory. Although the medial temporal lobe (MTL is thought to take part in path integration, the scope of its role for path integration remains unclear. To address this issue, we administered a variety of tasks involving path integration and other related processes to a group of neurosurgical patients whose MTL was unilaterally resected as therapy for epilepsy. These patients were unimpaired relative to neurologically intact controls in many tasks that required integration of various kinds of sensory self-motion information. However, the same patients (especially those who had lesions in the right hemisphere walked farther than the controls when attempting to walk without vision to a previewed target. Importantly, this task was unique in our test battery in that it allowed participants to form a mental representation of the target location and anticipate their upcoming walking trajectory before they began moving. Thus, these results put forth a new idea that the role of MTL structures for human path integration may stem from their participation in predicting the consequences of one's locomotor actions. The strengths of this new theoretical viewpoint are discussed.

  16. Rules for integrals over products of distributions from coordinate independence of path integrals

    International Nuclear Information System (INIS)

    Kleinert, H.; Chervyakov, A.

    2001-01-01

    In perturbative calculations of quantum-mechanical path integrals in curvilinear coordinates, one encounters Feynman diagrams involving multiple temporal integrals over products of distributions which are mathematically undefined. In addition, there are terms proportional to powers of Dirac δ-functions at the origin coming from the measure of path integration. We derive simple rules for dealing with such singular terms from the natural requirement of coordinate independence of the path integrals. (orig.)

  17. A New Look At The Path Integral Of Quantum Mechanics

    OpenAIRE

    Witten, Edward

    2010-01-01

    The Feynman path integral of ordinary quantum mechanics is complexified and it is shown that possible integration cycles for this complexified integral are associated with branes in a two-dimensional A-model. This provides a fairly direct explanation of the relationship of the A-model to quantum mechanics; such a relationship has been explored from several points of view in the last few years. These phenomena have an analog for Chern-Simons gauge theory in three dimensions: integration cycles...

  18. Lecture notes in topics in path integrals and string representations

    CERN Document Server

    Botelho, Luiz C L

    2017-01-01

    Functional Integrals is a well-established method in mathematical physics, especially those mathematical methods used in modern non-perturbative quantum field theory and string theory. This book presents a unique, original and modern treatment of strings representations on Bosonic Quantum Chromodynamics and Bosonization theory on 2d Gauge Field Models, besides of rigorous mathematical studies on the analytical regularization scheme on Euclidean quantum field path integrals and stochastic quantum field theory. It follows an analytic approach based on Loop space techniques, functional determinant exact evaluations and exactly solubility of four dimensional QCD loop wave equations through Elfin Botelho fermionic extrinsic self avoiding string path integrals.

  19. Path integration and the neural basis of the 'cognitive map'.

    NARCIS (Netherlands)

    McNaughton, B.L.; Battaglia, F.P.; Jensen, O.; Moser, E.I.; Moser, M.B

    2006-01-01

    The hippocampal formation can encode relative spatial location, without reference to external cues, by the integration of linear and angular self-motion (path integration). Theoretical studies, in conjunction with recent empirical discoveries, suggest that the medial entorhinal cortex (MEC) might

  20. Some illustrative examples of Mayer's interference in the path integral

    International Nuclear Information System (INIS)

    Fizichev, P.P.

    1983-01-01

    A new technique is proposed for evaluation of path integrals by means of a discretization procedure. It is based on the previously established necessity to single out the set of classical trajectories along which the summation is performed. The notion of Mayer interference is introduced and is illustrated on a number of simple examples. It is shown that the choice of the set of paths induced a corresponding quantization prosymmetries of the problem. The possibility is shown of extracting information about the space of quantum states from the path integral. A class of paths is established the summation over which in the framework of the suggested approach leads to the well-known results for the motion is a homogeneous field and for the harmonic oscillator

  1. PathSys: integrating molecular interaction graphs for systems biology

    Directory of Open Access Journals (Sweden)

    Raval Alpan

    2006-02-01

    Full Text Available Abstract Background The goal of information integration in systems biology is to combine information from a number of databases and data sets, which are obtained from both high and low throughput experiments, under one data management scheme such that the cumulative information provides greater biological insight than is possible with individual information sources considered separately. Results Here we present PathSys, a graph-based system for creating a combined database of networks of interaction for generating integrated view of biological mechanisms. We used PathSys to integrate over 14 curated and publicly contributed data sources for the budding yeast (S. cerevisiae and Gene Ontology. A number of exploratory questions were formulated as a combination of relational and graph-based queries to the integrated database. Thus, PathSys is a general-purpose, scalable, graph-data warehouse of biological information, complete with a graph manipulation and a query language, a storage mechanism and a generic data-importing mechanism through schema-mapping. Conclusion Results from several test studies demonstrate the effectiveness of the approach in retrieving biologically interesting relations between genes and proteins, the networks connecting them, and of the utility of PathSys as a scalable graph-based warehouse for interaction-network integration and a hypothesis generator system. The PathSys's client software, named BiologicalNetworks, developed for navigation and analyses of molecular networks, is available as a Java Web Start application at http://brak.sdsc.edu/pub/BiologicalNetworks.

  2. Semi-classical approximation to path integrals - phases and catastrophes

    International Nuclear Information System (INIS)

    Levit, S.

    1977-01-01

    Problems of phases and catastrophes were encountered when trying to apply the classical S-matrix theory to the scattering phenomena in nuclear physics. The path integral formulation provided a suitable basis for the treatment of these and related problems. Within conventional mathematical language it was possible to give practical prescriptions and discuss their limitations. Since the semi-classical (stationary phase) approximation is commonly used in any application of the path integral method, the results are not restricted to the scattering problems and may be of general interest. The derivation of the uniform approximations in the energy representation should use the exact path integral expression as the starting point, rather than performing Fourier transforms on the expressions derived in the present lecture. (B.G.)

  3. Master equations and the theory of stochastic path integrals

    Science.gov (United States)

    Weber, Markus F.; Frey, Erwin

    2017-04-01

    This review provides a pedagogic and self-contained introduction to master equations and to their representation by path integrals. Since the 1930s, master equations have served as a fundamental tool to understand the role of fluctuations in complex biological, chemical, and physical systems. Despite their simple appearance, analyses of master equations most often rely on low-noise approximations such as the Kramers-Moyal or the system size expansion, or require ad-hoc closure schemes for the derivation of low-order moment equations. We focus on numerical and analytical methods going beyond the low-noise limit and provide a unified framework for the study of master equations. After deriving the forward and backward master equations from the Chapman-Kolmogorov equation, we show how the two master equations can be cast into either of four linear partial differential equations (PDEs). Three of these PDEs are discussed in detail. The first PDE governs the time evolution of a generalized probability generating function whose basis depends on the stochastic process under consideration. Spectral methods, WKB approximations, and a variational approach have been proposed for the analysis of the PDE. The second PDE is novel and is obeyed by a distribution that is marginalized over an initial state. It proves useful for the computation of mean extinction times. The third PDE describes the time evolution of a ‘generating functional’, which generalizes the so-called Poisson representation. Subsequently, the solutions of the PDEs are expressed in terms of two path integrals: a ‘forward’ and a ‘backward’ path integral. Combined with inverse transformations, one obtains two distinct path integral representations of the conditional probability distribution solving the master equations. We exemplify both path integrals in analysing elementary chemical reactions. Moreover, we show how a well-known path integral representation of averaged observables can be recovered from

  4. Master equations and the theory of stochastic path integrals.

    Science.gov (United States)

    Weber, Markus F; Frey, Erwin

    2017-04-01

    This review provides a pedagogic and self-contained introduction to master equations and to their representation by path integrals. Since the 1930s, master equations have served as a fundamental tool to understand the role of fluctuations in complex biological, chemical, and physical systems. Despite their simple appearance, analyses of master equations most often rely on low-noise approximations such as the Kramers-Moyal or the system size expansion, or require ad-hoc closure schemes for the derivation of low-order moment equations. We focus on numerical and analytical methods going beyond the low-noise limit and provide a unified framework for the study of master equations. After deriving the forward and backward master equations from the Chapman-Kolmogorov equation, we show how the two master equations can be cast into either of four linear partial differential equations (PDEs). Three of these PDEs are discussed in detail. The first PDE governs the time evolution of a generalized probability generating function whose basis depends on the stochastic process under consideration. Spectral methods, WKB approximations, and a variational approach have been proposed for the analysis of the PDE. The second PDE is novel and is obeyed by a distribution that is marginalized over an initial state. It proves useful for the computation of mean extinction times. The third PDE describes the time evolution of a 'generating functional', which generalizes the so-called Poisson representation. Subsequently, the solutions of the PDEs are expressed in terms of two path integrals: a 'forward' and a 'backward' path integral. Combined with inverse transformations, one obtains two distinct path integral representations of the conditional probability distribution solving the master equations. We exemplify both path integrals in analysing elementary chemical reactions. Moreover, we show how a well-known path integral representation of averaged observables can be recovered from them. Upon

  5. Recent developments in the path integral approach to anomalies

    International Nuclear Information System (INIS)

    Fujikawa, Kazuo.

    1986-08-01

    After a brief summary of the path integral approach to anomalous identities, some of the recent developments in this approach are discussed. The topics discussed include (i) Construction of the effective action by means of the covariant current, (ii) Gauss law constraint in anomalous gauge theories, (iii) Path integral approach to anomalies in superconformal transformations, (iv) Conformal and ghost number anomalies in string theory in analogy with the instanton calculation, (v) Covariant local Lorentz anomaly and its connection with the mathematical construction of the consistent anomaly. (author)

  6. Entropic sampling in the path integral Monte Carlo method

    International Nuclear Information System (INIS)

    Vorontsov-Velyaminov, P N; Lyubartsev, A P

    2003-01-01

    We have extended the entropic sampling Monte Carlo method to the case of path integral representation of a quantum system. A two-dimensional density of states is introduced into path integral form of the quantum canonical partition function. Entropic sampling technique within the algorithm suggested recently by Wang and Landau (Wang F and Landau D P 2001 Phys. Rev. Lett. 86 2050) is then applied to calculate the corresponding entropy distribution. A three-dimensional quantum oscillator is considered as an example. Canonical distributions for a wide range of temperatures are obtained in a single simulation run, and exact data for the energy are reproduced

  7. Age differences in virtual environment and real world path integration

    Directory of Open Access Journals (Sweden)

    Diane E Adamo

    2012-09-01

    Full Text Available Accurate path integration requires the integration of visual, proprioceptive, and vestibular self-motion cues and age effects associated with alterations in processing information from these systems may contribute to declines in path integration abilities. The present study investigated age-related differences in path integration in conditions that varied as a function of available sources of sensory information. Twenty-two healthy, young (23.8 ± 3.0 yrs. and 16 older (70.1 ± 6.4 yrs. adults participated in distance reproduction and triangle completion tasks performed in a virtual environment and two real world conditions: guided walking and wheelchair propulsion. For walking and wheelchair propulsion conditions, participants wore a blindfold and wore noise-blocking headphones and were guided through the workspace by the experimenter. For the virtual environment (VE condition, participants viewed self-motion information on a computer monitor and used a joystick to navigate through the environment. For triangle completion tasks, older compared to younger individuals showed greater errors in rotation estimations performed in the wheelchair condition; and for rotation and distance estimations in the VE condition. Distance reproduction tasks, in contrast, did not show any age effects. These findings demonstrate that age differences in path integration vary as a function of the available sources of information and by the complexity of outbound pathway.

  8. An analysis of 3D particle path integration algorithms

    International Nuclear Information System (INIS)

    Darmofal, D.L.; Haimes, R.

    1996-01-01

    Several techniques for the numerical integration of particle paths in steady and unsteady vector (velocity) fields are analyzed. Most of the analysis applies to unsteady vector fields, however, some results apply to steady vector field integration. Multistep, multistage, and some hybrid schemes are considered. It is shown that due to initialization errors, many unsteady particle path integration schemes are limited to third-order accuracy in time. Multistage schemes require at least three times more internal data storage than multistep schemes of equal order. However, for timesteps within the stability bounds, multistage schemes are generally more accurate. A linearized analysis shows that the stability of these integration algorithms are determined by the eigenvalues of the local velocity tensor. Thus, the accuracy and stability of the methods are interpreted with concepts typically used in critical point theory. This paper shows how integration schemes can lead to erroneous classification of critical points when the timestep is finite and fixed. For steady velocity fields, we demonstrate that timesteps outside of the relative stability region can lead to similar integration errors. From this analysis, guidelines for accurate timestep sizing are suggested for both steady and unsteady flows. In particular, using simulation data for the unsteady flow around a tapered cylinder, we show that accurate particle path integration requires timesteps which are at most on the order of the physical timescale of the flow

  9. Path-integral measure for topological field theories

    International Nuclear Information System (INIS)

    Cugliandolo, L.F.; Lozano, G.; Schaposnik, F.A.

    1990-01-01

    We discuss how the dependence of the path-integral measure on the metric affects the properties of topological quantum field theories. We show that the choice of an invariant measure (under general coordinate transformations) preserves the topological character of these theories. We also discuss how topological invariants should be computed within this approach. (orig.)

  10. General form of effective Lagrangian in path integral quantization formalism

    CERN Document Server

    Tu Tung Sheng; Yuan Tu Nan

    1980-01-01

    The general form of the effective lagrangian in path integral formalism is obtained. The effective lagrangian includes the classical lagrangian, the term proportional to delta (0) given by Lee and Yang (see Phys. Rev., vol.128, p.885, 1962) and the additional term which is presented explicitly in the series expansion. The formalism is explicitly covariant. (6 refs).

  11. Chiral symmetry in the path-integral approach

    International Nuclear Information System (INIS)

    Schaposnik, F.A.

    1987-01-01

    The derivation of anomalous Ward-Takahashi identities related to chiral symmetries in the path-integral framework is presented. Some two-dimensional models in both abelian and non-abelian cases are discussed. The quantization of such theories using Weyl fermions is also presented. (L.C.) [pt

  12. Worldline path integrals for fermions with general couplings

    International Nuclear Information System (INIS)

    D'Hoker, E.; Gagne, D.G.

    1996-01-01

    We derive a worldline path integral representation for the effective action of a multiplet of Dirac fermions coupled to the most general set of matrix-valued scalar, pseudoscalar, vector, axial vector and antisymmetric tensor background fields. By representing internal degrees of freedom in terms of worldline fermions as well, we obtain a formulation which manifestly exhibits chiral gauge invariance. (orig.)

  13. Feynman path integral related to stochastic schroedinger equation

    International Nuclear Information System (INIS)

    Belavkin, V.P.; Smolyanov, O.G.

    1998-01-01

    The derivation of the Schroedinger equation describing the continuous measurement process is presented. The representation of the solution of the stochastic Schroedinger equation for continuous measurements is obtained by means of the Feynman path integral. The connection with the heuristic approach to the description of continuous measurements is considered. The connection with the Senon paradox is established [ru

  14. Numerical calculation of path integrals : The small-polaron model

    NARCIS (Netherlands)

    Raedt, Hans De; Lagendijk, Ad

    1983-01-01

    The thermodynamic properties of the small-polaron model are studied by means of a discrete version of the Feynman path-integral representation of the partition function. This lattice model describes a fermion interacting with a boson field. The bosons are treated analytically, the fermion

  15. Path integral Monte Carlo and the electron gas

    Science.gov (United States)

    Brown, Ethan W.

    Path integral Monte Carlo is a proven method for accurately simulating quantum mechanical systems at finite-temperature. By stochastically sampling Feynman's path integral representation of the quantum many-body density matrix, path integral Monte Carlo includes non-perturbative effects like thermal fluctuations and particle correlations in a natural way. Over the past 30 years, path integral Monte Carlo has been successfully employed to study the low density electron gas, high-pressure hydrogen, and superfluid helium. For systems where the role of Fermi statistics is important, however, traditional path integral Monte Carlo simulations have an exponentially decreasing efficiency with decreased temperature and increased system size. In this thesis, we work towards improving this efficiency, both through approximate and exact methods, as specifically applied to the homogeneous electron gas. We begin with a brief overview of the current state of atomic simulations at finite-temperature before we delve into a pedagogical review of the path integral Monte Carlo method. We then spend some time discussing the one major issue preventing exact simulation of Fermi systems, the sign problem. Afterwards, we introduce a way to circumvent the sign problem in PIMC simulations through a fixed-node constraint. We then apply this method to the homogeneous electron gas at a large swatch of densities and temperatures in order to map out the warm-dense matter regime. The electron gas can be a representative model for a host of real systems, from simple medals to stellar interiors. However, its most common use is as input into density functional theory. To this end, we aim to build an accurate representation of the electron gas from the ground state to the classical limit and examine its use in finite-temperature density functional formulations. The latter half of this thesis focuses on possible routes beyond the fixed-node approximation. As a first step, we utilize the variational

  16. Beam spread functions calculated using Feynman path integrals

    Science.gov (United States)

    Kilgo, Paul; Tessendorf, Jerry

    2017-07-01

    A method of solving the radiative transfer equation using Feynman path integrals (FPIs) is discussed. The FPI approach is a mathematical framework for computing multiple scattering in participating media. Its numerical behavior is not well known, and techniques are being developed to solve the FPI approach numerically. A missing numerical technique is detailed and used to calculate beam spread functions (BSFs), a commonly studied experimental property of many types of media. The calculations are compared against measured BSFs of sea ice. Analysis shows differently-shaped BSFs, and suggests the width parameter of the calculated BSF's Gaussian fit approaches a value in the limit of the number of path segments. A projection is attempted, but suggests a larger number of path segments would not increase the width of the calculated BSF. The trial suggests the approach is numerically stable, but requires further testing to ensure scientific accuracy.

  17. Molecular dynamics algorithms for path integrals at constant pressure

    Science.gov (United States)

    Martyna, Glenn J.; Hughes, Adam; Tuckerman, Mark E.

    1999-02-01

    Extended system path integral molecular dynamics algorithms have been developed that can generate efficiently averages in the quantum mechanical canonical ensemble [M. E. Tuckerman, B. J. Berne, G. J. Martyna, and M. L. Klein, J. Chem. Phys. 99, 2796 (1993)]. Here, the corresponding extended system path integral molecular dynamics algorithms appropriate to the quantum mechanical isothermal-isobaric ensembles with isotropic-only and full system cell fluctuations are presented. The former ensemble is employed to study fluid systems which do not support shear modes while the latter is employed to study solid systems. The algorithms are constructed by deriving appropriate dynamical equations of motions and developing reversible multiple time step algorithms to integrate the equations numerically. Effective parallelization schemes for distributed memory computers are presented. The new numerical methods are tested on model (a particle in a periodic potential) and realistic (liquid and solid para-hydrogen and liquid butane) systems. In addition, the methodology is extended to treat the path integral centroid dynamics scheme, [J. Cao and G. A. Voth, J. Chem. Phys. 99, 10070 (1993)], a novel method which is capable of generating semiclassical approximations to quantum mechanical time correlation functions.

  18. Rigorous time slicing approach to Feynman path integrals

    CERN Document Server

    Fujiwara, Daisuke

    2017-01-01

    This book proves that Feynman's original definition of the path integral actually converges to the fundamental solution of the Schrödinger equation at least in the short term if the potential is differentiable sufficiently many times and its derivatives of order equal to or higher than two are bounded. The semi-classical asymptotic formula up to the second term of the fundamental solution is also proved by a method different from that of Birkhoff. A bound of the remainder term is also proved. The Feynman path integral is a method of quantization using the Lagrangian function, whereas Schrödinger's quantization uses the Hamiltonian function. These two methods are believed to be equivalent. But equivalence is not fully proved mathematically, because, compared with Schrödinger's method, there is still much to be done concerning rigorous mathematical treatment of Feynman's method. Feynman himself defined a path integral as the limit of a sequence of integrals over finite-dimensional spaces which is obtained by...

  19. Path integral Liouville dynamics for thermal equilibrium systems.

    Science.gov (United States)

    Liu, Jian

    2014-06-14

    We show a new imaginary time path integral based method--path integral Liouville dynamics (PILD), which can be derived from the equilibrium Liouville dynamics [J. Liu and W. H. Miller, J. Chem. Phys. 134, 104101 (2011)] in the Wigner phase space. Numerical tests of PILD with the simple (white noise) Langevin thermostat have been made for two strongly anharmonic model problems. Since implementation of PILD does not request any specific form of the potential energy surface, the results suggest that PILD offers a potentially useful approach for general condensed phase molecular systems to have the two important properties: conserves the quantum canonical distribution and recovers exact thermal correlation functions (of even nonlinear operators, i.e., nonlinear functions of position or momentum operators) in the classical, high temperature, and harmonic limits.

  20. New N=4 supersymmetric Yang-Mills path integral

    Science.gov (United States)

    Fu, Chih-Hao; Kallosh, Renata

    2010-12-01

    Using Lorentz-covariant spinor helicity formalism, we reorganize the unitary scalar superfield light-cone path integral for the N=4 supersymmetric Yang-Mills theory. In new variables in the chiral Fourier superspace, the quadratic and cubic parts of the classical action have manifest Lorentz, kinematical and dynamical supersymmetry, with the exception of terms which contribute only to the contact terms in the supergraphs with propagators shrinking to a point. These terms have the same structure as supergraphs with quartic light-cone vertices, which break dynamical supersymmetry. We present evidence that all complicated terms breaking dynamical supersymmetry have to cancel and therefore can be omitted. It is plausible that the new form of the path integral leads to a set of relatively simple unitarity based rules with manifest N=4 supersymmetry.

  1. Path integral for the relativistic particle in curved space

    International Nuclear Information System (INIS)

    Ferraro, R.

    1992-01-01

    The propagator for a single relativistic particle in a (D+1)-dimensional curved background is obtained by evaluating the canonical path integral in the true 2D-dimensional phase space. Since only paths moving forward in time are integrated, the resulting propagator depends on how the time is chosen; i.e., it depends on the reference system. In order for the propagator to satisfy the properties of a unitary theory, the time must be attached to a Killing vector. Although the measure is unique (it is the Liouville measure), the skeletonization of the phase-space functional action is ambiguous. One such ambiguity is exploited to obtain different propagators obeying the Klein-Gordon equation with different couplings to quantities related to the shape of the reference system (spatial curvature, etc.)

  2. Mathematical theory of Feynman path integrals an introduction

    CERN Document Server

    Albeverio, Sergio A; Mazzucchi, Sonia

    2008-01-01

    Feynman path integrals, suggested heuristically by Feynman in the 40s, have become the basis of much of contemporary physics, from non-relativistic quantum mechanics to quantum fields, including gauge fields, gravitation, cosmology. Recently ideas based on Feynman path integrals have also played an important role in areas of mathematics like low-dimensional topology and differential geometry, algebraic geometry, infinite-dimensional analysis and geometry, and number theory. The 2nd edition of LNM 523 is based on the two first authors' mathematical approach of this theory presented in its 1st edition in 1976. To take care of the many developments since then, an entire new chapter on the current forefront of research has been added. Except for this new chapter and the correction of a few misprints, the basic material and presentation of the first edition has been maintained. At the end of each chapter the reader will also find notes with further bibliographical information.

  3. Integration of Hierarchical Goal Network Planning and Autonomous Path Planning

    Science.gov (United States)

    2016-03-01

    4302. Respondents should be aware that notwithstanding any other provision of law , no person shall be subject to any penalty for failing to comply...world robotic systems. This report documents work to integrate a hierarchical goal network planning algorithm with low-level path planning. The system...goals state. The domain is a robot operating in a known office environment with labeled rooms and doors that can be manipulated. The report goes on to

  4. Phase-space path integration of the relativistic particle equations

    International Nuclear Information System (INIS)

    Guer, H.

    1991-01-01

    Hamilton-Jacobi theory is applied to find appropriate canonical transformations for the calculation of the phase-space path integrals of the relativistic particle equations. Hence, canonical transformations and Hamilton-Jacobi theory are also introduced into relativistic quantum mechanics. Moreover, from the classical physics viewpoint, it is very interesting to find and to solve the Hamilton-Jacobi equations for the relativistic particle equations

  5. Path integral approach to the quantum fidelity amplitude.

    Science.gov (United States)

    Vaníček, Jiří; Cohen, Doron

    2016-06-13

    The Loschmidt echo is a measure of quantum irreversibility and is determined by the fidelity amplitude of an imperfect time-reversal protocol. Fidelity amplitude plays an important role both in the foundations of quantum mechanics and in its applications, such as time-resolved electronic spectroscopy. We derive an exact path integral formula for the fidelity amplitude and use it to obtain a series of increasingly accurate semiclassical approximations by truncating an exact expansion of the path integral exponent. While the zeroth-order expansion results in a remarkably simple, yet non-trivial approximation for the fidelity amplitude, the first-order expansion yields an alternative derivation of the so-called 'dephasing representation,' circumventing the use of a semiclassical propagator as in the original derivation. We also obtain an approximate expression for fidelity based on the second-order expansion, which resolves several shortcomings of the dephasing representation. The rigorous derivation from the path integral permits the identification of sufficient conditions under which various approximations obtained become exact. © 2016 The Authors.

  6. The path integral method in quantum field theory

    International Nuclear Information System (INIS)

    Burden, C.J.

    1990-01-01

    Richard Feynman is reputed to have once the that in his whole life he had only ever had two really clever ideas. As it has turned out, these two ideas, the path integral formulation of quantum mechanics and the diagrammatic representation of perturbation theory have become the cornerstone of modern quantum field theory and particle physics. The path integral, first hinted at by Dirac in the thirties but developed fully by Feynman in the late 40's provides us with an alternative, though equivalent, description of quantum mechanics to canonical quantization. It was not until the seventies that it found broad application in quantum field theory (QFT), leading of gauge theories. It has also lead to the invention of non-perturbative techniques such as lattice gauge theory and has revealed an intimate connection between QFT and statistical mechanics. This paper, the author develops the basic of QFT form the path integral formalism and introduce the idea of Feynman diagrams for calculating perturbation expansions. I will concentrate mainly on the example of φ 4 theory since it is probably the simplest example of an interacting field theory, though the methods generalize readily to more sophisticated theories

  7. Efficient stochastic thermostatting of path integral molecular dynamics.

    Science.gov (United States)

    Ceriotti, Michele; Parrinello, Michele; Markland, Thomas E; Manolopoulos, David E

    2010-09-28

    The path integral molecular dynamics (PIMD) method provides a convenient way to compute the quantum mechanical structural and thermodynamic properties of condensed phase systems at the expense of introducing an additional set of high frequency normal modes on top of the physical vibrations of the system. Efficiently sampling such a wide range of frequencies provides a considerable thermostatting challenge. Here we introduce a simple stochastic path integral Langevin equation (PILE) thermostat which exploits an analytic knowledge of the free path integral normal mode frequencies. We also apply a recently developed colored noise thermostat based on a generalized Langevin equation (GLE), which automatically achieves a similar, frequency-optimized sampling. The sampling efficiencies of these thermostats are compared with that of the more conventional Nosé-Hoover chain (NHC) thermostat for a number of physically relevant properties of the liquid water and hydrogen-in-palladium systems. In nearly every case, the new PILE thermostat is found to perform just as well as the NHC thermostat while allowing for a computationally more efficient implementation. The GLE thermostat also proves to be very robust delivering a near-optimum sampling efficiency in all of the cases considered. We suspect that these simple stochastic thermostats will therefore find useful application in many future PIMD simulations.

  8. A path integral approach to the Hodgkin-Huxley model

    Science.gov (United States)

    Baravalle, Roman; Rosso, Osvaldo A.; Montani, Fernando

    2017-11-01

    To understand how single neurons process sensory information, it is necessary to develop suitable stochastic models to describe the response variability of the recorded spike trains. Spikes in a given neuron are produced by the synergistic action of sodium and potassium of the voltage-dependent channels that open or close the gates. Hodgkin and Huxley (HH) equations describe the ionic mechanisms underlying the initiation and propagation of action potentials, through a set of nonlinear ordinary differential equations that approximate the electrical characteristics of the excitable cell. Path integral provides an adequate approach to compute quantities such as transition probabilities, and any stochastic system can be expressed in terms of this methodology. We use the technique of path integrals to determine the analytical solution driven by a non-Gaussian colored noise when considering the HH equations as a stochastic system. The different neuronal dynamics are investigated by estimating the path integral solutions driven by a non-Gaussian colored noise q. More specifically we take into account the correlational structures of the complex neuronal signals not just by estimating the transition probability associated to the Gaussian approach of the stochastic HH equations, but instead considering much more subtle processes accounting for the non-Gaussian noise that could be induced by the surrounding neural network and by feedforward correlations. This allows us to investigate the underlying dynamics of the neural system when different scenarios of noise correlations are considered.

  9. Quantum mechanics 1. Path-integral formulation and operator formalism

    International Nuclear Information System (INIS)

    Reinhardt, Hugo

    2012-01-01

    The first volume of this two-volume textbook gives a modern introduction to the quantum theory, which connects Feynman's path-integral formulation with the traditional operator formalism. In easily understandable form starting from the double-slit experiment the characteristic features and foundations of quantum theory are made accessible by means of the functional-integral approach. Just this approach makes a ''derivation'' of the Schroedinger equation from the principle of the interfering alternatives possible. In the following the author developes the traditional operator formulation of quantum mechanics, which is better suited for practical solution of elementary problems. However he then refers to the functional-integral approach, when this contributes to a better understanding. A further advance of this concept: The functional-integral approach facilitates essentially the later access to quantum field theory. The work is in like manner suited for the self-study as for the deepening accompanying of the course.

  10. Polymer density functional approach to efficient evaluation of path integrals

    DEFF Research Database (Denmark)

    Brukhno, Andrey; Vorontsov-Velyaminov, Pavel N.; Bohr, Henrik

    2005-01-01

    A polymer density functional theory (P-DFT) has been extended to the case of quantum statistics within the framework of Feynman path integrals. We start with the exact P-DFT formalism for an ideal open chain and adapt its efficient numerical solution to the case of a ring. We show that, similarly......, the path integral problem can, in principle, be solved exactly by making use of the two-particle pair correlation function (2p-PCF) for the ends of an open polymer, half of the original. This way the exact data for one-dimensional quantum harmonic oscillator are reproduced in a wide range of temperatures....... The exact solution is not, though, reachable in three dimensions (3D) because of a vast amount of storage required for 2p-PCF. In order to treat closed paths in 3D, we introduce a so-called "open ring" approximation which proves to be rather accurate in the limit of long chains. We also employ a simple self...

  11. Path dependence of fracture mechanics integrals on the integration area of characteristic integrals

    International Nuclear Information System (INIS)

    Roche, Roland.

    1975-11-01

    The necessary and sufficient conditions for characteristic integrals of fracture mechanics to be independent of area (or integration path), without making any assumptions concerning the behavior of the material are defined. The principle of the method involves comparing the spatial variation in energy density received with that which would result from a spatial variation in strain alone. This introduces a defect vector at each point of the solid. The resultants of the total defect vectors situated within an area are the characteristic integrals of this area. The condition governing independence in a region requires that the defect vector be null at any point. This condition in set under different forms which actually state that the energy density per unit volume received must have the same form of variation in space as in time [fr

  12. Cooperation Between Dead Reckoning (Path Integration) and External Position Cues

    Science.gov (United States)

    Etienne, Ariane S.; Maurer, Roland; Berlie, Joëlle; Derivaz, Valérie; Georgakopoulos, Joséphine; Griffin, Andrea; Rowe, Tiffany

    Dead reckoning (also called path integration) is the process by which a navigating organism derives its current position relative to an Earthbound reference point from its own locomotion. Dead reckoning requires the continuous estimation of changes in direction and location through self-generated signals and the computation of position on the basis of these signals.(i) Hymenopterous insects measure rotations and translations mainly with the help of optical references such as the Sun and translational visual flow. By contrast, mammals are able to estimate their position on the basis of purely 'internal' information; that is, signals generated in the vestibular system by inertial forces, somatosensory feedback, and efference copies (copies of central commands that control the performance of rotations and translations). Obviously, the assessment of the angular and linear components of locomotion is much more precise if it is assisted by external references than if this is not the case.(ii) Only man-made dead reckoning systems yield precise position information through the twofold integration over time of inertial signals deriving from angular and linear acceleration. On the biological level, all species tested so far seem to rely on a simplified form of path 'integration': in certain test situations, arthropods and mammals (including humans) commit similar systematic errors. This suggests that species from unrelated taxa update position according to a similar algorithm.

  13. Gauge freedom in path integrals in Abelian gauge theory

    OpenAIRE

    Saito, Teijiro; Endo, Ryusuke; Miura, Hikaru

    2016-01-01

    We extend the gauge symmetry of an Abelian gauge field to incorporate quantum gauge degrees of freedom. We twice apply the Harada–Tsutsui gauge recovery procedure to gauge-fixed theories. First, starting from the Faddeev–Popov path integral in the Landau gauge, we recover the gauge symmetry by introducing an additional field as an extended gauge degree of freedom. Fixing the extended gauge symmetry by the usual Faddeev–Popov procedure, we obtain the theory of Type I gaugeon formalism. Next, a...

  14. An improved heat kernel expansion from worldline path integrals

    International Nuclear Information System (INIS)

    Fliegner, D.; Haberl, P.; Schmidt, M.G.; Schubert, C.

    1994-11-01

    The one-loop effective action for the case of a massive scalar loop in the background of both a scalar potential and an abelian or non-abelian gauge field is written in a one-dimensional path integral representation. From this the inverse mass expansion is obtained by Wick contractions using a suitable Green function, which allows the computation of higher order coefficients. For the scalar case, explicit results are presented up to order O(T 8 ) in the proper time expansion. The relation to previous work is clarified. (orig.)

  15. Isotope effects in ice Ih: A path-integral simulation

    OpenAIRE

    Herrero, Carlos P.; Ramirez, Rafael

    2011-01-01

    Ice Ih has been studied by path-integral molecular dynamics simulations, using the effective q-TIP4P/F potential model for flexible water. This has allowed us to analyze finite-temperature quantum effects in this solid phase from 25 to 300 K at ambient pressure. Among these effects we find a negative thermal expansion of ice at low temperatures, which does not appear in classical molecular dynamics simulations. The compressibility derived from volume fluctuations gives results in line with ex...

  16. A path-integral approach to the problem of time

    Science.gov (United States)

    Amaral, M. M.; Bojowald, Martin

    2018-01-01

    Quantum transition amplitudes are formulated for model systems with local internal time, using intuition from path integrals. The amplitudes are shown to be more regular near a turning point of internal time than could be expected based on existing canonical treatments. In particular, a successful transition through a turning point is provided in the model systems, together with a new definition of such a transition in general terms. Some of the results rely on a fruitful relation between the problem of time and general Gribov problems.

  17. Self-gravitating stellar collapse: explicit geodesics and path integration

    Directory of Open Access Journals (Sweden)

    Jayashree Balakrishna

    2016-11-01

    Full Text Available We extend the work of Oppenheimer-Synder to model the gravitational collapse of a star to a black hole by including quantum mechanical effects. We first derive closed-form solutions for classical paths followed by a particle on the surface of the collapsing star in Schwarzschild and Kruskal coordinates for space-like, time-like and light-like geodesics. We next present an application of these paths to model the collapse of ultra-light dark matter particles, which necessitates incorporating quantum effects. To do so we treat a particle on the surface of the star as a wavepacket and integrate over all possible paths taken by the particle. The waveform is computed in Schwarzschild coordinates and found to exhibit an ingoing and an outgoing component, where the former contains the probability of collapse, while the latter contains the probability that the star will disperse. These calculations pave the way for investigating the possibility of quantum collapse that does not lead to black hole formation as well as for exploring the nature of the wavefunction inside r = 2M.

  18. Diffusion in periodic potentials with path integral hyperdynamics.

    Science.gov (United States)

    Ikonen, T; Khandkar, M D; Chen, L Y; Ying, S C; Ala-Nissila, T

    2011-08-01

    We consider the diffusion of brownian particles in one-dimensional periodic potentials as a test bench for the recently proposed stochastic path integral hyperdynamics (PIHD) scheme [Chen and Horing, J. Chem. Phys. 126, 224103 (2007)]. First, we consider the case where PIHD is used to enhance the transition rate of activated rare events. To this end, we study the diffusion of a single brownian particle moving in a spatially periodic potential in the high-friction limit at low temperature. We demonstrate that the boost factor as compared to straight molecular dynamics (MD) has nontrivial behavior as a function of the bias force. Instead of growing monotonically with the bias, the boost attains an optimal maximum value due to increased error in the finite path sampling induced by the bias. We also observe that the PIHD method can be sensitive to the choice of numerical integration algorithm. As the second case, we consider parallel resampling of multiple bias force values in the case of a brownian particle in a periodic potential subject to an external ac driving force. We confirm that there is no stochastic resonance in this system. However, while the PIHD method allows one to obtain data for multiple values of the ac bias, the boost with respect to MD remains modest due to the simplicity of the equation of motion in this case.

  19. Reparametrization in the path integral over finite dimensional manifold with a time-dependent metric

    International Nuclear Information System (INIS)

    Storchak, S.N.

    1988-01-01

    The path reparametrization procedure in the path integral is considered using the methods of stochastic processes for diffusion on finite dimensional manifold with a time-dependent metric. the reparametrization Jacobian has been obtained. The formulas of reparametrization for a symbolic presentation of the path integral have been derived

  20. Defect forces, defect couples and path integrals in fracture mechanics

    International Nuclear Information System (INIS)

    Roche, R.L.

    1979-07-01

    In this work, it is shown that the path integrals can be introduced without any reference to the material behavior. The method is based on the definition in a continuous medium of a set of vectors and couples having the dimension of a force or a moment. More precisely, definitions are given of volume defect forces, surface defect forces, volume defect couples, and surface defect couples. This is done with the help of the stress working variation of a particule moving through the solid. The most important result is: the resultant of all the defect forces included in a volume V is the J integral on the surface surrounding V and the moment resultant is the L integral. So these integrals are defined without any assumption on the material constitutive equation. Another result is the material form of the virtual work principle - defect forces are acting like conventional forces in the conventional principles of virtual work. This lead to the introduction of the energy momentum tensor and of the associated couple stress. Application of this method is made to fracture mechanics in studying the defect forces distribution around a crack [fr

  1. Path integrals for nonadiabatically coupled electrons and nuclei in molecules: Force analysis for branching nuclear paths and conservation laws

    International Nuclear Information System (INIS)

    Hanasaki, Kota; Takatsuka, Kazuo

    2010-01-01

    Real-time dynamics in electron-nucleus coupled systems in molecules is studied using the path-integral formalism, with a special emphasis on nonadiabatic interactions. We first establish a formal path-integral description of the entire system. Applying the stationary phase approximation, we then derive coupled equations for the mixed quantum-classical treatment of the system: the equations of motion for electron wave-packet dynamics and those for nuclear dynamics driven by what we call the force form. Thus the present theory also serves as a general theory for dynamics in mixed quantum and classical systems. On this theoretical foundation, we analyze two theories of nonadiabatic electron-nucleus coupled systems from the viewpoint of path branching: the semiclassical Ehrenfest theory and the recently developed method of phase-space averaging and natural branching [T. Yonehara, S. Takahashi, and K. Takatsuka, J. Chem. Phys. 130, 214113 (2009)]. We give a unified account of the essential feature of their physical implications and limitations. Path-integral formalism leads to further refinement of the idea of path branching caused by nonadiabatic coupling, thus giving deeper insight into the nonadiabatic dynamics. Further, we study the conservation laws for energy, linear momentum, and angular momentum in the general mixed quantum-classical representation. We also extend the present path-integral formulation so as to handle nonadiabatic dynamics in laser fields.

  2. Path integral approach to electron scattering in classical electromagnetic potential

    International Nuclear Information System (INIS)

    Xu Chuang; Feng Feng; Li Ying-Jun

    2016-01-01

    As is known to all, the electron scattering in classical electromagnetic potential is one of the most widespread applications of quantum theory. Nevertheless, many discussions about electron scattering are based upon single-particle Schrodinger equation or Dirac equation in quantum mechanics rather than the method of quantum field theory. In this paper, by using the path integral approach of quantum field theory, we perturbatively evaluate the scattering amplitude up to the second order for the electron scattering by the classical electromagnetic potential. The results we derive are convenient to apply to all sorts of potential forms. Furthermore, by means of the obtained results, we give explicit calculations for the one-dimensional electric potential. (paper)

  3. Ordering, symbols and finite-dimensional approximations of path integrals

    International Nuclear Information System (INIS)

    Kashiwa, Taro; Sakoda, Seiji; Zenkin, S.V.

    1994-01-01

    We derive general form of finite-dimensional approximations of path integrals for both bosonic and fermionic canonical systems in terms of symbols of operators determined by operator ordering. We argue that for a system with a given quantum Hamiltonian such approximations are independent of the type of symbols up to terms of O(ε), where ε of is infinitesimal time interval determining the accuracy of the approximations. A new class of such approximations is found for both c-number and Grassmannian dynamical variables. The actions determined by the approximations are non-local and have no classical continuum limit except the cases of pq- and qp-ordering. As an explicit example the fermionic oscillator is considered in detail. (author)

  4. Topological anomalies from the path integral measure in superspace

    International Nuclear Information System (INIS)

    Fujikawa, Kazuo; Nieuwenhuizen, Peter van

    2003-01-01

    A fully quantum version of the Witten-Olive analysis of the central charge in the N=1 Wess-Zumino model in d=2 with a kink solution is presented by using path integrals in superspace. We regulate the Jacobians with heat kernels in superspace, and obtain all superconformal anomalies as one Jacobian factor. The conserved quantum currents differ from the Noether currents by terms proportional to field equations, and these terms contribute to the anomalies. We identify the particular variation of the superfield which produces the central charge current and its anomaly; it is the variation of the auxiliary field. The quantum supersymmetry algebra which includes the contributions of superconformal anomalies is derived by using the Bjorken-Johnson-Low method instead of semi-classical Dirac brackets. We confirm earlier results that the BPS bound remains saturated at the quantum level due to equal anomalies in the energy and central charge

  5. Stochastic ship roll motion via path integral method

    Directory of Open Access Journals (Sweden)

    G. Cottone

    2010-09-01

    Full Text Available The response of ship roll oscillation under random ice impulsive loads modeled by Poisson arrival process is very important in studying the safety of ships navigation in cold regions. Under both external and parametric random excitations the evolution of the probability density function of roll motion is evaluated using the path integral (PI approach. The PI method relies on the Chapman-Kolmogorov equation, which governs the response transition probability density functions at two close intervals of time. Once the response probability density function at an early close time is specified, its value at later close time can be evaluated. The PI method is first demonstrated via simple dynamical models and then applied for ship roll dynamics under random impulsive white noise excitation.

  6. Stochastic ship roll motion via path integral method

    Science.gov (United States)

    Cottone, G.; Di Paola, M.; Ibrahim, R.; Pirrotta, A.; Santoro, R.

    2010-09-01

    The response of ship roll oscillation under random ice impulsive loads modeled by Poisson arrival process is very important in studying the safety of ships navigation in cold regions. Under both external and parametric random excitations the evolution of the probability density function of roll motion is evaluated using the path integral (PI) approach. The PI method relies on the Chapman-Kolmogorov equation, which governs the response transition probability density functions at two close intervals of time. Once the response probability density function at an early close time is specified, its value at later close time can be evaluated. The PI method is first demonstrated via simple dynamical models and then applied for ship roll dynamics under random impulsive white noise excitation

  7. Complex Nonlinearity Chaos, Phase Transitions, Topology Change and Path Integrals

    CERN Document Server

    Ivancevic, Vladimir G

    2008-01-01

    Complex Nonlinearity: Chaos, Phase Transitions, Topology Change and Path Integrals is a book about prediction & control of general nonlinear and chaotic dynamics of high-dimensional complex systems of various physical and non-physical nature and their underpinning geometro-topological change. The book starts with a textbook-like expose on nonlinear dynamics, attractors and chaos, both temporal and spatio-temporal, including modern techniques of chaos–control. Chapter 2 turns to the edge of chaos, in the form of phase transitions (equilibrium and non-equilibrium, oscillatory, fractal and noise-induced), as well as the related field of synergetics. While the natural stage for linear dynamics comprises of flat, Euclidean geometry (with the corresponding calculation tools from linear algebra and analysis), the natural stage for nonlinear dynamics is curved, Riemannian geometry (with the corresponding tools from nonlinear, tensor algebra and analysis). The extreme nonlinearity – chaos – corresponds to th...

  8. Hippocampal “Time Cells”: Time versus Path Integration

    Science.gov (United States)

    Kraus, Benjamin J.; Robinson, Robert J.; White, John A.; Eichenbaum, Howard; Hasselmo, Michael E.

    2014-01-01

    SUMMARY Recent studies have reported the existence of hippocampal “time cells,” neurons that fire at particular moments during periods when behavior and location are relatively constant. However, an alternative explanation of apparent time coding is that hippocampal neurons “path integrate” to encode the distance an animal has traveled. Here, we examined hippocampal neuronal firing patterns as rats ran in place on a treadmill, thus “clamping” behavior and location, while we varied the treadmill speed to distinguish time elapsed from distance traveled. Hippocampal neurons were strongly influenced by time and distance, and less so by minor variations in location. Furthermore, the activity of different neurons reflected integration over time and distance to varying extents, with most neurons strongly influenced by both factors and some significantly influenced by only time or distance. Thus, hippocampal neuronal networks captured both the organization of time and distance in a situation where these dimensions dominated an ongoing experience. PMID:23707613

  9. Representation of the three-body Coulomb Green's function in parabolic coordinates: paths of integration

    International Nuclear Information System (INIS)

    Zaytsev, S A

    2010-01-01

    The possibility of using straight-line paths of integration in computing the integral representation of the three-body Coulomb Green's function is discussed. In our numerical examples two different kinds of integration contours in the complex energy planes are considered. It is demonstrated that straight-line paths, which cross the positive real axis, are suitable for numerical computation.

  10. Path integral quantization of the Symplectic Leaves of the SU(2)*Poisson-Lie Group

    International Nuclear Information System (INIS)

    Morariu, B.

    1997-01-01

    The Feynman path integral is used to quantize the symplectic leaves of the Poisson-Lie group SU(2)*. In this way we obtain the unitary representations of Uq(su(2)). This is achieved by finding explicit Darboux coordinates and then using a phase space path integral. I discuss the *-structure of SU(2)* and give a detailed description of its leaves using various parameterizations and also compare the results with the path integral quantization of spin

  11. Looping probabilities of elastic chains: a path integral approach.

    Science.gov (United States)

    Cotta-Ramusino, Ludovica; Maddocks, John H

    2010-11-01

    We consider an elastic chain at thermodynamic equilibrium with a heat bath, and derive an approximation to the probability density function, or pdf, governing the relative location and orientation of the two ends of the chain. Our motivation is to exploit continuum mechanics models for the computation of DNA looping probabilities, but here we focus on explaining the novel analytical aspects in the derivation of our approximation formula. Accordingly, and for simplicity, the current presentation is limited to the illustrative case of planar configurations. A path integral formalism is adopted, and, in the standard way, the first approximation to the looping pdf is obtained from a minimal energy configuration satisfying prescribed end conditions. Then we compute an additional factor in the pdf which encompasses the contributions of quadratic fluctuations about the minimum energy configuration along with a simultaneous evaluation of the partition function. The original aspects of our analysis are twofold. First, the quadratic Lagrangian describing the fluctuations has cross-terms that are linear in first derivatives. This, seemingly small, deviation from the structure of standard path integral examples complicates the necessary analysis significantly. Nevertheless, after a nonlinear change of variable of Riccati type, we show that the correction factor to the pdf can still be evaluated in terms of the solution to an initial value problem for the linear system of Jacobi ordinary differential equations associated with the second variation. The second novel aspect of our analysis is that we show that the Hamiltonian form of these linear Jacobi equations still provides the appropriate correction term in the inextensible, unshearable limit that is commonly adopted in polymer physics models of, e.g. DNA. Prior analyses of the inextensible case have had to introduce nonlinear and nonlocal integral constraints to express conditions on the relative displacement of the end

  12. Path integration in place cells of developing rats.

    Science.gov (United States)

    Bjerknes, Tale L; Dagslott, Nenitha C; Moser, Edvard I; Moser, May-Britt

    2018-02-13

    Place cells in the hippocampus and grid cells in the medial entorhinal cortex rely on self-motion information and path integration for spatially confined firing. Place cells can be observed in young rats as soon as they leave their nest at around 2.5 wk of postnatal life. In contrast, the regularly spaced firing of grid cells develops only after weaning, during the fourth week. In the present study, we sought to determine whether place cells are able to integrate self-motion information before maturation of the grid-cell system. Place cells were recorded on a 200-cm linear track while preweaning, postweaning, and adult rats ran on successive trials from a start wall to a box at the end of a linear track. The position of the start wall was altered in the middle of the trial sequence. When recordings were made in complete darkness, place cells maintained fields at a fixed distance from the start wall regardless of the age of the animal. When lights were on, place fields were determined primarily by external landmarks, except at the very beginning of the track. This shift was observed in both young and adult animals. The results suggest that preweaning rats are able to calculate distances based on information from self-motion before the grid-cell system has matured to its full extent. Copyright © 2018 the Author(s). Published by PNAS.

  13. Diagrammatical methods within the path integral representation for quantum systems

    International Nuclear Information System (INIS)

    Alastuey, A

    2014-01-01

    The path integral representation has been successfully applied to the study of equilibrium properties of quantum systems for a long time. In particular, such a representation allowed Ginibre to prove the convergence of the low-fugacity expansions for systems with short-range interactions. First, I will show that the crucial trick underlying Ginibre's proof is the introduction of an equivalent classical system made with loops. Within the Feynman-Kac formula for the density matrix, such loops naturally emerge by collecting together the paths followed by particles exchanged in a given cyclic permutation. Two loops interact via an average of two- body genuine interactions between particles belonging to different loops, while the interactions between particles inside a given loop are accounted for in a loop fugacity. It turns out that the grand-partition function of the genuine quantum system exactly reduces to its classical counterpart for the gas of loops. The corresponding so-called magic formula can be combined with standard Mayer diagrammatics for the classical gas of loops. This provides low-density representations for the quantum correlations or thermodynamical functions, which are quite useful when collective effects must be taken into account properly. Indeed, resummations and or reorganizations of Mayer graphs can be performed by exploiting their remarkable topological and combinatorial properties, while statistical weights and bonds are purely c-numbers. The interest of that method will be illustrated through a brief description of its application to two long-standing problems, namely recombination in Coulomb systems and condensation in the interacting Bose gas.

  14. Isotope effects in ice Ih: A path-integral simulation

    Science.gov (United States)

    Herrero, Carlos P.; Ramírez, Rafael

    2011-03-01

    Ice Ih has been studied by path-integral molecular dynamics simulations, using the effective q-TIP4P/F potential model for flexible water. This has allowed us to analyze finite-temperature quantum effects in this solid phase from 25 to 300 K at ambient pressure. Among these effects we find a negative thermal expansion of ice at low temperatures, which does not appear in classical molecular dynamics simulations. The compressibility derived from volume fluctuations gives results in line with experimental data. We have analyzed isotope effects in ice Ih by considering normal, heavy, and tritiated water. In particular, we studied the effect of changing the isotopic mass of hydrogen on the kinetic energy and atomic delocalization in the crystal as well as on structural properties such as interatomic distances and molar volume. For D2O ice Ih at 100 K we obtained a decrease in molar volume and intramolecular O-H distance of 0.6% and 0.4%, respectively, as compared to H2O ice.

  15. Isotope effects in ice Ih: a path-integral simulation.

    Science.gov (United States)

    Herrero, Carlos P; Ramírez, Rafael

    2011-03-07

    Ice Ih has been studied by path-integral molecular dynamics simulations, using the effective q-TIP4P/F potential model for flexible water. This has allowed us to analyze finite-temperature quantum effects in this solid phase from 25 to 300 K at ambient pressure. Among these effects we find a negative thermal expansion of ice at low temperatures, which does not appear in classical molecular dynamics simulations. The compressibility derived from volume fluctuations gives results in line with experimental data. We have analyzed isotope effects in ice Ih by considering normal, heavy, and tritiated water. In particular, we studied the effect of changing the isotopic mass of hydrogen on the kinetic energy and atomic delocalization in the crystal as well as on structural properties such as interatomic distances and molar volume. For D(2)O ice Ih at 100 K we obtained a decrease in molar volume and intramolecular O-H distance of 0.6% and 0.4%, respectively, as compared to H(2)O ice. © 2011 American Institute of Physics.

  16. Thermal properties of graphene from path-integral simulations

    Science.gov (United States)

    Herrero, Carlos P.; Ramírez, Rafael

    2018-03-01

    Thermal properties of graphene monolayers are studied by path-integral molecular dynamics simulations, which take into account the quantization of vibrational modes in the crystalline membrane and allow one to consider anharmonic effects in these properties. This system was studied at temperatures in the range from 12 to 2000 K and zero external stress, by describing the interatomic interactions through the LCBOPII effective potential. We analyze the internal energy and specific heat and compare the results derived from the simulations with those yielded by a harmonic approximation for the vibrational modes. This approximation turns out to be rather precise up to temperatures of about 400 K. At higher temperatures, we observe an influence of the elastic energy due to the thermal expansion of the graphene sheet. Zero-point and thermal effects on the in-plane and "real" surface of graphene are discussed. The thermal expansion coefficient α of the real area is found to be positive at all temperatures, in contrast to the expansion coefficient αp of the in-plane area, which is negative at low temperatures and becomes positive for T ≳ 1000 K.

  17. Path integral approach to two-dimensional QCD in the light-front frame

    Energy Technology Data Exchange (ETDEWEB)

    Gaete, P. (Instituto de Fisica, Universidade Federal do Rio de Janeiro, C.P. 68528, BR-21945, Rio de Janeiro (Brazil)); Gamboa, J. (Fachbereich 7 Physik, Universitaet Siegen, Siegen, D-57068 (Germany)); Schmidt, I. (Departamento de Fisica, Universidad Tecnica Federico Santa Maria, Casilla 110-V, Valparaiso (Chile))

    1994-05-15

    Two-dimensional quantum chromodynamics in the light-front frame is studied following Hamiltonian methods. The theory is quantized using the path integral formalism and an effective theory similar to the Nambu--Jona-Lasinio model is obtained. Confinement in two dimensions is derived by analyzing directly the constraints in the path integral.

  18. Path integral approach to eikonal and next-to-eikonal exponentiation

    NARCIS (Netherlands)

    Laenen, E.; Stavenga, G.; White, C.D.

    2009-01-01

    We approach the issue of exponentiation of soft gauge boson corrections to scattering amplitudes from a path integral point of view. We show that if one represents the amplitude as a first quantized path integral in a mixed coordinate-momentum space representation, a charged particle interacting

  19. Regularizing Feynman path integrals using the generalized Kontsevich-Vishik trace

    Science.gov (United States)

    Hartung, Tobias

    2017-12-01

    A fully regulated definition of Feynman's path integral is presented here. The proposed re-formulation of the path integral coincides with the familiar formulation whenever the path integral is well defined. In particular, it is consistent with respect to lattice formulations and Wick rotations, i.e., it can be used in Euclidean and Minkowski space-time. The path integral regularization is introduced through the generalized Kontsevich-Vishik trace, that is, the extension of the classical trace to Fourier integral operators. Physically, we are replacing the time-evolution semi-group by a holomorphic family of operators such that the corresponding path integrals are well defined in some half space of C . The regularized path integral is, thus, defined through analytic continuation. This regularization can be performed by means of stationary phase approximation or computed analytically depending only on the Hamiltonian and the observable (i.e., known a priori). In either case, the computational effort to evaluate path integrals or expectations of observables reduces to the evaluation of integrals over spheres. Furthermore, computations can be performed directly in the continuum and applications (analytic computations and their implementations) to a number of models including the non-trivial cases of the massive Schwinger model and a φ4 theory.

  20. Quantum circuit dynamics via path integrals: Is there a classical action for discrete-time paths?

    Science.gov (United States)

    Penney, Mark D.; Enshan Koh, Dax; Spekkens, Robert W.

    2017-07-01

    It is straightforward to compute the transition amplitudes of a quantum circuit using the sum-over-paths methodology when the gates in the circuit are balanced, where a balanced gate is one for which all non-zero transition amplitudes are of equal magnitude. Here we consider the question of whether, for such circuits, the relative phases of different discrete-time paths through the configuration space can be defined in terms of a classical action, as they are for continuous-time paths. We show how to do so for certain kinds of quantum circuits, namely, Clifford circuits where the elementary systems are continuous-variable systems or discrete systems of odd-prime dimension. These types of circuit are distinguished by having phase-space representations that serve to define their classical counterparts. For discrete systems, the phase-space coordinates are also discrete variables. We show that for each gate in the generating set, one can associate a symplectomorphism on the phase-space and to each of these one can associate a generating function, defined on two copies of the configuration space. For discrete systems, the latter association is achieved using tools from algebraic geometry. Finally, we show that if the action functional for a discrete-time path through a sequence of gates is defined using the sum of the corresponding generating functions, then it yields the correct relative phases for the path-sum expression. These results are likely to be relevant for quantizing physical theories where time is fundamentally discrete, characterizing the classical limit of discrete-time quantum dynamics, and proving complexity results for quantum circuits.

  1. On the coordinate (in)dependence of the formal path integral

    DEFF Research Database (Denmark)

    Johnson-Freyd, Theo

    When path integrals are discussed in quantum field theory, it is almost always assumed that the fields take values in a vector bundle. When the fields are instead valued in a possibly-curved fiber bundle, the independence of the formal path integral on the coordinates becomes much less obvious....... In this short note, aimed primarily at mathematicians, we first briefly recall the notions of Lagrangian classical and quantum field theory and the standard coordinate-full definition of the “formal” or “Feynman-diagrammatic” path integral construction. We then outline a proof of the following claim: the formal...

  2. Path integrals in quantum mechanics, statistics, polymer physics, and financial markets

    CERN Document Server

    Kleinert, Hagen

    2009-01-01

    This is the fifth, expanded edition of the comprehensive textbook published in 1990 on the theory and applications of path integrals. It is the first book to explicitly solve path integrals of a wide variety of nontrivial quantum-mechanical systems, in particular the hydrogen atom. The solutions have been made possible by two major advances. The first is a new euclidean path integral formula which increases the restricted range of applicability of Feynman's time-sliced formula to include singular attractive 1/r- and 1/r2-potentials. The second is a new nonholonomic mapping principle carrying p

  3. Piloting and Path Integration within and across Boundaries

    Science.gov (United States)

    Mou, Weimin; Wang, Lin

    2015-01-01

    Three experiments investigated whether navigation is less efficient across boundaries than within boundaries. In an immersive virtual environment, participants learned objects' locations in a large room or a small room. Participants then pointed to the objects' original locations after physically walking a circuitous path without vision.…

  4. Rotational error in path integration: encoding and execution errors in angle reproduction.

    Science.gov (United States)

    Chrastil, Elizabeth R; Warren, William H

    2017-06-01

    Path integration is fundamental to human navigation. When a navigator leaves home on a complex outbound path, they are able to keep track of their approximate position and orientation and return to their starting location on a direct homebound path. However, there are several sources of error during path integration. Previous research has focused almost exclusively on encoding error-the error in registering the outbound path in memory. Here, we also consider execution error-the error in the response, such as turning and walking a homebound trajectory. In two experiments conducted in ambulatory virtual environments, we examined the contribution of execution error to the rotational component of path integration using angle reproduction tasks. In the reproduction tasks, participants rotated once and then rotated again to face the original direction, either reproducing the initial turn or turning through the supplementary angle. One outstanding difficulty in disentangling encoding and execution error during a typical angle reproduction task is that as the encoding angle increases, so does the required response angle. In Experiment 1, we dissociated these two variables by asking participants to report each encoding angle using two different responses: by turning to walk on a path parallel to the initial facing direction in the same (reproduction) or opposite (supplementary angle) direction. In Experiment 2, participants reported the encoding angle by turning both rightward and leftward onto a path parallel to the initial facing direction, over a larger range of angles. The results suggest that execution error, not encoding error, is the predominant source of error in angular path integration. These findings also imply that the path integrator uses an intrinsic (action-scaled) rather than an extrinsic (objective) metric.

  5. On some mathematical problems in the definition of Feynman path integral

    International Nuclear Information System (INIS)

    Combe, P.; Rodriguez, R.; Sirugue-Collin, M.

    1976-07-01

    It is shown how integration on a Hilbert space of paths can be performed to get exact evolution of non relativistic quantum systems for a rather large class of potentials including polynomial interaction

  6. Phase-space path-integral calculation of the Wigner function

    International Nuclear Information System (INIS)

    Samson, J H

    2003-01-01

    The Wigner function W(q, p) is formulated as a phase-space path integral, whereby its sign oscillations can be seen to follow from interference between the geometrical phases of the paths. The approach has similarities to the path-centroid method in the configuration-space path integral. Paths can be classified by the midpoint of their ends; short paths where the midpoint is close to (q, p) and which lie in regions of low energy (low P function of the Hamiltonian) will dominate, and the enclosed area will determine the sign of the Wigner function. As a demonstration, the method is applied to a sequence of density matrices interpolating between a Poissonian number distribution and a number state, each member of which can be represented exactly by a discretized path integral with a finite number of vertices. Saddle-point evaluation of these integrals recovers (up to a constant factor) the WKB approximation to the Wigner function of a number state

  7. An Anatomically Constrained Model for Path Integration in the Bee Brain.

    Science.gov (United States)

    Stone, Thomas; Webb, Barbara; Adden, Andrea; Weddig, Nicolai Ben; Honkanen, Anna; Templin, Rachel; Wcislo, William; Scimeca, Luca; Warrant, Eric; Heinze, Stanley

    2017-10-23

    Path integration is a widespread navigational strategy in which directional changes and distance covered are continuously integrated on an outward journey, enabling a straight-line return to home. Bees use vision for this task-a celestial-cue-based visual compass and an optic-flow-based visual odometer-but the underlying neural integration mechanisms are unknown. Using intracellular electrophysiology, we show that polarized-light-based compass neurons and optic-flow-based speed-encoding neurons converge in the central complex of the bee brain, and through block-face electron microscopy, we identify potential integrator cells. Based on plausible output targets for these cells, we propose a complete circuit for path integration and steering in the central complex, with anatomically identified neurons suggested for each processing step. The resulting model circuit is thus fully constrained biologically and provides a functional interpretation for many previously unexplained architectural features of the central complex. Moreover, we show that the receptive fields of the newly discovered speed neurons can support path integration for the holonomic motion (i.e., a ground velocity that is not precisely aligned with body orientation) typical of bee flight, a feature not captured in any previously proposed model of path integration. In a broader context, the model circuit presented provides a general mechanism for producing steering signals by comparing current and desired headings-suggesting a more basic function for central complex connectivity, from which path integration may have evolved. Copyright © 2017 Elsevier Ltd. All rights reserved.

  8. Quantum-classical path integral. I. Classical memory and weak quantum nonlocality.

    Science.gov (United States)

    Lambert, Roberto; Makri, Nancy

    2012-12-14

    We consider rigorous path integral descriptions of the dynamics of a quantum system coupled to a polyatomic environment, assuming that the latter is well approximated by classical trajectories. Earlier work has derived semiclassical or purely classical expressions for the influence functional from the environment, which should be sufficiently accurate for many situations, but the evaluation of quantum-(semi)classical path integral (QCPI) expressions has not been practical for large-scale simulation because the interaction with the environment introduces couplings nonlocal in time. In this work, we analyze the nature of the effects on a system from its environment in light of the observation [N. Makri, J. Chem. Phys. 109, 2994 (1998)] that true nonlocality in the path integral is a strictly quantum mechanical phenomenon. If the environment is classical, the path integral becomes local and can be evaluated in a stepwise fashion along classical trajectories of the free solvent. This simple "classical path" limit of QCPI captures fully the decoherence of the system via a classical mechanism. Small corrections to the classical path QCPI approximation may be obtained via an inexpensive random hop QCPI model, which accounts for some "back reaction" effects. Exploiting the finite length of nonlocality, we argue that further inclusion of quantum decoherence is possible via an iterative evaluation of the path integral. Finally, we show that the sum of the quantum amplitude factors with respect to the system paths leads to a smooth integrand as a function of trajectory initial conditions, allowing the use of Monte Carlo methods for the multidimensional phase space integral.

  9. Mnemonic discrimination relates to perforant path integrity: An ultra-high resolution diffusion tensor imaging study.

    Science.gov (United States)

    Bennett, Ilana J; Stark, Craig E L

    2016-03-01

    Pattern separation describes the orthogonalization of similar inputs into unique, non-overlapping representations. This computational process is thought to serve memory by reducing interference and to be mediated by the dentate gyrus of the hippocampus. Using ultra-high in-plane resolution diffusion tensor imaging (hrDTI) in older adults, we previously demonstrated that integrity of the perforant path, which provides input to the dentate gyrus from entorhinal cortex, was associated with mnemonic discrimination, a behavioral outcome designed to load on pattern separation. The current hrDTI study assessed the specificity of this perforant path integrity-mnemonic discrimination relationship relative to other cognitive constructs (identified using a factor analysis) and white matter tracts (hippocampal cingulum, fornix, corpus callosum) in 112 healthy adults (20-87 years). Results revealed age-related declines in integrity of the perforant path and other medial temporal lobe (MTL) tracts (hippocampal cingulum, fornix). Controlling for global effects of brain aging, perforant path integrity related only to the factor that captured mnemonic discrimination performance. Comparable integrity-mnemonic discrimination relationships were also observed for the hippocampal cingulum and fornix. Thus, whereas perforant path integrity specifically relates to mnemonic discrimination, mnemonic discrimination may be mediated by a broader MTL network. Copyright © 2015 Elsevier Inc. All rights reserved.

  10. Tunnel splitting in biaxial spin models investigated with spin-coherent-state path integrals

    International Nuclear Information System (INIS)

    Chen Zhide; Liang, J.-Q.; Pu, F.-C.

    2003-01-01

    Tunnel splitting in biaxial spin models is investigated with a full evaluation of the fluctuation functional integrals of the Euclidean kernel in the framework of spin-coherent-state path integrals which leads to a magnitude of tunnel splitting quantitatively comparable with the numerical results in terms of diagonalization of the Hamilton operator. An additional factor resulted from a global time transformation converting the position-dependent mass to a constant one seems to be equivalent to the semiclassical correction of the Lagrangian proposed by Enz and Schilling. A long standing question whether the spin-coherent-state representation of path integrals can result in an accurate tunnel splitting is therefore resolved

  11. Efficient Calculation of Energy Expectation Values in the Path Integral Formalism

    CERN Document Server

    Grujic, J

    2006-01-01

    The path integral formalism, originally introduced by Richard Feynman, represents a powerful general framework for dealing with quantum and statistical theories, as well as an extremely useful tool in many other areas of science. Their numerical integration, however, is notoriously demanding of computer time and it is one of the most challenging computational problems.

  12. Iterated real-time path integral evaluation using a distributed approximating functional propagator and average-case complexity integration

    International Nuclear Information System (INIS)

    Kouri, D.J.; Huang, Y.; Hoffman, D.K.

    1995-01-01

    The distributed approximating functional-path integral is formulated as an iterated sequence of d-dimensional integrals, where d is the intrinsic number of degrees of freedom for the system under consideration. This is made practical for larger values of d by evaluating these integrals using average-case complexity integration techniques, based on deterministic ''low discrepancy sequences,'' as opposed to products of one-dimensional quadratures or basis functions. The integration converges as (logP) d-1 /P, where P is the number of sample points used, and the dimensionality of the integral does not increase with the number of time slices required

  13. A Neural Path Integration Mechanism for Adaptive Vector Navigation in Autonomous Agents

    DEFF Research Database (Denmark)

    Goldschmidt, Dennis; Dasgupta, Sakyasingha; Wörgötter, Florentin

    2015-01-01

    Animals show remarkable capabilities in navigating their habitat in a fully autonomous and energy-efficient way. In many species, these capabilities rely on a process called path integration, which enables them to estimate their current location and to find their way back home after long-distance......Animals show remarkable capabilities in navigating their habitat in a fully autonomous and energy-efficient way. In many species, these capabilities rely on a process called path integration, which enables them to estimate their current location and to find their way back home after long...... of autonomous agent navigation, but it also reproduces various aspects of animal navigation. Finally, we discuss how the proposed path integration mechanism may be used as a scaffold for spatial learning in terms of vector navigation....

  14. Path integrals for quantum mechanics in curved space (or anomalies from nonlinear sigma models)

    Energy Technology Data Exchange (ETDEWEB)

    Nieuwenhuizen, Peter van [State Univ. of New York, Stony Brook, NY (United States). Inst. for Theoretical Physics]. E-mail: vannieu@insti.physics.sunysb.edu

    1996-07-01

    We give a complete derivation of path integrals for quantum mechanical nonlinear sigma models. We begin with bosonic systems with an arbitrary Hamiltonian H-circumflex quadratic in momenta. Starting from the matrix element with arbitrary but a priori fixed operator ordering in H-circumflex, we insert complete sets of position and momentum eigenstates, and obtain the discretized propagators and vertices in closed form. These results tell how to evaluate equal-time contractions in the corresponding continuum path integrals, as well as products of distributions. (author)

  15. The path integral model of D-pairing for HTSC, heavy fermion superconductors, and superfluids

    International Nuclear Information System (INIS)

    Brusov, P.N.; Brusova, N.P.

    1996-01-01

    A model of d-pairing for superconducting and superfluid Fermi-systems has been formulated within the path integration technique. By path integration over open-quote fastclose quotes and open-quotes slowclose quotes Fermi-fields, the action functional (which determines all properties of model system) has been obtained. This functional could be used for the determination of different superconducting (superfluid) states, for calculation of the transition temperatures for these states, and for the calculation of the collective mode spectrum for HTSC, as well as for heavy fermion superconductors

  16. Enzymatic Kinetic Isotope Effects from Path-Integral Free Energy Perturbation Theory.

    Science.gov (United States)

    Gao, J

    2016-01-01

    Path-integral free energy perturbation (PI-FEP) theory is presented to directly determine the ratio of quantum mechanical partition functions of different isotopologs in a single simulation. Furthermore, a double averaging strategy is used to carry out the practical simulation, separating the quantum mechanical path integral exactly into two separate calculations, one corresponding to a classical molecular dynamics simulation of the centroid coordinates, and another involving free-particle path-integral sampling over the classical, centroid positions. An integrated centroid path-integral free energy perturbation and umbrella sampling (PI-FEP/UM, or simply, PI-FEP) method along with bisection sampling was summarized, which provides an accurate and fast convergent method for computing kinetic isotope effects for chemical reactions in solution and in enzymes. The PI-FEP method is illustrated by a number of applications, to highlight the computational precision and accuracy, the rule of geometrical mean in kinetic isotope effects, enhanced nuclear quantum effects in enzyme catalysis, and protein dynamics on temperature dependence of kinetic isotope effects. © 2016 Elsevier Inc. All rights reserved.

  17. A new path-integral representation of the T-matrix in potential scattering

    International Nuclear Information System (INIS)

    Carron, J.; Rosenfelder, R.

    2011-01-01

    We employ the method used by Barbashov and collaborators in Quantum Field Theory to derive a path-integral representation of the T-matrix in nonrelativistic potential scattering which is free of functional integration over fictitious variables as was necessary before. The resulting expression serves as a starting point for a variational approximation applied to high-energy scattering from a Gaussian potential. Good agreement with exact partial-wave calculations is found even at large scattering angles. A novel path-integral representation of the scattering length is obtained in the low-energy limit. -- Highlights: → We derive a new path-integral representation for the T-matrix in quantum scattering from a potential. → The method is based on a technique used by Barbashov and collaborators in Quantum Field Theory. → Unlike previous approaches no unphysical degrees of freedom in the path integral are needed. → The new representation is used for a variational approximation of the T-matrix at high energies. → A new expression for the scattering length at low energy is derived.

  18. The path integral formulation of fractional Brownian motion for the general Hurst exponent

    International Nuclear Information System (INIS)

    Calvo, I; Sanchez, R

    2008-01-01

    In 1995, Sebastian (1995 J. Phys. A: Math. Gen. 28 4305) gave a path integral computation of the propagator of subdiffusive fractional Brownian motion (fBm), i.e. fBm with a Hurst or self-similarity exponent H element of (0, 1/2). The extension of Sebastian's calculation to superdiffusion, H element of (1/2, 1], becomes however quite involved due to the appearance of additional boundary conditions on fractional derivatives of the path. In this communication, we address the construction of the path integral representation in a different fashion, which allows us to treat both subdiffusion and superdiffusion on an equal footing. The derivation of the propagator of fBm for the general Hurst exponent is then performed in a neat and unified way. (fast track communication)

  19. Path integration guided with a quality map for shape reconstruction in the fringe reflection technique

    Science.gov (United States)

    Jing, Xiaoli; Cheng, Haobo; Wen, Yongfu

    2018-04-01

    A new local integration algorithm called quality map path integration (QMPI) is reported for shape reconstruction in the fringe reflection technique. A quality map is proposed to evaluate the quality of gradient data locally, and functions as a guideline for the integrated path. The presented method can be employed in wavefront estimation from its slopes over the general shaped surface with slope noise equivalent to that in practical measurements. Moreover, QMPI is much better at handling the slope data with local noise, which may be caused by the irregular shapes of the surface under test. The performance of QMPI is discussed by simulations and experiment. It is shown that QMPI not only improves the accuracy of local integration, but can also be easily implemented with no iteration compared to Southwell zonal reconstruction (SZR). From an engineering point-of-view, the proposed method may also provide an efficient and stable approach for different shapes with high-precise demand.

  20. Some comments on rigorous quantum field path integrals in the analytical regularization scheme

    Energy Technology Data Exchange (ETDEWEB)

    Botelho, Luiz C.L. [Universidade Federal Fluminense (UFF), Niteroi, RJ (Brazil). Dept. de Matematica Aplicada]. E-mail: botelho.luiz@superig.com.br

    2008-07-01

    Through the systematic use of the Minlos theorem on the support of cylindrical measures on R{sup {infinity}}, we produce several mathematically rigorous path integrals in interacting euclidean quantum fields with Gaussian free measures defined by generalized powers of the Laplacian operator. (author)

  1. Path Integral Treatment of Proton Transport Processes in BaZrO3

    DEFF Research Database (Denmark)

    Zhang, Qianfan; Wahnstrom, Goran; Björketun, Mårten

    2008-01-01

    Nuclear quantum effects on proton transfer and reorientation in BaZrO3 is investigated theoretically using the ab initio path-integral molecular-dynamics simulation technique. The result demonstrates that adding quantum fluctuations has a large effect on, in particular, the transfer barrier...

  2. Path integral in a magnetic field using the Trotter product formula

    Czech Academy of Sciences Publication Activity Database

    Gaveau, B.; Mihóková, Eva; Roncadelli, M.; Schulman, L. S.

    2004-01-01

    Roč. 72, č. 3 (2004), s. 385-388 ISSN 0002-9505 R&D Projects: GA MŠk ME 587 Institutional research plan: CEZ:AV0Z1010914 Keywords : path integral * magnetic field Subject RIV: BM - Solid Matter Physics ; Magnetism Impact factor: 0.844, year: 2004

  3. Path integrals and the solution of the Schwinger model in curved space-time

    Energy Technology Data Exchange (ETDEWEB)

    Barcelos-Neto, J.; Das, A.

    1986-04-15

    We use the path-integral formalism to derive the solution of the Schwinger model in curved space-time. We show that the nature of flat--space-time solutions persists even in the presence of a background gravitational field.

  4. Explaining Technology Integration in K-12 Classrooms: A Multilevel Path Analysis Model

    Science.gov (United States)

    Liu, Feng; Ritzhaupt, Albert D.; Dawson, Kara; Barron, Ann E.

    2017-01-01

    The purpose of this research was to design and test a model of classroom technology integration in the context of K-12 schools. The proposed multilevel path analysis model includes teacher, contextual, and school related variables on a teacher's use of technology and confidence and comfort using technology as mediators of classroom technology…

  5. Invariant path integration and the functional measure for Einstein gravitation theory

    International Nuclear Information System (INIS)

    Botelho, L.C.L.

    1985-01-01

    An invariant path integral approach is proposed for the Einstein gravitation theory suitable to the analysis of the associated functional measure problem. The proposed formulation is used to analyse the phenomenon of quantum gravity in two dimensional space times. (Author) [pt

  6. Quantum mechanical path integrals in curved spaces and the type-A trace anomaly

    Energy Technology Data Exchange (ETDEWEB)

    Bastianelli, Fiorenzo [Dipartimento di Fisica ed Astronomia, Università di Bologna,via Irnerio 46, I-40126 Bologna (Italy); INFN, Sezione di Bologna,via Irnerio 46, I-40126 Bologna (Italy); Corradini, Olindo [Dipartimento di Scienze Fisiche, Informatiche e Matematiche,Università di Modena e Reggio Emilia,Via Campi 213/A, I-41125 Modena (Italy); INFN, Sezione di Bologna,via Irnerio 46, I-40126 Bologna (Italy); Vassura, Edoardo [Dipartimento di Fisica ed Astronomia, Università di Bologna,via Irnerio 46, I-40126 Bologna (Italy); INFN, Sezione di Bologna,via Irnerio 46, I-40126 Bologna (Italy)

    2017-04-10

    Path integrals for particles in curved spaces can be used to compute trace anomalies in quantum field theories, and more generally to study properties of quantum fields coupled to gravity in first quantization. While their construction in arbitrary coordinates is well understood, and known to require the use of a regularization scheme, in this article we take up an old proposal of constructing the path integral by using Riemann normal coordinates. The method assumes that curvature effects are taken care of by a scalar effective potential, so that the particle lagrangian is reduced to that of a linear sigma model interacting with the effective potential. After fixing the correct effective potential, we test the construction on spaces of maximal symmetry and use it to compute heat kernel coefficients and type-A trace anomalies for a scalar field in arbitrary dimensions up to d=12. The results agree with expected ones, which are reproduced with great efficiency and extended to higher orders. We prove explicitly the validity of the simplified path integral on maximally symmetric spaces. This simplified path integral might be of further use in worldline applications, though its application on spaces of arbitrary geometry remains unclear.

  7. Some comments on rigorous quantum field path integrals in the analytical regularization scheme

    International Nuclear Information System (INIS)

    Botelho, Luiz C.L.

    2008-01-01

    Through the systematic use of the Minlos theorem on the support of cylindrical measures on R ∞ , we produce several mathematically rigorous path integrals in interacting euclidean quantum fields with Gaussian free measures defined by generalized powers of the Laplacian operator. (author)

  8. Two-Level System Coupled to Phonons : A Discrete Path-Integral Method

    NARCIS (Netherlands)

    Raedt, Bart De; Raedt, Hans De

    1983-01-01

    A discrete path-integral representation for the partition function of a two-level tunneling system coupled to acoustic phonons is derived. This representation allows calculation of properties in the whole coupling range. As a function of the coupling there is an abrupt (ground-state) transition from

  9. Teaching Basic Quantum Mechanics in Secondary School Using Concepts of Feynman Path Integrals Method

    Science.gov (United States)

    Fanaro, Maria de los Angeles; Otero, Maria Rita; Arlego, Marcelo

    2012-01-01

    This paper discusses the teaching of basic quantum mechanics in high school. Rather than following the usual formalism, our approach is based on Feynman's path integral method. Our presentation makes use of simulation software and avoids sophisticated mathematical formalism. (Contains 3 figures.)

  10. Real-space path integration is impaired in Alzheimer’s disease and mild cognitive impairment

    Czech Academy of Sciences Publication Activity Database

    Mokrišová, I.; Laczó, J.; Andel, R.; Gažová, I.; Vyhnálek, M.; Nedělská, Z.; Levčík, David; Cerman, J.; Vlček, Kamil; Hort, J.

    2016-01-01

    Roč. 307, Jul 1 (2016), s. 150-158 ISSN 0166-4328 Institutional support: RVO:67985823 Keywords : Alzheimer disease * mild cognitive impairment * spatial navigation * hippocampus * path integration Subject RIV: FH - Neurology Impact factor: 3.002, year: 2016

  11. Effects of Quantum Nuclear Delocalisation on NMR Parameters from Path Integral Molecular Dynamics

    Czech Academy of Sciences Publication Activity Database

    Dračínský, Martin; Hodgkinson, P.

    2014-01-01

    Roč. 20, č. 8 (2014), s. 2201-2207 ISSN 0947-6539 Grant - others:Seventh Framework Programme of the European Union(XE) FP7-299242 People Institutional support: RVO:61388963 Keywords : density functional calculations * isotope effects * NMR spectroscopy * nuclear delocalisation * path integral molecular dynamics Subject RIV: CC - Organic Chemistry Impact factor: 5.731, year: 2014

  12. Integrative Families and Systems Treatment: A Middle Path toward Integrating Common and Specific Factors in Evidence-Based Family Therapy

    Science.gov (United States)

    Fraser, J. Scott; Solovey, Andrew D.; Grove, David; Lee, Mo Yee; Greene, Gilbert J.

    2012-01-01

    A moderate common factors approach is proposed as a synthesis or middle path to integrate common and specific factors in evidence-based approaches to high-risk youth and families. The debate in family therapy between common and specific factors camps is reviewed and followed by suggestions from the literature for synthesis and creative flexibility…

  13. PRELIMINARY PROJECT PLAN FOR LANSCE INTEGRATED FLIGHT PATHS 11A, 11B, 12, and 13

    International Nuclear Information System (INIS)

    Bultman, D. H.; Weinacht, D.

    2000-01-01

    This Preliminary Project Plan Summarizes the Technical, Cost, and Schedule baselines for an integrated approach to developing several flight paths at the Manual Lujan Jr. Neutron Scattering Center at the Los Alamos Neutron Science Center. For example, the cost estimate is intended to serve only as a rough order of magnitude assessment of the cost that might be incurred as the flight paths are developed. Further refinement of the requirements and interfaces for each beamline will permit additional refinement and confidence in the accuracy of all three baselines (Technical, Cost, Schedule)

  14. Path integrals for electronic densities, reactivity indices, and localization functions in quantum systems.

    Science.gov (United States)

    Putz, Mihai V

    2009-11-10

    The density matrix theory, the ancestor of density functional theory, provides the immediate framework for Path Integral (PI) development, allowing the canonical density be extended for the many-electronic systems through the density functional closure relationship. Yet, the use of path integral formalism for electronic density prescription presents several advantages: assures the inner quantum mechanical description of the system by parameterized paths; averages the quantum fluctuations; behaves as the propagator for time-space evolution of quantum information; resembles Schrödinger equation; allows quantum statistical description of the system through partition function computing. In this framework, four levels of path integral formalism were presented: the Feynman quantum mechanical, the semiclassical, the Feynman-Kleinert effective classical, and the Fokker-Planck non-equilibrium ones. In each case the density matrix or/and the canonical density were rigorously defined and presented. The practical specializations for quantum free and harmonic motions, for statistical high and low temperature limits, the smearing justification for the Bohr's quantum stability postulate with the paradigmatic Hydrogen atomic excursion, along the quantum chemical calculation of semiclassical electronegativity and hardness, of chemical action and Mulliken electronegativity, as well as by the Markovian generalizations of Becke-Edgecombe electronic focalization functions - all advocate for the reliability of assuming PI formalism of quantum mechanics as a versatile one, suited for analytically and/or computationally modeling of a variety of fundamental physical and chemical reactivity concepts characterizing the (density driving) many-electronic systems.

  15. Path Integrals for Electronic Densities, Reactivity Indices, and Localization Functions in Quantum Systems

    Directory of Open Access Journals (Sweden)

    Mihai V. Putz

    2009-11-01

    Full Text Available The density matrix theory, the ancestor of density functional theory, provides the immediate framework for Path Integral (PI development, allowing the canonical density be extended for the many-electronic systems through the density functional closure relationship. Yet, the use of path integral formalism for electronic density prescription presents several advantages: assures the inner quantum mechanical description of the system by parameterized paths; averages the quantum fluctuations; behaves as the propagator for time-space evolution of quantum information; resembles Schrödinger equation; allows quantum statistical description of the system through partition function computing. In this framework, four levels of path integral formalism were presented: the Feynman quantum mechanical, the semiclassical, the Feynman-Kleinert effective classical, and the Fokker-Planck non-equilibrium ones. In each case the density matrix or/and the canonical density were rigorously defined and presented. The practical specializations for quantum free and harmonic motions, for statistical high and low temperature limits, the smearing justification for the Bohr’s quantum stability postulate with the paradigmatic Hydrogen atomic excursion, along the quantum chemical calculation of semiclassical electronegativity and hardness, of chemical action and Mulliken electronegativity, as well as by the Markovian generalizations of Becke-Edgecombe electronic focalization functions – all advocate for the reliability of assuming PI formalism of quantum mechanics as a versatile one, suited for analytically and/or computationally modeling of a variety of fundamental physical and chemical reactivity concepts characterizing the (density driving many-electronic systems.

  16. Lithium impurity recombination in solid para-hydrogen: A path integral quantum transition state theory study

    Science.gov (United States)

    Jang, Seogjoo; Voth, Gregory A.

    1998-03-01

    The recombination of two lithium atoms trapped in one-vacancy defect sites of solid para-hydrogen at 4 K and zero external pressure is studied as a quantum activated process. The quantum activation free energy is calculated using path integral quantum transition state theory along with the method of path integral molecular dynamics simulation. The equilibrium volume of the system is determined by a constant pressure method that scales the sides of the rectangular simulation box. At a fixed equilibrium volume of the system, a constraint dynamics path integral simulation is then employed to determine the quantum path centroid free energy barrier along the reaction coordinate, which is taken to be the relative Li-Li separation. The two lithium atoms begin to recombine at a distance of approximately twice the lattice spacing, and the height of the barrier relative to the metastable well is 78±10 K. The rate of the intrinsic recombination step is estimated to be 1.3×103s-1 at 4 K. It is found that the lithium nuclei exhibit significant tunneling behavior over their classical limit.

  17. Accelerated sampling by infinite swapping of path integral molecular dynamics with surface hopping

    Science.gov (United States)

    Lu, Jianfeng; Zhou, Zhennan

    2018-02-01

    To accelerate the thermal equilibrium sampling of multi-level quantum systems, the infinite swapping limit of a recently proposed multi-level ring polymer representation is investigated. In the infinite swapping limit, the ring polymer evolves according to an averaged Hamiltonian with respect to all possible surface index configurations of the ring polymer and thus connects the surface hopping approach to the mean-field path-integral molecular dynamics. A multiscale integrator for the infinite swapping limit is also proposed to enable efficient sampling based on the limiting dynamics. Numerical results demonstrate the huge improvement of sampling efficiency of the infinite swapping compared with the direct simulation of path-integral molecular dynamics with surface hopping.

  18. The 1+1 SU(2) Yang-Mills path integral

    International Nuclear Information System (INIS)

    Swanson, Mark S

    2004-01-01

    The path integral for SU(2) invariant two-dimensional Yang-Mills theory is recast in terms of the chromoelectric field strength by integrating the gauge fields from the theory. Implementing Gauss's law as a constraint in this process induces a topological term in the action that is no longer invariant under large gauge transformations. For the case that the partition function is considered over a circular spatial degree of freedom, it is shown that the effective action of the path integral is quantum mechanically WKB exact and localizes onto a set of chromoelectric zero modes satisfying antiperiodic boundary conditions. Summing over the zero modes yields a partition function that can be reexpressed using the Poisson resummation technique, allowing an easy determination of the energy spectrum, which is found to be identical to that given by other approaches

  19. Ray optics for diffraction: a useful paradox in a path integral context

    International Nuclear Information System (INIS)

    Schulman, L.S.

    1984-01-01

    Geometrical diffraction theory uses ray tracing techniques to calculate diffraction and other properties of the electromagnetic field generally considered characteristically wave like. The author studies this dualism of the classical electromagnetic field so as to distinguish those aspects of quantum dualism that arise simply as properties of oscillatory integrals and those that may have deeper origins. By a series of transformations the solutions of certain optics problems are reduced to the evaluation of a Feynman path integral and the known semiclassical approximations for the path integral provide a justification for the geometrical diffraction theory. Particular attention is paid to the problem of edge diffraction and for a half plane barrier a closed form solution is obtained. A classical variational principle for barrier penetration is also presented. (Auth.)

  20. Spatial representations of place cells in darkness are supported by path integration and border information

    Directory of Open Access Journals (Sweden)

    Sijie eZhang

    2014-06-01

    Full Text Available Effective spatial navigation is enabled by reliable reference cues that derive from sensory information from the external environment, as well as from internal sources such as the vestibular system. The integration of information from these sources enables dead reckoning in the form of path integration. Navigation in the dark is associated with the accumulation of errors in terms of perception of allocentric position and this may relate to error accumulation in path integration. We assessed this by recording from place cells in the dark under circumstances where spatial sensory cues were suppressed. Spatial information content, spatial coherence, place field size, and peak and infield firing rates decreased whereas sparsity increased following exploration in the dark compared to the light. Nonetheless it was observed that place field stability in darkness was sustained by border information in a subset of place cells. To examine the impact of encountering the environment’s border on navigation, we analyzed the trajectory and spiking data gathered during navigation in the dark. Our data suggest that although error accumulation in path integration drives place field drift in darkness, under circumstances where border contact is possible, this information is integrated to enable retention of spatial representations.

  1. The use of a path independent integral in non-linear fracture mechanics

    International Nuclear Information System (INIS)

    Hellen, T.K.

    1977-01-01

    The use of the Rice J-intergral to assess conditions at a crack tip in an elastic or non-linear elastic body is well known. The integral equals the energy release rate and is path independent for any contour surrounding the crack tip provided no other singularities are encompassed. The path independence propertiy breaks down, however, in more general situations such as in three dimensional stress systems, plasticity unloading, thermal or creep states. Hence the required crack tip characteristics represented by the value of the integral round a contour whose radius about the tip tends to zero, is not reproduced along contours away from the tip. Consequently, an alternative integral, designated J*, has been proposed which equals J for elastic cases and in the other cases cited above remains path independent. A computer program for calculating the J and J* integrals has been developed as an extension to the BERSAFE finite element system. A full analysis of the cracked structure including plasticity, creep and thermal strains is conducted and the results are stored on a permanent data set. The integral values may then be calculated using the post-processor program for any number of contours and load or time steps, without recourse to further expensive computations. (Auth. )

  2. Path integrals and Voronin's theorem on the universality of the Riemann zeta function

    Science.gov (United States)

    Bitar, Khalil M.; Khuri, N. N.; Ren, H. C.

    1991-10-01

    We present a new approach to the path integral in latticized quantum theories. Our method is based on Voronin's theorems on the universality of the Riemann zeta function. We obtain a formula for the partition function as a discrete sum over "paths" with each path labeled by an integer and given by a zeta function evaluated at a fixed set of points in the critical strip. These points are the image of the space-time lattice resulting from a simple linear mapping. A new measure appears in our sum, and its properties are extensively discussed and a method to calculate it is given. We carried out extensive checks of the method for Euclidean quantum mechanics, and compared the results with those obtained from well-established methods as well as exact results. The comparison confirms the validity of the zeta-function method and our calculation of the measure.

  3. IntPath--an integrated pathway gene relationship database for model organisms and important pathogens.

    Science.gov (United States)

    Zhou, Hufeng; Jin, Jingjing; Zhang, Haojun; Yi, Bo; Wozniak, Michal; Wong, Limsoon

    2012-01-01

    Pathway data are important for understanding the relationship between genes, proteins and many other molecules in living organisms. Pathway gene relationships are crucial information for guidance, prediction, reference and assessment in biochemistry, computational biology, and medicine. Many well-established databases--e.g., KEGG, WikiPathways, and BioCyc--are dedicated to collecting pathway data for public access. However, the effectiveness of these databases is hindered by issues such as incompatible data formats, inconsistent molecular representations, inconsistent molecular relationship representations, inconsistent referrals to pathway names, and incomprehensive data from different databases. In this paper, we overcome these issues through extraction, normalization and integration of pathway data from several major public databases (KEGG, WikiPathways, BioCyc, etc). We build a database that not only hosts our integrated pathway gene relationship data for public access but also maintains the necessary updates in the long run. This public repository is named IntPath (Integrated Pathway gene relationship database for model organisms and important pathogens). Four organisms--S. cerevisiae, M. tuberculosis H37Rv, H. Sapiens and M. musculus--are included in this version (V2.0) of IntPath. IntPath uses the "full unification" approach to ensure no deletion and no introduced noise in this process. Therefore, IntPath contains much richer pathway-gene and pathway-gene pair relationships and much larger number of non-redundant genes and gene pairs than any of the single-source databases. The gene relationships of each gene (measured by average node degree) per pathway are significantly richer. The gene relationships in each pathway (measured by average number of gene pairs per pathway) are also considerably richer in the integrated pathways. Moderate manual curation are involved to get rid of errors and noises from source data (e.g., the gene ID errors in WikiPathways and

  4. Integrated optimization of unmanned aerial vehicle task allocation and path planning under steady wind

    Science.gov (United States)

    Liang, Zhengzheng; Zhu, Moning; Hu, Xiaoxuan; Wang, Guoqiang

    2018-01-01

    Wind has a significant effect on the control of fixed-wing unmanned aerial vehicles (UAVs), resulting in changes in their ground speed and direction, which has an important influence on the results of integrated optimization of UAV task allocation and path planning. The objective of this integrated optimization problem changes from minimizing flight distance to minimizing flight time. In this study, the Euclidean distance between any two targets is expanded to the Dubins path length, considering the minimum turning radius of fixed-wing UAVs. According to the vector relationship between wind speed, UAV airspeed, and UAV ground speed, a method is proposed to calculate the flight time of UAV between targets. On this basis, a variable-speed Dubins path vehicle routing problem (VS-DP-VRP) model is established with the purpose of minimizing the time required for UAVs to visit all the targets and return to the starting point. By designing a crossover operator and mutation operator, the genetic algorithm is used to solve the model, the results of which show that an effective UAV task allocation and path planning solution under steady wind can be provided. PMID:29561888

  5. Blip-summed quantum-classical path integral with cumulative quantum memory.

    Science.gov (United States)

    Makri, Nancy

    2016-12-22

    The quantum-classical path integral (QCPI) offers a rigorous methodology for simulating quantum mechanical processes in condensed-phase environments treated in full atomistic detail. This paper describes the implementation of QCPI on system-bath models, which are frequently employed in studying the dynamics of reactive processes. The QCPI methodology incorporates all effects associated with stimulated phonon absorption and emission as its crudest limit, thus can (in some regimes) converge faster than influence functional-based path integral methods specifically designed for system-bath Hamiltonians. It is shown that the QCPI phase arising from a harmonic bath can be summed analytically with respect to the discrete bath degrees of freedom and expressed in terms of precomputed influence functional coefficients, avoiding the explicit enumeration of forced oscillator trajectories, whose number grows exponentially with the length of quantum memory. Further, adoption of the blip decomposition (which classifies the system paths based on the time length over which their forward and backward components are not identical) and a cumulative treatment of the QCPI phase between blips allows elimination of the majority of system paths, leading to a dramatic increase in efficiency. The generalization of these acceleration techniques to anharmonic environments is discussed.

  6. Phase space isometries and equivariant localization of path integrals in two dimensions

    International Nuclear Information System (INIS)

    Szabo, Richard J.; Semenoff, Gordon W.

    1994-01-01

    By considering the most general metric which can occur on a simply-connected two-dimensional symplectic manifold, we find the most general hamiltonians on a two-dimensional phase space to which equivariant localization formulas for the associated path integrals can be applied. We show that in the case of a maximally symmetric phase space the only applicable hamiltonians are essentially harmonic oscillators, while for nonhomogeneous phase spaces the possibilities are more numerous but ambiguities in the path integrals occur. In the latter case we give general formulas for the Darboux hamiltonians, as well as the hamiltonians which result naturally from a generalized coherent state formulation of the quantum theory which shows that again the hamiltonians so obtained are just generalized versions of harmonic oscillators. Our analysis and results describe the quantum geometry of some two-dimensional systems. ((orig.))

  7. Proton momentum distributions in water: A path integral molecular dynamics study

    Science.gov (United States)

    Srinivasan, Varadharajan; Morrone, Joseph A.; Sebastiani, Daniel; Car, Roberto

    2007-03-01

    Recent neutron Compton scattering experiments have detected the proton momentum distributions of water. This density in momentum space is a quantum mechanical property of the proton, due to the confining anharmonic potential from covalent and hydrogen bonds. The theoretical calculation of this property can be carried out via ``open'' path integral expressions. In this work, we present an extension of the staging path integral molecular dynamics method, which is then employed to calculate the proton momentum distributions of water in the solid, liquid, and supercritical phases. We utilize the SPC/F2 empirical force field to model the system's interactions. The calculated momentum distributions depict both agreement and discrepancies with experiment. The differences may be explained by the deviation of the force field from the true interactions. These distributions provide an abundance of information about the environment and interactions surrounding the proton.

  8. Introduction to quantum mechanics Schrödinger equation and path integral

    CERN Document Server

    Müller-Kirsten, H J W

    2012-01-01

    This text on quantum mechanics begins by covering all the main topics of an introduction to the subject. It then concentrates on newer developments. In particular it continues with the perturbative solution of the Schrodinger equation for various potentials and thereafter with the introduction and evaluation of their path integral counterparts. Considerations of the large order behavior of the perturbation expansions show that in most applications these are asymptotic expansions. The parallel consideration of path integrals requires the evaluation of these around periodic classical configurations, the fluctuation equations about which lead back to specific wave equations. The period of the classical configurations is related to temperature, and permits transitions to the thermal domain to be classified as phase transitions. In this second edition of the text important applications and numerous examples have been added. In particular, the chapter on the Coulomb potential has been extended to include an introdu...

  9. An accurate European option pricing model under Fractional Stable Process based on Feynman Path Integral

    Science.gov (United States)

    Ma, Chao; Ma, Qinghua; Yao, Haixiang; Hou, Tiancheng

    2018-03-01

    In this paper, we propose to use the Fractional Stable Process (FSP) for option pricing. The FSP is one of the few candidates to directly model a number of desired empirical properties of asset price risk neutral dynamics. However, pricing the vanilla European option under FSP is difficult and problematic. In the paper, built upon the developed Feynman Path Integral inspired techniques, we present a novel computational model for option pricing, i.e. the Fractional Stable Process Path Integral (FSPPI) model under a general fractional stable distribution that tackles this problem. Numerical and empirical experiments show that the proposed pricing model provides a correction of the Black-Scholes pricing error - overpricing long term options, underpricing short term options; overpricing out-of-the-money options, underpricing in-the-money options without any additional structures such as stochastic volatility and a jump process.

  10. Path-integral and Ornstein-Zernike study of quantum fluid structures on the crystallization line

    Energy Technology Data Exchange (ETDEWEB)

    Sesé, Luis M., E-mail: msese@ccia.uned.es [Departamento de Ciencias y Técnicas Fisicoquímicas, Universidad Nacional de Educación a Distancia, Paseo Senda del Rey 9, 28040 Madrid (Spain)

    2016-03-07

    Liquid neon, liquid para-hydrogen, and the quantum hard-sphere fluid are studied with path integral Monte Carlo simulations and the Ornstein-Zernike pair equation on their respective crystallization lines. The results cover the whole sets of structures in the r-space and the k-space and, for completeness, the internal energies, pressures and isothermal compressibilities. Comparison with experiment is made wherever possible, and the possibilities of establishing k-space criteria for quantum crystallization based on the path-integral centroids are discussed. In this regard, the results show that the centroid structure factor contains two significant parameters related to its main peak features (amplitude and shape) that can be useful to characterize freezing.

  11. The use of a path independent integral in non-linear fracture mechanics

    International Nuclear Information System (INIS)

    Hellen, T.K.

    1977-01-01

    A computer program for calculating the J and J* integrals has been developed as an extension to the BERSAFE finite element system. A full analysis of the cracked structure including plasticity, creep and thermal strains is conducted and the results are stored on a permanent data set. The integral values may then be calculated using the post-processor program for any number of contours and load or time steps, without recourse to further expensive computations. Numerical examples are presented comparing the J and J* integrals for a number of cracked plates under thermal, plastic and creep environments. To demonstrate the accuracy for a simple thermo-elastic case, a centre cracked plate subject to a symmetric quadratic gradient is included. Here, the J integral is shown to be path dependent whereas good independence is seen for the J* integral. The case of an elastic-plastic plate is invetigated to demonstrate path independence for both integrals in non-linear elasticity, and the effects of unloading are discussed. An alternative method for obtaining the change of potential energy over a small crack extension is briefly mentioned and compared to the J and J* results in this case. An axisymmetric bar with an internal penny-shaped crack subjected to tension is discussed under elastic-plastic materials behavior

  12. An efficient algorithm for integrated task sequencing and path planning for robotic remote laser welding

    Science.gov (United States)

    Gorbenko, Anna; Popov, Vladimir

    2017-07-01

    Different planning problems for robotic remote laser welding are of considerable interest. In this paper, we consider the problem of integrated task sequencing and path planning for robotic remote laser welding. We propose an efficient approach to solve the problem. In particular, we consider an explicit reduction from the decision version of the problem to the satisfiability problem. We present the results of computational experiments for different satisfiability algorithms.

  13. A 2-Micron Pulsed Integrated Path Differential Absorption Lidar Development For Atmospheric CO2 Concentration Measurements

    Science.gov (United States)

    Yu, Jirong; Petros, Mulugeta; Reithmaier, Karl; Bai, Yingxin; Trieu, Bo C.; Refaat, Tamer F.; Kavaya, Michael J.; Singh, Upendra N.

    2012-01-01

    A 2-micron pulsed, Integrated Path Differential Absorption (IPDA) lidar instrument for ground and airborne atmospheric CO2 concentration measurements via direct detection method is being developed at NASA Langley Research Center. This instrument will provide an alternate approach to measure atmospheric CO2 concentrations with significant advantages. A high energy pulsed approach provides high-precision measurement capability by having high signal-to-noise level and unambiguously eliminates the contamination from aerosols and clouds that can bias the IPDA measurement.

  14. Path-integral bosonization in topologically nontrivial sectors: The non-Abelian case

    International Nuclear Information System (INIS)

    Cabra, D.; Manias, M.V.; Schaposnik, F.A.; Trobo, M.

    1991-01-01

    We present a path-integral bosonization approach which allows us to take into account nontrivial topological sectors in two-dimensional models such as two-dimensional QCD. Because of the existence of fermionic zero modes, the partition function receives a contribution only from the topologically trivial (n=0) sector. However, certain fermionic correlation functions (constructed from chiral-charge-nonconserving operators) become nonvanishing when one takes into account n≠0 sectors

  15. The educational relationship as a place of integration and prevention: First results of an experimental path

    Directory of Open Access Journals (Sweden)

    Loredana Teresa Pedata

    2012-12-01

    Full Text Available The path and the pilot study presented here come from a synergy between a pharmaceutical, universities and institutions in the area. The intervention evaluation wants to establish itself as a means of "re-thinking" youth intervention benefited: the assumption that the integration of knowledge can constitute an enrichment of the whole person, we believe that such enrichment is more likely to occur in group in comparison with others and the development of social skills and human resources.

  16. Path-integral bosonization in a topological background; The Thirring model

    Energy Technology Data Exchange (ETDEWEB)

    Manias, M.V.; Naon, C.M.; Trobo, M.L. (Dept. de Fisica, Facultad de Ciencias Exactas, Univ. National de La Plata, C.C. 67, 1900 La Plata (AR))

    1990-07-20

    In this paper, the authors investigate the Thirring model in a nontrivial topological sector through the path-integral approach to bosonization. In particular, the authors analyze the minimal correlation functions. The authors find that there exist no nonvanishing minimal functions for any finite value of the Thirring coupling constant g{sup 2}. For g{sup 2} {yields} {infinity} we recover the results.

  17. Path-integral bosonization in topologically nontrivial sectors: The non-Abelian case

    Energy Technology Data Exchange (ETDEWEB)

    Cabra, D.; Manias, M.V. (Departamento de Fisica, Universidad Nacional de La Plata, CC 67, 1900 La Plata, Argentina (AR) Consejo Nacional de Investigaciones Cientificas y Tecnicas, Argentina (AR)); Schaposnik, F.A. (Laboratoire de Physique Theorique Particules Elementaires, Universite de Paris 7, Tour 24-5 et., 2 Place Jussieu, 75251 Paris CEDEX 05, France (FR) Departamento de Fisica, Universidad Nacional de La Plata, CC67 1900 La Plata, Argentina (AR) Comision de Investigaciones Cientificas Buenos Aires (CICBA), Buenos Aires, Argentina (AR)); Trobo, M. (Departamento de Fisica, Universidad Nacional de La Plata, CC 67, 1900 La Plata, Argentina Consejo Nacional de Investigaciones Cientificas y Tecnicas, Argentina (AR))

    1991-05-15

    We present a path-integral bosonization approach which allows us to take into account nontrivial topological sectors in two-dimensional models such as two-dimensional QCD. Because of the existence of fermionic zero modes, the partition function receives a contribution only from the topologically trivial ({ital n}=0) sector. However, certain fermionic correlation functions (constructed from chiral-charge-nonconserving operators) become nonvanishing when one takes into account {ital n}{ne}0 sectors.

  18. Statistical mechanics of neocortical interactions: High resolution path-integral calculation of short-term memory

    OpenAIRE

    Ingber, Lester; Nunez, Paul

    2000-01-01

    We present high-resolution path-integral calculations of a previously developed model of short-term memory in neocortex. These calculations, made possible with supercomputer resources, supplant similar calculations made in L. Ingber, Phys. Rev. E 49, 4652 (1994), and support coarser estimates made in L. Ingber, Phys. Rev. A 29, 3346 (1984). We also present a current experimental context for the relevance of these calculations using the approach of statistical mechanics of neocortical interact...

  19. Integrating cell on chip—Novel waveguide platform employing ultra-long optical paths

    Science.gov (United States)

    Fohrmann, Lena Simone; Sommer, Gerrit; Pitruzzello, Giampaolo; Krauss, Thomas F.; Petrov, Alexander Yu.; Eich, Manfred

    2017-09-01

    Optical waveguides are the most fundamental building blocks of integrated optical circuits. They are extremely well understood, yet there is still room for surprises. Here, we introduce a novel 2D waveguide platform which affords a strong interaction of the evanescent tail of a guided optical wave with an external medium while only employing a very small geometrical footprint. The key feature of the platform is its ability to integrate the ultra-long path lengths by combining low propagation losses in a silicon slab with multiple reflections of the guided wave from photonic crystal (PhC) mirrors. With a reflectivity of 99.1% of our tailored PhC-mirrors, we achieve interaction paths of 25 cm within an area of less than 10 mm2. This corresponds to 0.17 dB/cm effective propagation which is much lower than the state-of-the-art loss of approximately 1 dB/cm of single mode silicon channel waveguides. In contrast to conventional waveguides, our 2D-approach leads to a decay of the guided wave power only inversely proportional to the optical path length. This entirely different characteristic is the major advantage of the 2D integrating cell waveguide platform over the conventional channel waveguide concepts that obey the Beer-Lambert law.

  20. Application of path-integral quantization to indistinguishable particle systems topologically confined by a magnetic field

    Science.gov (United States)

    Jacak, Janusz E.

    2018-01-01

    We demonstrate an original development of path-integral quantization in the case of a multiply connected configuration space of indistinguishable charged particles on a 2D manifold and exposed to a strong perpendicular magnetic field. The system occurs to be exceptionally homotopy-rich and the structure of the homotopy essentially depends on the magnetic field strength resulting in multiloop trajectories at specific conditions. We have proved, by a generalization of the Bohr-Sommerfeld quantization rule, that the size of a magnetic field flux quantum grows for multiloop orbits like (2 k +1 ) h/c with the number of loops k . Utilizing this property for electrons on the 2D substrate jellium, we have derived upon the path integration a complete FQHE hierarchy in excellent consistence with experiments. The path integral has been next developed to a sum over configurations, displaying various patterns of trajectory homotopies (topological configurations), which in the nonstationary case of quantum kinetics, reproduces some unclear formerly details in the longitudinal resistivity observed in experiments.

  1. Integrating cell on chip—Novel waveguide platform employing ultra-long optical paths

    Directory of Open Access Journals (Sweden)

    Lena Simone Fohrmann

    2017-09-01

    Full Text Available Optical waveguides are the most fundamental building blocks of integrated optical circuits. They are extremely well understood, yet there is still room for surprises. Here, we introduce a novel 2D waveguide platform which affords a strong interaction of the evanescent tail of a guided optical wave with an external medium while only employing a very small geometrical footprint. The key feature of the platform is its ability to integrate the ultra-long path lengths by combining low propagation losses in a silicon slab with multiple reflections of the guided wave from photonic crystal (PhC mirrors. With a reflectivity of 99.1% of our tailored PhC-mirrors, we achieve interaction paths of 25 cm within an area of less than 10 mm2. This corresponds to 0.17 dB/cm effective propagation which is much lower than the state-of-the-art loss of approximately 1 dB/cm of single mode silicon channel waveguides. In contrast to conventional waveguides, our 2D-approach leads to a decay of the guided wave power only inversely proportional to the optical path length. This entirely different characteristic is the major advantage of the 2D integrating cell waveguide platform over the conventional channel waveguide concepts that obey the Beer-Lambert law.

  2. i-PI: A Python interface for ab initio path integral molecular dynamics simulations

    Science.gov (United States)

    Ceriotti, Michele; More, Joshua; Manolopoulos, David E.

    2014-03-01

    Recent developments in path integral methodology have significantly reduced the computational expense of including quantum mechanical effects in the nuclear motion in ab initio molecular dynamics simulations. However, the implementation of these developments requires a considerable programming effort, which has hindered their adoption. Here we describe i-PI, an interface written in Python that has been designed to minimise the effort required to bring state-of-the-art path integral techniques to an electronic structure program. While it is best suited to first principles calculations and path integral molecular dynamics, i-PI can also be used to perform classical molecular dynamics simulations, and can just as easily be interfaced with an empirical forcefield code. To give just one example of the many potential applications of the interface, we use it in conjunction with the CP2K electronic structure package to showcase the importance of nuclear quantum effects in high-pressure water. Catalogue identifier: AERN_v1_0 Program summary URL: http://cpc.cs.qub.ac.uk/summaries/AERN_v1_0.html Program obtainable from: CPC Program Library, Queen’s University, Belfast, N. Ireland Licensing provisions: GNU General Public License, version 3 No. of lines in distributed program, including test data, etc.: 138626 No. of bytes in distributed program, including test data, etc.: 3128618 Distribution format: tar.gz Programming language: Python. Computer: Multiple architectures. Operating system: Linux, Mac OSX, Windows. RAM: Less than 256 Mb Classification: 7.7. External routines: NumPy Nature of problem: Bringing the latest developments in the modelling of nuclear quantum effects with path integral molecular dynamics to ab initio electronic structure programs with minimal implementational effort. Solution method: State-of-the-art path integral molecular dynamics techniques are implemented in a Python interface. Any electronic structure code can be patched to receive the atomic

  3. Canonical path-integral measures for Holst and Plebanski gravity: II. Gauge invariance and physical inner product

    International Nuclear Information System (INIS)

    Han Muxin

    2010-01-01

    This paper serves as a continuation for the discussion in Engle et al (2010, Class. Quantum Grav. 27 245014). We analyze the invariance properties of the gravity path-integral measure derived from canonical framework and discuss which path-integral formula may be employed in the concrete computation e.g. constructing a spin-foam model, so that the final model can be interpreted as a physical inner product in the canonical theory. This paper is divided into two parts, the first part is concerning the gauge invariance of the canonical path-integral measure for gravity from the reduced phase space quantization. We show that the path-integral measure is invariant under all the gauge transformations generated by all the constraints. These gauge transformations are the local symmetries of the gravity action, which is implemented without anomaly at the quantum level by the invariant path-integral measure. However, these gauge transformations coincide with the spacetime diffeomorphisms only when the equations of motion are imposed. But the path-integral measure is not invariant under spacetime diffeomorphisms, i.e. the local symmetry of spacetime diffeomorphisms become anomalous in the reduced phase space path-integral quantization. In the second part, we present a path-integral formula, which formally solves all the quantum constraint equations of gravity, and further results in a rigging map in the sense of refined algebraic quantization (RAQ). Then we give a formal path-integral expression of the physical inner product in loop quantum gravity (LQG). This path-integral expression is simpler than the one from reduced phase space quantization, since all the gauge-fixing conditions are removed except the time gauge. The resulting path-integral measure is different from the product Lebesgue measure up to a local measure factor containing both the spacetime volume element and the spatial volume element. This formal path-integral expression of the physical inner product can be

  4. Accurate path integration in continuous attractor network models of grid cells.

    Directory of Open Access Journals (Sweden)

    Yoram Burak

    2009-02-01

    Full Text Available Grid cells in the rat entorhinal cortex display strikingly regular firing responses to the animal's position in 2-D space and have been hypothesized to form the neural substrate for dead-reckoning. However, errors accumulate rapidly when velocity inputs are integrated in existing models of grid cell activity. To produce grid-cell-like responses, these models would require frequent resets triggered by external sensory cues. Such inadequacies, shared by various models, cast doubt on the dead-reckoning potential of the grid cell system. Here we focus on the question of accurate path integration, specifically in continuous attractor models of grid cell activity. We show, in contrast to previous models, that continuous attractor models can generate regular triangular grid responses, based on inputs that encode only the rat's velocity and heading direction. We consider the role of the network boundary in the integration performance of the network and show that both periodic and aperiodic networks are capable of accurate path integration, despite important differences in their attractor manifolds. We quantify the rate at which errors in the velocity integration accumulate as a function of network size and intrinsic noise within the network. With a plausible range of parameters and the inclusion of spike variability, our model networks can accurately integrate velocity inputs over a maximum of approximately 10-100 meters and approximately 1-10 minutes. These findings form a proof-of-concept that continuous attractor dynamics may underlie velocity integration in the dorsolateral medial entorhinal cortex. The simulations also generate pertinent upper bounds on the accuracy of integration that may be achieved by continuous attractor dynamics in the grid cell network. We suggest experiments to test the continuous attractor model and differentiate it from models in which single cells establish their responses independently of each other.

  5. Expressing Solutions of the Dirac Equation in Terms of Feynman Path Integral

    CERN Document Server

    Hose, R D

    2006-01-01

    Using the separation of the variables technique, the free particle solutions of the Dirac equation in the momentum space are shown to be actually providing the definition of Delta function for the Schr dinger picture. Further, the said solution is shown to be derivable on the sole strength of geometrical argument that the Dirac equation for free particle is an equation of a plane in momentum space. During the evolution of time in the Schr dinger picture, the normal to the said Dirac equation plane is shown to be constantly changing in direction due to the uncertainty principle and thereby, leading to a zigzag path for the Dirac particle in the momentum space. Further, the time evolution of the said Delta function solutions of the Dirac equation is shown to provide Feynman integral of all such zigzag paths in the momentum space. Towards the end of the paper, Feynman path integral between two fixed spatial points in the co-ordinate space during a certain time interv! al is shown to be composed, in time sequence...

  6. A quantum generalization of intrinsic reaction coordinate using path integral centroid coordinates

    International Nuclear Information System (INIS)

    Shiga, Motoyuki; Fujisaki, Hiroshi

    2012-01-01

    We propose a generalization of the intrinsic reaction coordinate (IRC) for quantum many-body systems described in terms of the mass-weighted ring polymer centroids in the imaginary-time path integral theory. This novel kind of reaction coordinate, which may be called the ''centroid IRC,'' corresponds to the minimum free energy path connecting reactant and product states with a least amount of reversible work applied to the center of masses of the quantum nuclei, i.e., the centroids. We provide a numerical procedure to obtain the centroid IRC based on first principles by combining ab initio path integral simulation with the string method. This approach is applied to NH 3 molecule and N 2 H 5 - ion as well as their deuterated isotopomers to study the importance of nuclear quantum effects in the intramolecular and intermolecular proton transfer reactions. We find that, in the intramolecular proton transfer (inversion) of NH 3 , the free energy barrier for the centroid variables decreases with an amount of about 20% compared to the classical one at the room temperature. In the intermolecular proton transfer of N 2 H 5 - , the centroid IRC is largely deviated from the ''classical'' IRC, and the free energy barrier is reduced by the quantum effects even more drastically.

  7. The imaginary-time path integral and non-time-reversal-invariant saddle points of the Euclidean action

    International Nuclear Information System (INIS)

    Dasgupta, I.

    1998-01-01

    We discuss new bounce-like (but non-time-reversal-invariant) solutions to Euclidean equations of motion, which we dub boomerons. In the Euclidean path integral approach to quantum theories, boomerons make an imaginary contribution to the vacuum energy. The fake vacuum instability can be removed by cancelling boomeron contributions against contributions from time reversed boomerons (anti-boomerons). The cancellation rests on a sign choice whose significance is not completely understood in the path integral method. (orig.)

  8. Path integral molecular dynamics with surface hopping for thermal equilibrium sampling of nonadiabatic systems.

    Science.gov (United States)

    Lu, Jianfeng; Zhou, Zhennan

    2017-04-21

    In this work, a novel ring polymer representation for a multi-level quantum system is proposed for thermal average calculations. The proposed representation keeps the discreteness of the electronic states: besides position and momentum, each bead in the ring polymer is also characterized by a surface index indicating the electronic energy surface. A path integral molecular dynamics with surface hopping (PIMD-SH) dynamics is also developed to sample the equilibrium distribution of the ring polymer configurational space. The PIMD-SH sampling method is validated theoretically and by numerical examples.

  9. Path-integral calculation of the second virial coefficient including intramolecular flexibility effects

    Energy Technology Data Exchange (ETDEWEB)

    Garberoglio, Giovanni, E-mail: garberoglio@fbk.eu [Interdisciplinary Laboratory for Computational Science (LISC), FBK-CMM and University of Trento, via Sommarive 18, I-38123 Povo (Italy); Jankowski, Piotr [Department of Quantum Chemistry, Faculty of Chemistry, Nicolaus Copernicus University, Gagarina 7, PL-87-100 Toruń (Poland); Szalewicz, Krzysztof [Department of Physics and Astronomy, University of Delaware, Newark, Delaware 19716 (United States); Harvey, Allan H. [Applied Chemicals and Materials Division, National Institute of Standards and Technology, 325 Broadway, Boulder, Colorado 80305-3337 (United States)

    2014-07-28

    We present a path-integral Monte Carlo procedure for the fully quantum calculation of the second molecular virial coefficient accounting for intramolecular flexibility. This method is applied to molecular hydrogen (H{sub 2}) and deuterium (D{sub 2}) in the temperature range 15–2000 K, showing that the effect of molecular flexibility is not negligible. Our results are in good agreement with experimental data, as well as with virials given by recent empirical equations of state, although some discrepancies are observed for H{sub 2} between 100 and 200 K.

  10. Path integral Liouville dynamics: Applications to infrared spectra of OH, water, ammonia, and methane

    International Nuclear Information System (INIS)

    Liu, Jian; Zhang, Zhijun

    2016-01-01

    Path integral Liouville dynamics (PILD) is applied to vibrational dynamics of several simple but representative realistic molecular systems (OH, water, ammonia, and methane). The dipole-derivative autocorrelation function is employed to obtain the infrared spectrum as a function of temperature and isotopic substitution. Comparison to the exact vibrational frequency shows that PILD produces a reasonably accurate peak position with a relatively small full width at half maximum. PILD offers a potentially useful trajectory-based quantum dynamics approach to compute vibrational spectra of molecular systems

  11. Approximate path integral solution for a Dirac particle in a deformed Hulthen potential

    International Nuclear Information System (INIS)

    Kadja, A.; Benamira, F.; Guechi, L.

    2017-01-01

    The problem of a Dirac particle moving in a deformed Hulthen potential is solved in the framework of the path integral formalism. With the help of the Biedenharn transformation, the construction of a closed form for the Green function of the second-order Dirac equation is done by using a proper approximation to the centrifugal term and the Green function of the linear Dirac equation is calculated. The energy spectrum for the bound states is obtained from the poles of the Green function. A Dirac particle in the standard Hulthen potential (q = 1) and a Dirac hydrogen-like ion (q = 1 and a → ∞) are considered as particular cases.

  12. Channel Capacity Calculation at Large SNR and Small Dispersion within Path-Integral Approach

    Science.gov (United States)

    Reznichenko, A. V.; Terekhov, I. S.

    2018-04-01

    We consider the optical fiber channel modelled by the nonlinear Shrödinger equation with additive white Gaussian noise. Using Feynman path-integral approach for the model with small dispersion we find the first nonzero corrections to the conditional probability density function and the channel capacity estimations at large signal-to-noise ratio. We demonstrate that the correction to the channel capacity in small dimensionless dispersion parameter is quadratic and positive therefore increasing the earlier calculated capacity for a nondispersive nonlinear optical fiber channel in the intermediate power region. Also for small dispersion case we find the analytical expressions for simple correlators of the output signals in our noisy channel.

  13. An introduction to stochastic control theory, path integrals and reinforcement learning

    Science.gov (United States)

    Kappen, Hilbert J.

    2007-02-01

    Control theory is a mathematical description of how to act optimally to gain future rewards. In this paper I give an introduction to deterministic and stochastic control theory and I give an overview of the possible application of control theory to the modeling of animal behavior and learning. I discuss a class of non-linear stochastic control problems that can be efficiently solved using a path integral or by MC sampling. In this control formalism the central concept of cost-to-go becomes a free energy and methods and concepts from statistical physics can be readily applied.

  14. Unified path integral approach to theories of diffusion-influenced reactions.

    Science.gov (United States)

    Prüstel, Thorsten; Meier-Schellersheim, Martin

    2017-08-01

    Building on mathematical similarities between quantum mechanics and theories of diffusion-influenced reactions, we develop a general approach for computational modeling of diffusion-influenced reactions that is capable of capturing not only the classical Smoluchowski picture but also alternative theories, as is here exemplified by a volume reactivity model. In particular, we prove the path decomposition expansion of various Green's functions describing the irreversible and reversible reaction of an isolated pair of molecules. To this end, we exploit a connection between boundary value and interaction potential problems with δ- and δ^{'}-function perturbation. We employ a known path-integral-based summation of a perturbation series to derive a number of exact identities relating propagators and survival probabilities satisfying different boundary conditions in a unified and systematic manner. Furthermore, we show how the path decomposition expansion represents the propagator as a product of three factors in the Laplace domain that correspond to quantities figuring prominently in stochastic spatially resolved simulation algorithms. This analysis will thus be useful for the interpretation of current and the design of future algorithms. Finally, we discuss the relation between the general approach and the theory of Brownian functionals and calculate the mean residence time for the case of irreversible and reversible reactions.

  15. The Klauder-Daubechies construction of the phase-space path integral and the harmonic oscillator

    Energy Technology Data Exchange (ETDEWEB)

    Govaerts, Jan; Mattelaer, Olivier [Center for Particle Physics and Phenomenology (CP3), Institut de Physique Nucleaire, Universite catholique de Louvain (UCL), 2, Chemin du Cyclotron, B-1348 Louvain-la-Neuve (Belgium); Bwayi, Calvin Matondo [Department of Physics, University of Kinshasa (UNIKIN), Kinshasa (Congo, The Democratic Republic of the)], E-mail: Jan.Govaerts@uclouvain.be, E-mail: matymatondo@yahoo.fr, E-mail: Olivier.Mattelaer@uclouvain.be

    2009-11-06

    The canonical operator quantization formulation corresponding to the Klauder-Daubechies construction of the phase-space path integral is considered. This formulation is explicitly applied and solved in the case of the harmonic oscillator, thereby illustrating in a manner complementary to Klauder and Daubechies' original work some of the promising features offered by their construction of a quantum dynamics. The Klauder-Daubechies functional integral involves a regularization parameter eventually taken to vanish, which defines a new physical time scale. When extrapolated to the field theory context, besides providing a new regularization of short distance divergences, keeping a finite value for that time scale offers some tantalizing prospects when it comes to strong gravitational quantum systems.

  16. Relations between the EU and Republic of Kosovo - The path of Kosovo integration towards the EU

    Directory of Open Access Journals (Sweden)

    Arif Riza

    2016-07-01

    Full Text Available Almost all the European Union member states have surpassed various challenges toward their integration into the European family. Although all these challenges are special cases on their own, Kosovo’s journey differs from the above mentioned cases, because Kosovo has not been recognized as an independent state by some members of the European family. The other key element that differs Kosovo’s journey from other cases is the presence of international institutions such as: EULEX, ICO, UNMIK, KFOR etc. in Kosovo’s territory. These organizations were not present in other member states of the European Union and other countries which aim for European integration. This manuscript aims to analyze the Kosovo challenges in its path towards the European family, which is only possible if Kosovo can create sustainable politics and cause fundamental changes in all fields, whether in public or private institutions, in order to build the rule of law. In general, this article will discuss the presence of international institutions in Kosovo such as: EULEX, ICO, UNMIK, KFOR and other international organizations, their effects on the rule of law, economic development and the sustainability of institutions. Moreover, this paper will particularly analyze the influence of the above mentioned factors to ease Kosovo’s path, as an observed country, compared to other countries in the region.

  17. Path-integral description of combined Hamiltonian and non-Hamiltonian dynamics in quantum dissipative systems

    Science.gov (United States)

    Barth, A. M.; Vagov, A.; Axt, V. M.

    2016-09-01

    We present a numerical path-integral iteration scheme for the low-dimensional reduced density matrix of a time-dependent quantum dissipative system. Our approach simultaneously accounts for the combined action of a microscopically modeled pure-dephasing-type coupling to a continuum of harmonic oscillators representing, e.g., phonons, and further environmental interactions inducing non-Hamiltonian dynamics in the inner system represented, e.g., by Lindblad-type dissipation or relaxation. Our formulation of the path-integral method allows for a numerically exact treatment of the coupling to the oscillator modes and moreover is general enough to provide a natural way to include Markovian processes that are sufficiently described by rate equations. We apply this new formalism to a model of a single semiconductor quantum dot which includes the coupling to longitudinal acoustic phonons for two cases: (a) external laser excitation taking into account a phenomenological radiative decay of the excited dot state and (b) a coupling of the quantum dot to a single mode of an optical cavity taking into account cavity photon losses.

  18. [Application of clinical nursing path integrated with holistic nursing in advanced schistosomiasis patients with ascites].

    Science.gov (United States)

    Mei-Zhi, Yuan; Jing-Ru, Sun; Tao, Chen; Xiao-Yu, Zhang; Liang-Cai, He; Jia-Song, Wang

    2016-05-12

    To evaluate the effect of the clinical nursing path integrated with the holistic nursing on advanced schistosomiasis patients with ascites. A total of 226 advanced schistosomiasis patients with ascites were randomly divided into a control group and an experimental group (113 cases each group). The subjects in the experimental group were nursed by the clinical nursing path integrated with the holistic nursing, while those in the control group were nursed only by the holistic nursing. Then the clinical relevant indexes of the two groups were observed, and the quality of life of the patients before and after hospital discharge was assessed. The improvement rate, satisfaction degree, and awareness rate of health knowledge of the patients in the experiment group were 93.8%, 100% and 97.4%, respectively, which were significantly higher than those of the control group (all P holistic nursing can effectively improve the improvement rate and decrease the mortality of the advanced schistosomiasis patients with ascites; meanwhile, it can shorten the hospitalization time and save the hospitalization cost. Therefore, this nursing model is suitable for popularization and application in the treatment and nursing work of the advanced schistosomiasis assistance.

  19. Liouville action as path-integral complexity: from continuous tensor networks to AdS/CFT

    Science.gov (United States)

    Caputa, Pawel; Kundu, Nilay; Miyaji, Masamichi; Takayanagi, Tadashi; Watanabe, Kento

    2017-11-01

    We propose an optimization procedure for Euclidean path-integrals that evaluate CFT wave functionals in arbitrary dimensions. The optimization is performed by minimizing certain functional, which can be interpreted as a measure of computational complexity, with respect to background metrics for the path-integrals. In two dimensional CFTs, this functional is given by the Liouville action. We also formulate the optimization for higher dimensional CFTs and, in various examples, find that the optimized hyperbolic metrics coincide with the time slices of expected gravity duals. Moreover, if we optimize a reduced density matrix, the geometry becomes two copies of the entanglement wedge and reproduces the holographic entanglement entropy. Our approach resembles a continuous tensor network renormalization and provides a concrete realization of the proposed interpretation of AdS/CFT as tensor networks. The present paper is an extended version of our earlier report arXiv:1703.00456 and includes many new results such as evaluations of complexity functionals, energy stress tensor, higher dimensional extensions and time evolutions of thermofield double states.

  20. A path integral for heavy-quarks in a hot plasma

    CERN Document Server

    Beraudo, A.; Faccioli, P.; Garberoglio, G.; 10.1016/j.nuclphysa.2010.06.007

    2010-01-01

    We propose a model for the propagation of a heavy-quark in a hot plasma, to be viewed as a first step towards a full description of the dynamics of heavy quark systems in a quark-gluon plasma, including bound state formation. The heavy quark is treated as a non relativistic particle interacting with a fluctuating field, whose correlator is determined by a hard thermal loop approximation. This approximation, which concerns only the medium in which the heavy quark propagates, is the only one that is made, and it can be improved. The dynamics of the heavy quark is given exactly by a quantum mechanical path integral that is calculated in this paper in the Euclidean space-time using numerical Monte Carlo techniques. The spectral function of the heavy quark in the medium is then reconstructed using a Maximum Entropy Method. The path integral is also evaluated exactly in the case where the mass of the heavy quark is infinite; one then recovers known results concerning the complex optical potential that controls the ...

  1. Path integral approach for electron transport in disturbed magnetic field lines

    International Nuclear Information System (INIS)

    Kanno, Ryutaro; Nakajima, Noriyoshi; Takamaru, Hisanori

    2002-05-01

    A path integral method is developed to investigate statistical property of an electron transport described as a Langevin equation in a statically disturbed magnetic field line structure; especially a transition probability of electrons strongly tied to field lines is considered. The path integral method has advantages that 1) it does not include intrinsically a growing numerical error of an orbit, which is caused by evolution of the Langevin equation under a finite calculation accuracy in a chaotic field line structure, and 2) it gives a method of understanding the qualitative content of the Langevin equation and assists to expect statistical property of the transport. Monte Carlo calculations of the electron distributions under both effects of chaotic field lines and collisions are demonstrated to comprehend above advantages through some examples. The mathematical techniques are useful to study statistical properties of various phenomena described as Langevin equations in general. By using parallel generators of random numbers, the Monte Carlo scheme to calculate a transition probability can be suitable for a parallel computation. (author)

  2. Path integral representation of Lorentzian spinfoam model, asymptotics and simplicial geometries

    International Nuclear Information System (INIS)

    Han, Muxin; Krajewski, Thomas

    2014-01-01

    A new path integral representation of Lorentzian Engle–Pereira–Rovelli–Livine spinfoam model is derived by employing the theory of unitary representation of SL(2,C). The path integral representation is taken as a starting point of semiclassical analysis. The relation between the spinfoam model and classical simplicial geometry is studied via the large-spin asymptotic expansion of the spinfoam amplitude with all spins uniformly large. More precisely, in the large-spin regime, there is an equivalence between the spinfoam critical configuration (with certain nondegeneracy assumption) and a classical Lorentzian simplicial geometry. Such an equivalence relation allows us to classify the spinfoam critical configurations by their geometrical interpretations, via two types of solution-generating maps. The equivalence between spinfoam critical configuration and simplical geometry also allows us to define the notion of globally oriented and time-oriented spinfoam critical configuration. It is shown that only at the globally oriented and time-oriented spinfoam critical configuration, the leading-order contribution of spinfoam large-spin asymptotics gives precisely an exponential of Lorentzian Regge action of General Relativity. At all other (unphysical) critical configurations, spinfoam large-spin asymptotics modifies the Regge action at the leading-order approximation. (paper)

  3. Maximally-localized position, Euclidean path-integral, and thermodynamics in GUP quantum mechanics

    Science.gov (United States)

    Bernardo, Reginald Christian S.; Esguerra, Jose Perico H.

    2018-04-01

    In dealing with quantum mechanics at very high energies, it is essential to adapt to a quasiposition representation using the maximally-localized states because of the generalized uncertainty principle. In this paper, we look at maximally-localized states as eigenstates of the operator ξ = X + iβP that we refer to as the maximally-localized position. We calculate the overlap between maximally-localized states and show that the identity operator can be expressed in terms of the maximally-localized states. Furthermore, we show that the maximally-localized position is diagonal in momentum-space and that the maximally-localized position and its adjoint satisfy commutation and anti-commutation relations reminiscent of the harmonic oscillator commutation and anti-commutation relations. As application, we use the maximally-localized position in developing the Euclidean path-integral and introduce the compact form of the propagator for maximal localization. The free particle momentum-space propagator and the propagator for maximal localization are analytically evaluated up to quadratic-order in β. Finally, we obtain a path-integral expression for the partition function of a thermodynamic system using the maximally-localized states. The partition function of a gas of noninteracting particles is evaluated. At temperatures exceeding the Planck energy, we obtain the gas' maximum internal energy N / 2 β and recover the zero heat capacity of an ideal gas.

  4. A reductionist perspective on quantum statistical mechanics: Coarse-graining of path integrals.

    Science.gov (United States)

    Sinitskiy, Anton V; Voth, Gregory A

    2015-09-07

    Computational modeling of the condensed phase based on classical statistical mechanics has been rapidly developing over the last few decades and has yielded important information on various systems containing up to millions of atoms. However, if a system of interest contains important quantum effects, well-developed classical techniques cannot be used. One way of treating finite temperature quantum systems at equilibrium has been based on Feynman's imaginary time path integral approach and the ensuing quantum-classical isomorphism. This isomorphism is exact only in the limit of infinitely many classical quasiparticles representing each physical quantum particle. In this work, we present a reductionist perspective on this problem based on the emerging methodology of coarse-graining. This perspective allows for the representations of one quantum particle with only two classical-like quasiparticles and their conjugate momenta. One of these coupled quasiparticles is the centroid particle of the quantum path integral quasiparticle distribution. Only this quasiparticle feels the potential energy function. The other quasiparticle directly provides the observable averages of quantum mechanical operators. The theory offers a simplified perspective on quantum statistical mechanics, revealing its most reductionist connection to classical statistical physics. By doing so, it can facilitate a simpler representation of certain quantum effects in complex molecular environments.

  5. Quantum mechanics 1. Path-integral formulation and operator formalism; Quantenmechanik 1. Pfadintegralformulierung und Operatorformalismus

    Energy Technology Data Exchange (ETDEWEB)

    Reinhardt, Hugo [Tuebingen Univ. (Germany). Inst. fuer Theoretische Physik

    2012-11-01

    The first volume of this two-volume textbook gives a modern introduction to the quantum theory, which connects Feynman's path-integral formulation with the traditional operator formalism. In easily understandable form starting from the double-slit experiment the characteristic features and foundations of quantum theory are made accessible by means of the functional-integral approach. Just this approach makes a ''derivation'' of the Schroedinger equation from the principle of the interfering alternatives possible. In the following the author developes the traditional operator formulation of quantum mechanics, which is better suited for practical solution of elementary problems. However he then refers to the functional-integral approach, when this contributes to a better understanding. A further advance of this concept: The functional-integral approach facilitates essentially the later access to quantum field theory. The work is in like manner suited for the self-study as for the deepening accompanying of the course.

  6. Numerical calculations of the probabilities for quantum transitions in atoms and molecules by the path integral method

    Science.gov (United States)

    Biryukov, Alexander; Degtyareva, Yana

    2017-10-01

    The probabilities of molecular quantum transitions induced by electromagnetic field are expressed as path integrals of a real alternating functional. We propose a new method for computing these integrals by means of recurrence relations. We apply this approach to description of the two-photon Rabi oscillations.

  7. Real-time Feynman path integral with Picard–Lefschetz theory and its applications to quantum tunneling

    Energy Technology Data Exchange (ETDEWEB)

    Tanizaki, Yuya, E-mail: yuya.tanizaki@riken.jp [Department of Physics, The University of Tokyo, Tokyo 113-0033 (Japan); Theoretical Research Division, Nishina Center, RIKEN, Wako 351-0198 (Japan); Koike, Takayuki, E-mail: tkoike@ms.u-tokyo.ac.jp [Graduate School of Mathematical Sciences, The University of Tokyo, Tokyo 153-8914 (Japan)

    2014-12-15

    Picard–Lefschetz theory is applied to path integrals of quantum mechanics, in order to compute real-time dynamics directly. After discussing basic properties of real-time path integrals on Lefschetz thimbles, we demonstrate its computational method in a concrete way by solving three simple examples of quantum mechanics. It is applied to quantum mechanics of a double-well potential, and quantum tunneling is discussed. We identify all of the complex saddle points of the classical action, and their properties are discussed in detail. However a big theoretical difficulty turns out to appear in rewriting the original path integral into a sum of path integrals on Lefschetz thimbles. We discuss generality of that problem and mention its importance. Real-time tunneling processes are shown to be described by those complex saddle points, and thus semi-classical description of real-time quantum tunneling becomes possible on solid ground if we could solve that problem. - Highlights: • Real-time path integral is studied based on Picard–Lefschetz theory. • Lucid demonstration is given through simple examples of quantum mechanics. • This technique is applied to quantum mechanics of the double-well potential. • Difficulty for practical applications is revealed, and we discuss its generality. • Quantum tunneling is shown to be closely related to complex classical solutions.

  8. The difficulties in the mathematical definition of path integrals are overcome in the theory of continuous quantum measurements

    International Nuclear Information System (INIS)

    Menskii, M.B.

    1993-01-01

    Any real physical process takes place in an external (with respect to the investigated system) medium whose state reflects information about the behavior of the system. Therefore, a real model of any process must include a description of the measurement process. This has the consequence that the dynamics of a real system contains both quantum and classical elements. Mathematically, a quantum system subject to continuous measurement can be described by a restricted path integral. The Feynman path integral that is usually employed is an idealization that is not correct in all cases. In a real situation in which the path integral is restricted, the difficulties associated with the mathematical definition of the path integral disappear. These difficulties are a consequence of an unphysical idealization - the neglect of the fact that some information about the behavior of the quantum system remains in classical form in the environment. The aim of this paper is to show that the well-known difficulties in the mathematically rigorous definition of path integrals disappear if allowance is made for the specific interaction of a quantum system with its environment in which information about the state of the system is extracted. The consequences are evaluated of establishing the changes resulting from giving up the ideal model of an isolated system and accepting that some information about the behavior of the system remains outside it in classical form. 16 refs

  9. Multi-Objective Climb Path Optimization for Aircraft/Engine Integration Using Particle Swarm Optimization

    Directory of Open Access Journals (Sweden)

    Aristeidis Antonakis

    2017-04-01

    Full Text Available In this article, a new multi-objective approach to the aircraft climb path optimization problem, based on the Particle Swarm Optimization algorithm, is introduced to be used for aircraft–engine integration studies. This considers a combination of a simulation with a traditional Energy approach, which incorporates, among others, the use of a proposed path-tracking scheme for guidance in the Altitude–Mach plane. The adoption of population-based solver serves to simplify case setup, allowing for direct interfaces between the optimizer and aircraft/engine performance codes. A two-level optimization scheme is employed and is shown to improve search performance compared to the basic PSO algorithm. The effectiveness of the proposed methodology is demonstrated in a hypothetic engine upgrade scenario for the F-4 aircraft considering the replacement of the aircraft’s J79 engine with the EJ200; a clear advantage of the EJ200-equipped configuration is unveiled, resulting, on average, in 15% faster climbs with 20% less fuel.

  10. Improving the variational path integral approach to the quantum double-well potential

    International Nuclear Information System (INIS)

    Bao Jingdong; Wang Hongyu

    2002-01-01

    An improved variational path integral approach is developed and applied to the quantum double-well potential, in which part of the quartic term of the potential is included in the trial action. The expression of the effective classical potential (ECP) under a non-Gaussian expectation is obtained. Here the frequency and fourth-order derivative of the potential are treated as two variational parameters, determined by the minimization of the ECP at each point. We calculate the ECP, the free energy and the level splitting of a symmetrical double-well potential. It is shown that the present results are better than those of the Feynman-Kleinert Gaussian variational method. (author)

  11. Methane optical density measurements with an integrated path differential absorption lidar from an airborne platform

    Science.gov (United States)

    Riris, Haris; Numata, Kenji; Wu, Stewart; Gonzalez, Brayler; Rodriguez, Michael; Scott, Stan; Kawa, Stephan; Mao, Jianping

    2017-07-01

    We report on an airborne demonstration of atmospheric methane (CH4) measurements with an integrated path differential absorption lidar using an optical parametric amplifier and optical parametric oscillator laser transmitter and sensitive avalanche photodiode detector. The lidar measures the atmospheric CH4 absorption at multiple, discrete wavelengths near 1650.96 nm. The instrument was deployed in the fall of 2015, aboard NASA's DC-8 airborne laboratory along with an in situ spectrometer and measured CH4 over a wide range of surfaces and atmospheric conditions from altitudes of 2 to 13 km. We will show the results from our flights, compare the performance of the two laser transmitters, and identify areas of improvement for the lidar.

  12. Path Integral Quantum Mechanics in Curved Space-Time a New Perspective

    Science.gov (United States)

    Singh, Dinesh; Mobed, Nader

    2012-07-01

    A new approach to path integral quantum mechanics in curved space-time for a scalar particle is presented in terms of local curvature involving Fermi or Riemann normal co-ordinates. This approach involves use of a local time translation operator with Lie transport that, while strictly non-unitary in form, nonetheless yields the correct expression for the curved space-time free-particle Lagrangian in the sum-over-histories, with additional terms corresponding to a curvature-dependent violation of probability. These terms simultaneously induce a breakdown of time-reversal symmetry at the quantum mechanical level, and also a violation of the weak equivalence principle at the particle's Compton wavelength scale. Furthermore, the scalar propagator generates a gravitational analogue of the Aharonov-Bohm effect and Berry's phase through the appearance of an overall gauge-invariant phase factor. Future directions to follow from this initial research are presented.

  13. Low-temperature metallic liquid hydrogen: an ab-initio path-integral molecular dynamics perspective

    Science.gov (United States)

    Chen, Ji; Li, Xin-Zheng; Zhang, Qianfan; Probert, Matthew; Pickard, Chris; Needs, Richard; Michaelides, Angelos; Wang, Enge

    2013-03-01

    Experiments and computer simulations have shown that the melting temperature of solid hydrogen drops with pressure above about 65 GPa, suggesting that a low temperature liquid state might exist. It has also been suggested that this liquid state might be non-molecular and metallic, although evidence for such behaviour is lacking. Using a combination of ab initio path-integral molecular dynamics and the two-phase methods, we have simulated the melting of solid hydrogen under finite temperatures. We found an atomic solid phase from 500 to 800 GPa which melts at < 200 K. Beyond this and up to pressures of 1,200 GPa a metallic atomic liquid is stable at temperatures as low as 50 K. The quantum motion of the protons is critical to the low melting temperature in this system as ab initio simulations with classical nuclei lead to a considerably higher melting temperature of ~300 K across the entire pressure range considered.

  14. Exact path-integral evaluation of locally interacting systems: The subtlety of operator ordering

    Science.gov (United States)

    Taniguchi, Nobuhiko

    2017-10-01

    We discuss how one calculates the coherent path integrals for locally interacting systems, where some inconsistencies with exact results have been reported previously. It is shown that the operator ordering subtlety that is hidden in the local interaction term modifies the Hubbard-Stratonovich transformation in the continuous time formulation, and it helps reproduce known results by the operator method. We also demonstrate that many-body effects in the strong interaction limit can be well characterized by the free-particle theory that is subject to annealed random potentials and dynamical gauge (or phase) fields. The present treatment expands the conventional paradigm of the one-particle description, and it provides a simple, viable picture for strongly correlated materials of either bosonic or fermionic systems.

  15. Accelerating the convergence of path integral dynamics with a generalized Langevin equation

    Science.gov (United States)

    Ceriotti, Michele; Manolopoulos, David E.; Parrinello, Michele

    2011-02-01

    The quantum nature of nuclei plays an important role in the accurate modelling of light atoms such as hydrogen, but it is often neglected in simulations due to the high computational overhead involved. It has recently been shown that zero-point energy effects can be included comparatively cheaply in simulations of harmonic and quasiharmonic systems by augmenting classical molecular dynamics with a generalized Langevin equation (GLE). Here we describe how a similar approach can be used to accelerate the convergence of path integral (PI) molecular dynamics to the exact quantum mechanical result in more strongly anharmonic systems exhibiting both zero point energy and tunnelling effects. The resulting PI-GLE method is illustrated with applications to a double-well tunnelling problem and to liquid water.

  16. Accelerating the convergence of path integral dynamics with a generalized Langevin equation.

    Science.gov (United States)

    Ceriotti, Michele; Manolopoulos, David E; Parrinello, Michele

    2011-02-28

    The quantum nature of nuclei plays an important role in the accurate modelling of light atoms such as hydrogen, but it is often neglected in simulations due to the high computational overhead involved. It has recently been shown that zero-point energy effects can be included comparatively cheaply in simulations of harmonic and quasiharmonic systems by augmenting classical molecular dynamics with a generalized Langevin equation (GLE). Here we describe how a similar approach can be used to accelerate the convergence of path integral (PI) molecular dynamics to the exact quantum mechanical result in more strongly anharmonic systems exhibiting both zero point energy and tunnelling effects. The resulting PI-GLE method is illustrated with applications to a double-well tunnelling problem and to liquid water.

  17. Methane optical density measurements with an integrated path differential absorption lidar from an airborne platform.

    Science.gov (United States)

    Riris, Haris; Numata, Kenji; Wu, Stewart; Gonzalez, Brayler; Rodriguez, Michael; Scott, Stan; Kawa, Stephan; Mao, Jianping

    2017-07-01

    We report on an airborne demonstration of atmospheric methane (CH 4 ) measurements with an Integrated Path Differential Absorption (IPDA) lidar using an optical parametric amplifier (OPA) and optical parametric oscillator (OPO) laser transmitter and sensitive avalanche photodiode detector. The lidar measures the atmospheric CH 4 absorption at multiple, discrete wavelengths near 1650.96 nm. The instrument was deployed in the fall of 2015, aboard NASA's DC-8 airborne laboratory along with an in-situ spectrometer and measured CH 4 over a wide range of surfaces and atmospheric conditions from altitudes of 2 km to 13 km. In this paper, we will show the results from our flights, compare the performance of the two laser transmitters, and identify areas of improvement for the lidar.

  18. Excitonic effects in two-dimensional semiconductors: Path integral Monte Carlo approach

    Energy Technology Data Exchange (ETDEWEB)

    Velizhanin, Kirill A.; Saxena, Avadh

    2015-11-01

    One of the most striking features of novel two-dimensional semiconductors (e.g., transition metal dichalcogenide monolayers or phosphorene) is a strong Coulomb interaction between charge carriers resulting in large excitonic effects. In particular, this leads to the formation of multicarrier bound states upon photoexcitation (e.g., excitons, trions, and biexcitons), which could remain stable at near-room temperatures and contribute significantly to the optical properties of such materials. In the present work we have used the path integral Monte Carlo methodology to numerically study properties of multicarrier bound states in two-dimensional semiconductors. Specifically, we have accurately investigated and tabulated the dependence of single-exciton, trion, and biexciton binding energies on the strength of dielectric screening, including the limiting cases of very strong and very weak screening. The results of this work are potentially useful in the analysis of experimental data and benchmarking of theoretical and computational models.

  19. Optimal multigrid algorithms for the massive Gaussian model and path integrals

    International Nuclear Information System (INIS)

    Brandt, A.; Galun, M.

    1996-01-01

    Multigrid algorithms are presented which, in addition to eliminating the critical slowing down, can also eliminate the open-quotes volume factorclose quotes. The elimination of the volume factor removes the need to produce many independent fine-grid configurations for averaging out their statistical deviations, by averaging over the many samples produced on coarse grids during the multigrid cycle. Thermodynamic limits of observables can be calculated to relative accuracy var-epsilon r in just O(var-epsilon r -2 ) computer operations, where var-epsilon r is the error relative to the standard deviation of the observable. In this paper, we describe in detail the calculation of the susceptibility in the one-dimensional massive Gaussian model, which is also a simple example of path integrals. Numerical experiments show that the susceptibility can be calculated to relative accuracy var-epsilon r in about 8 var-epsilon r -2 random number generations, independent of the mass size

  20. Harmonic-phase path-integral approximation of thermal quantum correlation functions

    Science.gov (United States)

    Robertson, Christopher; Habershon, Scott

    2018-03-01

    We present an approximation to the thermal symmetric form of the quantum time-correlation function in the standard position path-integral representation. By transforming to a sum-and-difference position representation and then Taylor-expanding the potential energy surface of the system to second order, the resulting expression provides a harmonic weighting function that approximately recovers the contribution of the phase to the time-correlation function. This method is readily implemented in a Monte Carlo sampling scheme and provides exact results for harmonic potentials (for both linear and non-linear operators) and near-quantitative results for anharmonic systems for low temperatures and times that are likely to be relevant to condensed phase experiments. This article focuses on one-dimensional examples to provide insights into convergence and sampling properties, and we also discuss how this approximation method may be extended to many-dimensional systems.

  1. Fragmentation function in non-equilibrium QCD using closed-time path integral formalism

    International Nuclear Information System (INIS)

    Nayak, Gouranga C.

    2009-01-01

    In this paper we implement the Schwinger-Keldysh closed-time path integral formalism in non-equilibrium QCD in accordance to the definition of the Collins-Soper fragmentation function. We consider a high-p T parton in QCD medium at initial time τ 0 with an arbitrary non-equilibrium (non-isotropic) distribution function f(vector (p)) fragmenting to a hadron. We formulate the parton-to-hadron fragmentation function in non-equilibrium QCD in the light-cone quantization formalism. It may be possible to include final-state interactions with the medium via a modification of the Wilson lines in this definition of the non-equilibrium fragmentation function. This may be relevant to the study of hadron production from a quark-gluon plasma at RHIC and LHC. (orig.)

  2. Airborne 2-Micron Double-Pulsed Integrated Path Differential Absorption Lidar for Column CO2 Measurement

    Science.gov (United States)

    Singh, Upendra N.; Yu, Jirong; Petros, Mulugeta; Refaat, Tamer F.; Remus, Ruben G.; Fay, James J.; Reithmaier, Karl

    2014-01-01

    Double-pulse 2-micron lasers have been demonstrated with energy as high as 600 millijouls and up to 10 Hz repetition rate. The two laser pulses are separated by 200 microseconds and can be tuned and locked separately. Applying double-pulse laser in DIAL system enhances the CO2 measurement capability by increasing the overlap of the sampled volume between the on-line and off-line. To avoid detection complicity, integrated path differential absorption (IPDA) lidar provides higher signal-to-noise ratio measurement compared to conventional range-resolved DIAL. Rather than weak atmospheric scattering returns, IPDA rely on the much stronger hard target returns that is best suited for airborne platforms. In addition, the IPDA technique measures the total integrated column content from the instrument to the hard target but with weighting that can be tuned by the transmitter. Therefore, the transmitter could be tuned to weight the column measurement to the surface for optimum CO2 interaction studies or up to the free troposphere for optimum transport studies. Currently, NASA LaRC is developing and integrating a double-Pulsed 2-micron direct detection IPDA lidar for CO2 column measurement from an airborne platform. The presentation will describe the development of the 2-micron IPDA lidar system and present the airborne measurement of column CO2 and will compare to in-situ measurement for various ground target of different reflectivity.

  3. Path-integral in collective variables and its application to nuclear and hadron physics

    International Nuclear Information System (INIS)

    Pervushin, V.N.; Rajnkhardt, Kh.; Ehbert, D.

    1979-01-01

    The application of functional integrals to describe collective degrees of freedom in different fields of physics is reviewed for the period since 1965. The application of path integrals to the schematic model of nuclear multiparticle systems with pairing and particle-hole forces permits to lay strict foundations under the so called theory of nuclear field, which hitherto was proved euristically. The Abel gauge theory of interacting massless quarks and vector gluons is described. In this model radiative corrections cause spontaneous dynamic breaking of the chiral γ 5 -invariance. The application of functional integration to two-dimensional quantum chromodynamics is also analyzed. It is shown that the local quark-gluon theory can be transformed in an infinite-component nonpolynomial field theory in terms of colourless bound states - mesons. A modified perturbation theory appears in the form of 1/Nsub(c)-expansion (Nsub(c) - number of quarks), that is formally is very akin to the 1/Ω-expansion (Ωdegeneracy of single-particle states) in the theory of nuclear field

  4. Airborne 2-micron double-pulsed integrated path differential absorption lidar for column CO2 measurement

    Science.gov (United States)

    Singh, Upendra N.; Yu, Jirong; Petros, Mulugeta; Refaat, Tamer F.; Remus, Ruben G.; Fay, James J.; Reithmaier, Karl

    2014-10-01

    Double-pulse 2-micron lasers have been demonstrated with energy as high as 600 mJ and up to 10 Hz repetition rate. The two laser pulses are separated by 200 µs and can be tuned and locked separately. Applying double-pulse laser in DIAL system enhances the CO2 measurement capability by increasing the overlap of the sampled volume between the on-line and off-line. To avoid detection complicity, integrated path differential absorption (IPDA) lidar provides higher signal-to-noise ratio measurement compared to conventional range-resolved DIAL. Rather than weak atmospheric scattering returns, IPDA rely on the much stronger hard target returns that is best suited for airborne platforms. In addition, the IPDA technique measures the total integrated column content from the instrument to the hard target but with weighting that can be tuned by the transmitter. Therefore, the transmitter could be tuned to weight the column measurement to the surface for optimum CO2 interaction studies or up to the free troposphere for optimum transport studies. Currently, NASA LaRC is developing and integrating a double-Pulsed 2-µm direct detection IPDA lidar for CO2 column measurement from an airborne platform. The presentation will describe the development of the 2-μm IPDA lidar system and present the airborne measurement of column CO2 and will compare to in-situ measurement for various ground target of different reflectivity.

  5. Perturbed path integrals in imaginary time: Efficiently modeling nuclear quantum effects in molecules and materials

    Science.gov (United States)

    Poltavsky, Igor; DiStasio, Robert A.; Tkatchenko, Alexandre

    2018-03-01

    Nuclear quantum effects (NQE), which include both zero-point motion and tunneling, exhibit quite an impressive range of influence over the equilibrium and dynamical properties of molecules and materials. In this work, we extend our recently proposed perturbed path-integral (PPI) approach for modeling NQE in molecular systems [I. Poltavsky and A. Tkatchenko, Chem. Sci. 7, 1368 (2016)], which successfully combines the advantages of thermodynamic perturbation theory with path-integral molecular dynamics (PIMD), in a number of important directions. First, we demonstrate the accuracy, performance, and general applicability of the PPI approach to both molecules and extended (condensed-phase) materials. Second, we derive a series of estimators within the PPI approach to enable calculations of structural properties such as radial distribution functions (RDFs) that exhibit rapid convergence with respect to the number of beads in the PIMD simulation. Finally, we introduce an effective nuclear temperature formalism within the framework of the PPI approach and demonstrate that such effective temperatures can be an extremely useful tool in quantitatively estimating the "quantumness" associated with different degrees of freedom in the system as well as providing a reliable quantitative assessment of the convergence of PIMD simulations. Since the PPI approach only requires the use of standard second-order imaginary-time PIMD simulations, these developments enable one to include a treatment of NQE in equilibrium thermodynamic properties (such as energies, heat capacities, and RDFs) with the accuracy of higher-order methods but at a fraction of the computational cost, thereby enabling first-principles modeling that simultaneously accounts for the quantum mechanical nature of both electrons and nuclei in large-scale molecules and materials.

  6. Sensitivity study of optimal CO2 emission paths using a simplified structural integrated assessment model (SIAM)

    International Nuclear Information System (INIS)

    Hasselmann, K.; Hasselmann, S.; Giering, R.; Ocana, V.; Storch, H. von

    1997-01-01

    A structurally highly simplified, globally integrated coupled climate-economic costs model SIAM (Structural Integrated Assessment Model) is used to compute optimal paths of global CO 2 emissions that minimize the net sum of climate damage and mitigation costs. It studies the sensitivity of the computed optimal emission paths. The climate module is represented by a linearized impulse-response model calibrated against a coupled ocean-atmosphere general circulation climate model and a three-dimensional global carbon-cycle model. The cost terms are presented by expressions designed with respect to input assumptions. These include the discount rates for mitigation and damage costs, the inertia of the socio-economic system, and the dependence of climate damages on the changes in temperature and the rate of change of temperature. Different assumptions regarding these parameters are believed to cause the marked divergences of existing cost-benefit analyses. The long memory of the climate system implies that very long time horizons of several hundred years need to be considered to optimize CO 2 emissions on time scales relevant for a policy of sustainable development. Cost-benefit analyses over shorter time scales of a century or two can lead to dangerous underestimates of the long term climate impact of increasing greenhouse-gas emissions. To avert a major long term global warming, CO 2 emissions need to be reduced ultimately to very low levels. This may be done slowly but should not be interpreted as providing a time cushion for inaction: the transition becomes more costly the longer the necessary mitigation policies are delayed. However, the long time horizon provides adequate flexibility for later adjustments. Short term energy conservation alone is insufficient and can be viewed only as a useful measure in support of the necessary long term transition to carbon-free energy technologies. 46 refs., 9 figs., 2 tabs

  7. Triple-Pulsed Two-Micron Integrated Path Differential Absorption Lidar: A New Active Remote Sensing Capability with Path to Space

    Science.gov (United States)

    Singh, Upendra N.; Refaat, Tamer F.; Petros, Mulugeta; Yu, Jirong

    2015-01-01

    The two-micron wavelength is suitable for monitoring atmospheric water vapor and carbon dioxide, the two most dominant greenhouse gases. Recent advances in 2-micron laser technology paved the way for constructing state-of-the-art lidar transmitters for active remote sensing applications. In this paper, a new triple-pulsed 2-micron integrated path differential absorption lidar is presented. This lidar is capable of measuring either two species or single specie with two different weighting functions, simultaneously and independently. Development of this instrument is conducted at NASA Langley Research Center. Instrument scaling for projected future space missions will be discussed.

  8. PathText: a text mining integrator for biological pathway visualizations

    Science.gov (United States)

    Kemper, Brian; Matsuzaki, Takuya; Matsuoka, Yukiko; Tsuruoka, Yoshimasa; Kitano, Hiroaki; Ananiadou, Sophia; Tsujii, Jun'ichi

    2010-01-01

    Motivation: Metabolic and signaling pathways are an increasingly important part of organizing knowledge in systems biology. They serve to integrate collective interpretations of facts scattered throughout literature. Biologists construct a pathway by reading a large number of articles and interpreting them as a consistent network, but most of the models constructed currently lack direct links to those articles. Biologists who want to check the original articles have to spend substantial amounts of time to collect relevant articles and identify the sections relevant to the pathway. Furthermore, with the scientific literature expanding by several thousand papers per week, keeping a model relevant requires a continuous curation effort. In this article, we present a system designed to integrate a pathway visualizer, text mining systems and annotation tools into a seamless environment. This will enable biologists to freely move between parts of a pathway and relevant sections of articles, as well as identify relevant papers from large text bases. The system, PathText, is developed by Systems Biology Institute, Okinawa Institute of Science and Technology, National Centre for Text Mining (University of Manchester) and the University of Tokyo, and is being used by groups of biologists from these locations. Contact: brian@monrovian.com. PMID:20529930

  9. Path integral studies of the rotations of methane and its heavier isotopomers in 4He nanoclusters.

    Science.gov (United States)

    Markovskiy, N D; Mak, C H

    2009-08-13

    Path integral Monte Carlo simulations have been carried out to study the rotations of a methane molecule and its heavier isotopomers inside a small cluster of 4He atoms at 0.3 K in order to determine how the renormalization in the methane's rotational constant is related to the quantum statistics and superfluidity of the helium shell. By changing the mass of the hydrogens and systematically varying the moment of inertia of the methane, we were able to study the effects of its rotations on the quantum statistics of the helium atoms and their countereffects on the methane's effective rotational constant. The renormalized rotational constant depends strongly on the intrinsic moment of inertia of the methane. A heavy probe favors strong templating of the helium density as well as a large renormalization in the probe's rotational constant, but a light probe shows almost no effect on the shell density or the effective rotational constant. These results suggest that in order to fully understand the superfluidity of the helium shell, the probe must be treated as an integral part of the system. We rationalize the findings in terms of a rotational smearing effect and suggest that there is no clearly quantifiable relationship between the superfluid fraction of the shell and the renormalized rotational constant of the probe for cases where the probe molecule is either light or has weak anisotropic interactions with the helium atoms.

  10. From organizational integration to clinical integration: analysis of the path between one level of integration to another using official documents

    Science.gov (United States)

    Mandza, Matey; Gagnon, Dominique; Carrier, Sébastien; Belzile, Louise; Demers, Louis

    2010-01-01

    Purpose Services’ integration comprises organizational, normative, economic, informational and clinical dimensions. Since 2004, the province of Quebec has devoted significant efforts to unify the governance of the main health and social care organizations of its various territories. Notwithstanding the uniformity of the national plan’s prescription, the territorial integration modalities greatly vary across the province. Theory This research is based upon a conceptual model of integration that comprises six components: inter-organizational partnership, case management, standardized assessment, a single entry point, a standardized service planning tool and a shared clinical file. Methods We conducted an embedded case study in six contrasted sites in terms of their level of integration. All documents prescribing the implementation of integration were retrieved and analyzed. Results and conclusions The analyzed documents demonstrate a growing local appropriation of the current integrative reform. Interestingly however, no link seems to exist between the quality of local prescriptions and the level of integration achieved in each site. This finding leads us to hypothesize that the variable quality of the operational accompaniment offered to implement these prescriptions is a variable in play.

  11. From classical to quantum and back: Hamiltonian adaptive resolution path integral, ring polymer, and centroid molecular dynamics.

    Science.gov (United States)

    Kreis, Karsten; Kremer, Kurt; Potestio, Raffaello; Tuckerman, Mark E

    2017-12-28

    Path integral-based methodologies play a crucial role for the investigation of nuclear quantum effects by means of computer simulations. However, these techniques are significantly more demanding than corresponding classical simulations. To reduce this numerical effort, we recently proposed a method, based on a rigorous Hamiltonian formulation, which restricts the quantum modeling to a small but relevant spatial region within a larger reservoir where particles are treated classically. In this work, we extend this idea and show how it can be implemented along with state-of-the-art path integral simulation techniques, including path-integral molecular dynamics, which allows for the calculation of quantum statistical properties, and ring-polymer and centroid molecular dynamics, which allow the calculation of approximate quantum dynamical properties. To this end, we derive a new integration algorithm that also makes use of multiple time-stepping. The scheme is validated via adaptive classical-path-integral simulations of liquid water. Potential applications of the proposed multiresolution method are diverse and include efficient quantum simulations of interfaces as well as complex biomolecular systems such as membranes and proteins.

  12. From classical to quantum and back: Hamiltonian adaptive resolution path integral, ring polymer, and centroid molecular dynamics

    Science.gov (United States)

    Kreis, Karsten; Kremer, Kurt; Potestio, Raffaello; Tuckerman, Mark E.

    2017-12-01

    Path integral-based methodologies play a crucial role for the investigation of nuclear quantum effects by means of computer simulations. However, these techniques are significantly more demanding than corresponding classical simulations. To reduce this numerical effort, we recently proposed a method, based on a rigorous Hamiltonian formulation, which restricts the quantum modeling to a small but relevant spatial region within a larger reservoir where particles are treated classically. In this work, we extend this idea and show how it can be implemented along with state-of-the-art path integral simulation techniques, including path-integral molecular dynamics, which allows for the calculation of quantum statistical properties, and ring-polymer and centroid molecular dynamics, which allow the calculation of approximate quantum dynamical properties. To this end, we derive a new integration algorithm that also makes use of multiple time-stepping. The scheme is validated via adaptive classical-path-integral simulations of liquid water. Potential applications of the proposed multiresolution method are diverse and include efficient quantum simulations of interfaces as well as complex biomolecular systems such as membranes and proteins.

  13. Effects of dynamical paths on the energy gap and the corrections to the free energy in path integrals of mean-field quantum spin systems

    Science.gov (United States)

    Koh, Yang Wei

    2018-03-01

    In current studies of mean-field quantum spin systems, much attention is placed on the calculation of the ground-state energy and the excitation gap, especially the latter, which plays an important role in quantum annealing. In pure systems, the finite gap can be obtained by various existing methods such as the Holstein-Primakoff transform, while the tunneling splitting at first-order phase transitions has also been studied in detail using instantons in many previous works. In disordered systems, however, it remains challenging to compute the gap of large-size systems with specific realization of disorder. Hitherto, only quantum Monte Carlo techniques are practical for such studies. Recently, Knysh [Nature Comm. 7, 12370 (2016), 10.1038/ncomms12370] proposed a method where the exponentially large dimensionality of such systems is condensed onto a random potential of much lower dimension, enabling efficient study of such systems. Here we propose a slightly different approach, building upon the method of static approximation of the partition function widely used for analyzing mean-field models. Quantum effects giving rise to the excitation gap and nonextensive corrections to the free energy are accounted for by incorporating dynamical paths into the path integral. The time-dependence of the trace of the time-ordered exponential of the effective Hamiltonian is calculated by solving a differential equation perturbatively, yielding a finite-size series expansion of the path integral. Formulae for the first excited-state energy are proposed to aid in computing the gap. We illustrate our approach using the infinite-range ferromagnetic Ising model and the Hopfield model, both in the presence of a transverse field.

  14. Review of computer simulations of isotope effects on biochemical reactions: From the Bigeleisen equation to Feynman's path integral.

    Science.gov (United States)

    Wong, Kin-Yiu; Xu, Yuqing; Xu, Liang

    2015-11-01

    Enzymatic reactions are integral components in many biological functions and malfunctions. The iconic structure of each reaction path for elucidating the reaction mechanism in details is the molecular structure of the rate-limiting transition state (RLTS). But RLTS is very hard to get caught or to get visualized by experimentalists. In spite of the lack of explicit molecular structure of the RLTS in experiment, we still can trace out the RLTS unique "fingerprints" by measuring the isotope effects on the reaction rate. This set of "fingerprints" is considered as a most direct probe of RLTS. By contrast, for computer simulations, oftentimes molecular structures of a number of TS can be precisely visualized on computer screen, however, theoreticians are not sure which TS is the actual rate-limiting one. As a result, this is an excellent stage setting for a perfect "marriage" between experiment and theory for determining the structure of RLTS, along with the reaction mechanism, i.e., experimentalists are responsible for "fingerprinting", whereas theoreticians are responsible for providing candidates that match the "fingerprints". In this Review, the origin of isotope effects on a chemical reaction is discussed from the perspectives of classical and quantum worlds, respectively (e.g., the origins of the inverse kinetic isotope effects and all the equilibrium isotope effects are purely from quantum). The conventional Bigeleisen equation for isotope effect calculations, as well as its refined version in the framework of Feynman's path integral and Kleinert's variational perturbation (KP) theory for systematically incorporating anharmonicity and (non-parabolic) quantum tunneling, are also presented. In addition, the outstanding interplay between theory and experiment for successfully deducing the RLTS structures and the reaction mechanisms is demonstrated by applications on biochemical reactions, namely models of bacterial squalene-to-hopene polycyclization and RNA 2'-O

  15. A path-integral approach for bosonic effective theories for Fermion fields in four and three dimensions

    International Nuclear Information System (INIS)

    Botelho, Luiz C.L.

    1998-02-01

    We study four dimensional Effective Bosonic Field Theories for massive fermion field in the infrared region and massive fermion in ultraviolet region by using an appropriate Fermion Path Integral Chiral variable change and the Polyakov's Fermi-Bose transmutation in the 3D-Abelian Thrirring model. (author)

  16. Derivation of the Schrodinger Equation from the Hamilton-Jacobi Equation in Feynman's Path Integral Formulation of Quantum Mechanics

    Science.gov (United States)

    Field, J. H.

    2011-01-01

    It is shown how the time-dependent Schrodinger equation may be simply derived from the dynamical postulate of Feynman's path integral formulation of quantum mechanics and the Hamilton-Jacobi equation of classical mechanics. Schrodinger's own published derivations of quantum wave equations, the first of which was also based on the Hamilton-Jacobi…

  17. Green function of the double-fractional Fokker-Planck equation: path integral and stochastic differential equations.

    Science.gov (United States)

    Kleinert, H; Zatloukal, V

    2013-11-01

    The statistics of rare events, the so-called black-swan events, is governed by non-Gaussian distributions with heavy power-like tails. We calculate the Green functions of the associated Fokker-Planck equations and solve the related stochastic differential equations. We also discuss the subject in the framework of path integration.

  18. A path-integral approach for bosonic effective theories for Fermion fields in four and three dimensions

    Energy Technology Data Exchange (ETDEWEB)

    Botelho, Luiz C.L

    1998-02-01

    We study four dimensional Effective Bosonic Field Theories for massive fermion field in the infrared region and massive fermion in ultraviolet region by using an appropriate Fermion Path Integral Chiral variable change and the Polyakov`s Fermi-Bose transmutation in the 3D-Abelian Thrirring model. (author) 14 refs.

  19. Creativity, Spirituality, and Transcendence: Paths to Integrity and Wisdom in the Mature Self. Publications in Creativity Research.

    Science.gov (United States)

    Miller, Melvin E., Ed.; Cook-Greuter, Susanne R., Ed.

    This book contains 11 papers on creativity, spirituality, and transcendence as paths to integrity and wisdom in the mature self. The book begins with the paper "Introduction--Creativity in Adulthood: Personal Maturity and Openness to Extraordinary Sources of Inspiration" (Susanne R. Cook-Greuter, Melvin E. Miller). The next four papers,…

  20. Moving to a Soft Path for Water: Integrated Research and Management Needs

    Science.gov (United States)

    Gleick, P. H.

    2011-12-01

    Water on Earth in its three fundamental phases is integral to the functioning, dynamics, and variability of the global climatological and biological support systems. From a purely scientific point of view, understanding the complexity of the hydrological cycle is of paramount interest and central to our understanding of other planetary geological, atmospheric, chemical, and physical processes. But water is more than that: water is key to economic, social, and political issues as well, including some of the core challenges of our time such central to issues of poverty, health, environmental sustainability, conflict, and economic prosperity. The more society seeks to solve these challenges, the more obvious it becomes that we must improve more than just our understanding of the fundamental science of the hydrological cycle and its links with related global processes; we must also improve our understanding of the complex social, economic, and structural challenges facing water managers and users. We must move to a different paradigm where water is managed in a far more integrated way - what I call the "soft path for water." Central to our basic science needs are (1) an expansion of the frequency and nature of the data we collect, (2) the development of systems for managing, sharing, and analyzing those data, and (3) improvements in our ability to model and forecast the hydrological cycle together with other climatological, geophysical, and biochemical systems. These improvements would lead to a far better understanding of the local, regional, and global details of the water balance on timescales from minutes to millennia. These needs are increasingly well understood in the research community and extensive efforts in these areas are underway under the auspices of national research centers, universities, and international scientific collaborations. But it is also becoming increasingly apparent that many of the current water challenges facing society are not going to be

  1. Boosting QED and QCD bound states in the path integral formalism

    Science.gov (United States)

    Simonov, Yu. A.

    2015-03-01

    Wave functions and energy eigenvalues of the path integral Hamiltonian are studied in the Lorentz frame moving with velocity v . The instantaneous interaction produced by the Wilson loop is shown to be reduced by an overall factor √{1 -(v/c )2 }. As a result, one obtains the boosted energy eigenvalues in the Lorentz covariant form E =√{P2+M02 } , where M0 is the c.m. energy, and this form is tested for two free particles and for the Coulomb and linear interaction. Using Lorentz-contracted wave functions of the bound states, one obtains the scaled-parton wave functions and valence quark distributions for large P . Matrix elements containing wave functions moving with different velocities strongly decrease with growing relative momentum; e.g., for the timelike form factors, one obtains Fh(Q0)˜(M/hQ_0)2 nh with nh=1 and 2 for mesons and baryons, as in the "quark counting rule."

  2. Path-integral approach to the dynamics of a random chain with rigid constraints

    International Nuclear Information System (INIS)

    Ferrari, Franco; Paturej, Jaroslaw; Vilgis, Thomas A.

    2008-01-01

    In this work the dynamics of a chain consisting of a set of beads attached to the ends of segments of fixed lengths is investigated. The chain fluctuates at constant temperature in a viscous medium. For simplicity, all interactions among the beads have been switched off and the number of spatial dimensions has been limited to two. In the limit in which the chain becomes a continuous system, its behavior may be described by a path integral, in which the rigid constraints coming from the infinitesimally small segments are imposed by means of a functional δ function. In this way a model of the dynamics of the chain is obtained, which closely resembles a two-dimensional nonlinear σ model. The partition function of this generalized nonlinear σ model is computed explicitly for a ring-shaped chain in the semiclassical approximation. The behavior of the chain at both long and short scales of time and distances is investigated. The connection between the generalized nonlinear σ model presented here and the Rouse model is discussed

  3. Numerical path integration technique for the calculation of transport properties of proteins.

    Science.gov (United States)

    Kang, Eun-Hee; Mansfield, Marc L; Douglas, Jack F

    2004-03-01

    We present a new technique for the computation of both the translational diffusivity and the intrinsic viscosity of macromolecules, and apply it here to proteins. Traditional techniques employ finite element representations of the surface of the macromolecule, taking the surface to be a union of spheres or of polygons, and have computation times that are O(m(3)) where m is the number of finite elements. The new technique, a numerical path integration method, has computation times that are only O(m). We have applied the technique to approximately 1000 different protein structures. The computed translational diffusivities and intrinsic viscosities are, to lowest order, proportional respectively to N(-1/3)(R) and N(0)(R), where N(R) is the number of amino acid residues in the protein. Our calculations also show some correlation with the shape of the molecule, as represented by the ratio m(2)/m(3), where m(2) and m(3) are, respectively, the middle and the smallest of the three principal moments of inertia. Comparisons with a number of experimental results are also performed, with results generally consistent to within experimental error.

  4. Polymer escape from a metastable Kramers potential: path integral hyperdynamics study.

    Science.gov (United States)

    Shin, Jaeoh; Ikonen, Timo; Khandkar, Mahendra D; Ala-Nissila, Tapio; Sung, Wokyung

    2010-11-14

    We study the dynamics of flexible, semiflexible, and self-avoiding polymer chains moving under a Kramers metastable potential. Due to thermal noise, the polymers, initially placed in the metastable well, can cross the potential barrier, but these events are extremely rare if the barrier is much larger than thermal energy. To speed up the slow rate processes in computer simulations, we extend the recently proposed path integral hyperdynamics method to the cases of polymers. We consider the cases where the polymers' radii of gyration are comparable to the distance between the well bottom and the barrier top. We find that, for a flexible polymers, the crossing rate (R) monotonically decreases with chain contour length (L), but with the magnitude much larger than the Kramers rate in the globular limit. For a semiflexible polymer, the crossing rate decreases with L but becomes nearly constant for large L. For a fixed L, the crossing rate becomes maximum at an intermediate bending stiffness. For the self-avoiding chain, the rate is a nonmonotonic function of L, first decreasing with L, and then, above a certain length, increasing with L. These findings can be instrumental for efficient separation of biopolymers.

  5. Path-integral isomorphic Hamiltonian for including nuclear quantum effects in non-adiabatic dynamics

    Science.gov (United States)

    Tao, Xuecheng; Shushkov, Philip; Miller, Thomas F.

    2018-03-01

    We describe a path-integral approach for including nuclear quantum effects in non-adiabatic chemical dynamics simulations. For a general physical system with multiple electronic energy levels, a corresponding isomorphic Hamiltonian is introduced such that Boltzmann sampling of the isomorphic Hamiltonian with classical nuclear degrees of freedom yields the exact quantum Boltzmann distribution for the original physical system. In the limit of a single electronic energy level, the isomorphic Hamiltonian reduces to the familiar cases of either ring polymer molecular dynamics (RPMD) or centroid molecular dynamics Hamiltonians, depending on the implementation. An advantage of the isomorphic Hamiltonian is that it can easily be combined with existing mixed quantum-classical dynamics methods, such as surface hopping or Ehrenfest dynamics, to enable the simulation of electronically non-adiabatic processes with nuclear quantum effects. We present numerical applications of the isomorphic Hamiltonian to model two- and three-level systems, with encouraging results that include improvement upon a previously reported combination of RPMD with surface hopping in the deep-tunneling regime.

  6. Hadronization of quark-diquark model for nucleon structure and nuclear force by path integral

    International Nuclear Information System (INIS)

    Nagata, Keitaro

    2003-01-01

    One of the central issues of the hadron physics is how to interpret the properties and the origin of nuclear force. Nuclear force is in principle the manifestation of dynamics of quarks and gluons but no trial has been successful yet in describing the nuclear force by using QCD, the fundamental theory of the strong interactions. Phenomenon related to the chiral symmetry and the spontaneous breaking of the chiral symmetry is one of the important phenomena for the understanding of hadron physics. Nambu-Jona-Lasinio (NJL) model is one of the quark system models to explain the phenomena concerning the chiral symmetry. Although the method to deduce the Lagrangian describing mesons by applying the path integral to NJL model has been well known as the bosonization, it has been difficult to extend it to baryons because baryons are three-body system. In this paper, a method is reported to deduce Lagrangian which describes baryon-meson from quark-diquark Lagrangian by assuming that baryons are the bound states of quark and diquark. (S. Funahashi)

  7. Numerical path integral solution to strong Coulomb correlation in one dimensional Hooke's atom

    Science.gov (United States)

    Ruokosenmäki, Ilkka; Gholizade, Hossein; Kylänpää, Ilkka; Rantala, Tapio T.

    2017-01-01

    We present a new approach based on real time domain Feynman path integrals (RTPI) for electronic structure calculations and quantum dynamics, which includes correlations between particles exactly but within the numerical accuracy. We demonstrate that incoherent propagation by keeping the wave function real is a novel method for finding and simulation of the ground state, similar to Diffusion Monte Carlo (DMC) method, but introducing new useful tools lacking in DMC. We use 1D Hooke's atom, a two-electron system with very strong correlation, as our test case, which we solve with incoherent RTPI (iRTPI) and compare against DMC. This system provides an excellent test case due to exact solutions for some confinements and because in 1D the Coulomb singularity is stronger than in two or three dimensional space. The use of Monte Carlo grid is shown to be efficient for which we determine useful numerical parameters. Furthermore, we discuss another novel approach achieved by combining the strengths of iRTPI and DMC. We also show usefulness of the perturbation theory for analytical approximates in case of strong confinements.

  8. Dynamical mean-field theory and path integral renormalisation group calculations of strongly correlated electronic states

    International Nuclear Information System (INIS)

    Heilmann, D.B.

    2007-02-01

    The two-plane HUBBARD model, which is a model for some electronic properties of undoped YBCO superconductors as well as displays a MOTT metal-to-insulator transition and a metal-to-band insulator transition, is studied within Dynamical Mean-Field Theory using HIRSCH-FYE Monte Carlo. In order to find the different transitions and distinguish the types of insulator, we calculate the single-particle spectral densities, the self-energies and the optical conductivities. We conclude that there is a continuous transition from MOTT to band insulator. In the second part, ground state properties of a diagonally disordered HUBBARD model is studied using a generalisation of Path Integral Renormalisation Group, a variational method which can also determine low-lying excitations. In particular, the distribution of antiferromagnetic properties is investigated. We conclude that antiferromagnetism breaks down in a percolation-type transition at a critical disorder, which is not changed appreciably by the inclusion of correlation effects, when compared to earlier studies. Electronic and excitation properties at the system sizes considered turn out to primarily depend on the geometry. (orig.)

  9. Matter-wave diffraction approaching limits predicted by Feynman path integrals for multipath interference

    Science.gov (United States)

    Barnea, A. Ronny; Cheshnovsky, Ori; Even, Uzi

    2018-02-01

    Interference experiments have been paramount in our understanding of quantum mechanics and are frequently the basis of testing the superposition principle in the framework of quantum theory. In recent years, several studies have challenged the nature of wave-function interference from the perspective of Born's rule—namely, the manifestation of so-called high-order interference terms in a superposition generated by diffraction of the wave functions. Here we present an experimental test of multipath interference in the diffraction of metastable helium atoms, with large-number counting statistics, comparable to photon-based experiments. We use a variation of the original triple-slit experiment and accurate single-event counting techniques to provide a new experimental bound of 2.9 ×10-5 on the statistical deviation from the commonly approximated null third-order interference term in Born's rule for matter waves. Our value is on the order of the maximal contribution predicted for multipath trajectories by Feynman path integrals.

  10. Dynamical mean-field theory and path integral renormalisation group calculations of strongly correlated electronic states

    Energy Technology Data Exchange (ETDEWEB)

    Heilmann, D.B.

    2007-02-15

    The two-plane HUBBARD model, which is a model for some electronic properties of undoped YBCO superconductors as well as displays a MOTT metal-to-insulator transition and a metal-to-band insulator transition, is studied within Dynamical Mean-Field Theory using HIRSCH-FYE Monte Carlo. In order to find the different transitions and distinguish the types of insulator, we calculate the single-particle spectral densities, the self-energies and the optical conductivities. We conclude that there is a continuous transition from MOTT to band insulator. In the second part, ground state properties of a diagonally disordered HUBBARD model is studied using a generalisation of Path Integral Renormalisation Group, a variational method which can also determine low-lying excitations. In particular, the distribution of antiferromagnetic properties is investigated. We conclude that antiferromagnetism breaks down in a percolation-type transition at a critical disorder, which is not changed appreciably by the inclusion of correlation effects, when compared to earlier studies. Electronic and excitation properties at the system sizes considered turn out to primarily depend on the geometry. (orig.)

  11. Path-integral formalism for stochastic resetting: Exactly solved examples and shortcuts to confinement.

    Science.gov (United States)

    Roldán, Édgar; Gupta, Shamik

    2017-08-01

    We study the dynamics of overdamped Brownian particles diffusing in conservative force fields and undergoing stochastic resetting to a given location at a generic space-dependent rate of resetting. We present a systematic approach involving path integrals and elements of renewal theory that allows us to derive analytical expressions for a variety of statistics of the dynamics such as (i) the propagator prior to first reset, (ii) the distribution of the first-reset time, and (iii) the spatial distribution of the particle at long times. We apply our approach to several representative and hitherto unexplored examples of resetting dynamics. A particularly interesting example for which we find analytical expressions for the statistics of resetting is that of a Brownian particle trapped in a harmonic potential with a rate of resetting that depends on the instantaneous energy of the particle. We find that using energy-dependent resetting processes is more effective in achieving spatial confinement of Brownian particles on a faster time scale than performing quenches of parameters of the harmonic potential.

  12. The sign problem in real-time path integral simulations: Using the cumulant action to implement multilevel blocking

    International Nuclear Information System (INIS)

    Mak, C. H.

    2009-01-01

    A practical method to tackle the sign problem in real-time path integral simulations is proposed based on the multilevel blocking idea. The formulation is made possible by using a cumulant expansion of the action, which in addition to addressing the sign problem, provides an unbiased estimator for the action from a statistically noisy sample of real-time paths. The cumulant formulation also allows the analytical gradients of the action to be computed with little extra computational effort, and it can easily be implemented in a massively parallel environment.

  13. Non-uniqueness of quantum transition state theory and general dividing surfaces in the path integral space.

    Science.gov (United States)

    Jang, Seogjoo; Voth, Gregory A

    2017-05-07

    Despite the fact that quantum mechanical principles do not allow the establishment of an exact quantum analogue of the classical transition state theory (TST), the development of a quantum TST (QTST) with a proper dynamical justification, while recovering the TST in the classical limit, has been a long standing theoretical challenge in chemical physics. One of the most recent efforts of this kind was put forth by Hele and Althorpe (HA) [J. Chem. Phys. 138, 084108 (2013)], which can be specified for any cyclically invariant dividing surface defined in the space of the imaginary time path integral. The present work revisits the issue of the non-uniqueness of QTST and provides a detailed theoretical analysis of HA-QTST for a general class of such path integral dividing surfaces. While we confirm that HA-QTST reproduces the result based on the ring polymer molecular dynamics (RPMD) rate theory for dividing surfaces containing only a quadratic form of low frequency Fourier modes, we find that it produces different results for those containing higher frequency imaginary time paths which accommodate greater quantum fluctuations. This result confirms the assessment made in our previous work [Jang and Voth, J. Chem. Phys. 144, 084110 (2016)] that HA-QTST does not provide a derivation of RPMD-TST in general and points to a new ambiguity of HA-QTST with respect to its justification for general cyclically invariant dividing surfaces defined in the space of imaginary time path integrals. Our analysis also offers new insights into similar path integral based QTST approaches.

  14. Column carbon dioxide and water vapor measurements by an airborne triple-pulse integrated path differential absorption lidar: novel lidar technologies and techniques with path to space

    Science.gov (United States)

    Singh, U. N.; Petros, M.; Refaat, T. F.; Yu, J.; Ismail, S.

    2017-09-01

    The 2-micron wavelength region is suitable for atmospheric carbon dioxide (CO2) measurements due to the existence of distinct absorption features for the gas at this wavelength region [1]. For more than 20 years, researchers at NASA Langley Research Center (LaRC) have developed several high-energy and high repetition rate 2-micron pulsed lasers [2]. Currently, LaRC team is engaged in designing, developing and demonstrating a triple-pulsed 2-micron direct detection Integrated Path Differential Absorption (IPDA) lidar to measure the weighted-average column dry-air mixing ratios of carbon dioxide (XCO2) and water vapor (XH2O) from an airborne platform [1, 3-5]. This novel technique allows measurement of the two most dominant greenhouse gases, simultaneously and independently, using a single instrument. This paper will provide status and details of the development of this airborne 2-micron triple-pulse IPDA lidar. The presented work will focus on the advancement of critical IPDA lidar components. Updates on the state-of-the-art triple-pulse laser transmitter will be presented including the status of seed laser locking, wavelength control, receiver and detector upgrades, laser packaging and lidar integration. Future plans for IPDA lidar ground integration, testing and flight validation will also be discussed. This work enables new Earth observation measurements, while reducing risk, cost, size, volume, mass and development time of required instruments.

  15. Configuration Path Integral Monte Carlo. Ab initio simulations of fermions in the warm dense matter regime

    Energy Technology Data Exchange (ETDEWEB)

    Schoof, Tim

    2017-03-08

    The reliable quantum mechanical description of thermodynamic properties of fermionic many-body systems at high densities and strong degeneracy is of increasing interest due to recent experimental progress in generating systems that exhibit a non-trivial interplay of quantum, temperature, and coupling effects. While quantum Monte Carlo methods are among the most accurate approaches for the description of the ground state, finite-temperature path integral Monte Carlo (PIMC) simulations cannot correctly describe weakly to moderately coupled and strongly degenerate Fermi systems due to the so-called fermion sign problem. By switching from the coordinate representation to a basis of anti-symmetric Slater-determinants, the Configuration Path Integral Monte Carlo (CPIMC) approach greatly reduces the sign problem and allows for the exact computation of thermodynamic properties in this regime. During this work, the CPIMC algorithm was greatly improved in terms of efficiency and accessible observables. The first successful implementation of the diagrammatic worm algorithm for a general Hamiltonian in Fock space with arbitrary pair interactions gives direct access to the Matsubara Green function. This allows for the reconstruction of dynamic properties from simulations in thermodynamic equilibrium and significantly reduces the statistical variance of derived estimators, such as the one-particle density. The strongly improved MC sampling, the much more efficient calculation of update probabilities, and the successful parallelization to thousands of CPU cores, which have been achieved as part of the new implementation, are essential for the subsequent application of the method to much larger systems than in previous works. This thesis demonstrates the capabilities of the CPIMC approach for a model system of Coulomb interacting fermions in a two-dimensional harmonic trap. The correctness of the CPIMC implementation is verified by rigorous comparisons with an exact

  16. Different strategies for spatial updating in yaw and pitch path integration

    Directory of Open Access Journals (Sweden)

    Caspar Mathias Goeke

    2013-02-01

    Full Text Available Research in spatial navigation revealed the existence of discrete strategies defined by the use of distinct reference frames during virtual path integration. The present study investigated the distribution of these navigation strategies as a function of gender, video gaming experience, and self-estimates of spatial navigation abilities in a population of 300 subjects. Participants watched videos of virtual passages through a star-field with one turn in either the horizontal (yaw or the vertical (pitch axis. At the end of a passage they selected one out of four homing arrows to indicate the initial starting location. To solve the task, participants could employ two discrete strategies, navigating within either an egocentric or an allocentric reference frame. The majority of valid subjects (232/260 consistently used the same strategy in more than 75% of all trials. With that approach 33.1% of all participants were classified as Turners (using an egocentric reference frame on both axes and 46.5% as Nonturners (using an allocentric reference frame on both axes. 9.2% of all participants consistently used an egocentric reference frame in the yaw plane but an allocentric reference frame in the pitch plane (Switcher. Investigating the influence of gender on navigation strategies revealed that females predominantly used the Nonturner strategy while males used both the Turner and the Nonturner strategy with comparable probabilities. Other than expected, video gaming experience did not influence strategy use. Based on a strong quantitative basis with the sample size about an order of magnitude larger than in typical psychophysical studies these results demonstrate that most people reliably use one out of three possible navigation strategies (Turners, Nonturners, Switchers for spatial updating and provides a sound estimate of how those strategies are distributed within the general population.

  17. Receiver Performance Analysis of a Multi-wavelength Sampling Integrated Path Differential Absorption CO2 Lidar

    Science.gov (United States)

    Sun, X.; Abshire, J. B.; Ramanathan, A. K.; Mao, J.; Kawa, S. R.

    2016-12-01

    A multi-wavelength sampling integrated path differential (IPDA) CO2 lidar is analyzed and modeled. The instrument transmits laser pulses at a series of wavelengths across the 1572.33 nm CO2 absorption line. The receiver measures the received laser pulse energy and time of flight at each wavelength. The measurements are then fit to a CO2 absorption line shape to determine the total column CO2 mixing ratio. The receiver model includes effects of solar background, photon detection shot noise, detector dark current, preamplifier noise and laser speckle noise. The least-square curve fit is a linear fit in the optical depth domain and the logarithm of the raw measurements. The column CO2 mixing ratio is proportional to the scaling factor resulted from the curve fit. There are several advantages to performing the curve fit in the optical depth domain: (a) the result is directly proportional to the CO2molecule number density of the column; (b) it is a standard linear least square error fit where the theory is well established; (c) there is no need to separately estimate the off-line optical transmission. The receiver model further gives insight about the effects of various instrument parameters and the difference between the atmosphere model used in the curve fit and the actual atmosphere. For example, we can use the model to estimate the biases in the retrieved CO2 mixing ratio from small errors in the meteorological data used to generate the line shape used in the curve fit. We have shown that the estimated instrument performance using this receiver model agrees with the results from our recent airborne measurements. The receiver model is also used in the simulation of the impact of the lidar measurements of the global greenhouse gas distribution and their projected impact on quantification of surface sources and sinks.

  18. Statistical mechanics and field theory. [Path integrals, lattices, pseudofree vertex model

    Energy Technology Data Exchange (ETDEWEB)

    Samuel, S.A.

    1979-05-01

    Field theory methods are applied to statistical mechanics. Statistical systems are related to fermionic-like field theories through a path integral representation. Considered are the Ising model, the free-fermion model, and close-packed dimer problems on various lattices. Graphical calculational techniques are developed. They are powerful and yield a simple procedure to compute the vacuum expectation value of an arbitrary product of Ising spin variables. From a field theorist's point of view, this is the simplest most logical derivation of the Ising model partition function and correlation functions. This work promises to open a new area of physics research when the methods are used to approximate unsolved problems. By the above methods a new model named the 128 pseudo-free vertex model is solved. Statistical mechanics intuition is applied to field theories. It is shown that certain relativistic field theories are equivalent to classical interacting gases. Using this analogy many results are obtained, particularly for the Sine-Gordon field theory. Quark confinement is considered. Although not a proof of confinement, a logical, esthetic, and simple picture is presented of how confinement works. A key ingredient is the insight gained by using an analog statistical system consisting of a gas of macromolecules. This analogy allows the computation of Wilson loops in the presence of topological vortices and when symmetry breakdown occurs in the topological quantum number. Topological symmetry breakdown calculations are placed on approximately the same level of rigor as instanton calculations. The picture of confinement that emerges is similar to the dual Meissner type advocated by Mandelstam. Before topological symmetry breakdown, QCD has monopoles bound linearly together by three topological strings. Topological symmetry breakdown corresponds to a new phase where these monopoles are liberated. It is these liberated monopoles that confine quarks. 64 references.

  19. Path Integral Monte Carlo Simulations of Warm Dense Matter and Plasmas

    Energy Technology Data Exchange (ETDEWEB)

    Militzer, Burkhard [Univ. of California, Berkeley, CA (United States)

    2018-01-13

    New path integral Monte Carlo simulation (PIMC) techniques will be developed and applied to derive the equation of state (EOS) for the regime of warm dense matter and dense plasmas where existing first-principles methods cannot be applied. While standard density functional theory has been used to accurately predict the structure of many solids and liquids up to temperatures on the order of 10,000 K, this method is not applicable at much higher temperature where electronic excitations become important because the number of partially occupied electronic orbitals reaches intractably large numbers and, more importantly, the use of zero-temperature exchange-correlation functionals introduces an uncontrolled approximation. Here we focus on PIMC methods that become more and more efficient with increasing temperatures and still include all electronic correlation effects. In this approach, electronic excitations increase the efficiency rather than reduce it. While it has commonly been assumed such methods can only be applied to elements without core electrons like hydrogen and helium, we recently showed how to extend PIMC to heavier elements by performing the first PIMC simulations of carbon and water plasmas [Driver, Militzer, Phys. Rev. Lett. 108 (2012) 115502]. Here we propose to continue this important development to extend the reach of PIMC simulations to yet heavier elements and also lower temperatures. The goal is to provide a robust first-principles simulation method that can accurately and efficiently study materials with excited electrons at solid-state densities in order to access parts of the phase diagram such the regime of warm dense matter and plasmas where so far only more approximate, semi-analytical methods could be applied.

  20. Fully Quantum Description of the Zundel Ion: Combining Variational Quantum Monte Carlo with Path Integral Langevin Dynamics.

    Science.gov (United States)

    Mouhat, Félix; Sorella, Sandro; Vuilleumier, Rodolphe; Saitta, Antonino Marco; Casula, Michele

    2017-06-13

    We introduce a novel approach for a fully quantum description of coupled electron-ion systems from first principles. It combines the variational quantum Monte Carlo solution of the electronic part with the path integral formalism for the quantum nuclear dynamics. On the one hand, the path integral molecular dynamics includes nuclear quantum effects by adding a set of fictitious classical particles (beads) aimed at reproducing nuclear quantum fluctuations via a harmonic kinetic term. On the other hand, variational quantum Monte Carlo can provide Born-Oppenheimer potential energy surfaces with a precision comparable to the most-advanced post-Hartree-Fock approaches, and with a favorable scaling with the system size. In order to cope with the intrinsic noise due to the stochastic nature of quantum Monte Carlo methods, we generalize the path integral molecular dynamics using a Langevin thermostat correlated according to the covariance matrix of quantum Monte Carlo nuclear forces. The variational parameters of the quantum Monte Carlo wave function are evolved during the nuclear dynamics, such that the Born-Oppenheimer potential energy surface is unbiased. Statistical errors on the wave function parameters are reduced by resorting to bead grouping average, which we show to be accurate and well-controlled. Our general algorithm relies on a Trotter breakup between the dynamics driven by ionic forces and the one set by the harmonic interbead couplings. The latter is exactly integrated, even in the presence of the Langevin thermostat, thanks to the mapping onto an Ornstein-Uhlenbeck process. This framework turns out to be also very efficient in the case of noiseless (deterministic) ionic forces. The new implementation is validated on the Zundel ion (H 5 O 2 + ) by direct comparison with standard path integral Langevin dynamics calculations made with a coupled cluster potential energy surface. Nuclear quantum effects are confirmed to be dominant over thermal effects well

  1. Blip decomposition of the path integral: Exponential acceleration of real-time calculations on quantum dissipative systems

    International Nuclear Information System (INIS)

    Makri, Nancy

    2014-01-01

    The real-time path integral representation of the reduced density matrix for a discrete system in contact with a dissipative medium is rewritten in terms of the number of blips, i.e., elementary time intervals over which the forward and backward paths are not identical. For a given set of blips, it is shown that the path sum with respect to the coordinates of all remaining time points is isomorphic to that for the wavefunction of a system subject to an external driving term and thus can be summed by an inexpensive iterative procedure. This exact decomposition reduces the number of terms by a factor that increases exponentially with propagation time. Further, under conditions (moderately high temperature and/or dissipation strength) that lead primarily to incoherent dynamics, the “fully incoherent limit” zero-blip term of the series provides a reasonable approximation to the dynamics, and the blip series converges rapidly to the exact result. Retention of only the blips required for satisfactory convergence leads to speedup of full-memory path integral calculations by many orders of magnitude

  2. Status of the National Ignition Facility Integrated Computer Control System (ICCS) on the Path to Ignition

    International Nuclear Information System (INIS)

    Lagin, L J; Bettenhauasen, R C; Bowers, G A; Carey, R W; Edwards, O D; Estes, C M; Demaret, R D; Ferguson, S W; Fisher, J M; Ho, J C; Ludwigsen, A P; Mathisen, D G; Marshall, C D; Matone, J M; McGuigan, D L; Sanchez, R J; Shelton, R T; Stout, E A; Tekle, E; Townsend, S L; Van Arsdall, P J; Wilson, E F

    2007-01-01

    diagnostics, in preparation for project completion in 2009. Additional capabilities to support fusion ignition shots in a National Ignition Campaign (NIC) beginning in 2010 will include a cryogenic target system, target diagnostics, and integrated experimental shot data analysis with tools for data visualization and archiving. This talk discusses the current status of the control system implementation and discusses the plan to complete the control system on the path to ignition

  3. Status of the National Ignition Facility Integrated Computer Control System (ICCS) on the path to ignition

    Energy Technology Data Exchange (ETDEWEB)

    Lagin, L.J. [Lawrence Livermore National Laboratory, P.O. Box 808, Livermore, CA 94550 (United States)], E-mail: lagin1@llnl.gov; Bettenhausen, R.C.; Bowers, G.A.; Carey, R.W.; Edwards, O.D.; Estes, C.M.; Demaret, R.D.; Ferguson, S.W.; Fisher, J.M.; Ho, J.C.; Ludwigsen, A.P.; Mathisen, D.G.; Marshall, C.D.; Matone, J.T.; McGuigan, D.L.; Sanchez, R.J.; Stout, E.A.; Tekle, E.A.; Townsend, S.L.; Van Arsdall, P.J. [Lawrence Livermore National Laboratory, P.O. Box 808, Livermore, CA 94550 (United States)] (and others)

    2008-04-15

    final optics, target positioners and diagnostics. Additional capabilities to support fusion ignition shots in a National Ignition Campaign (NIC) beginning in 2010 will include a cryogenic target system, target diagnostics, and integrated experimental shot data analysis with tools for data visualization and archiving. This talk discusses the current status of the control system implementation and discusses the plan to complete the control system on the path to ignition.

  4. Status of the National Ignition Facility Integrated Computer Control System (ICCS) on the Path to Ignition

    Energy Technology Data Exchange (ETDEWEB)

    Lagin, L J; Bettenhauasen, R C; Bowers, G A; Carey, R W; Edwards, O D; Estes, C M; Demaret, R D; Ferguson, S W; . Fisher, J M; Ho, J C; Ludwigsen, A P; Mathisen, D G; Marshall, C D; Matone, J M; McGuigan, D L; Sanchez, R J; Shelton, R T; Stout, E A; Tekle, E; Townsend, S L; Van Arsdall, P J; Wilson, E F

    2007-09-11

    positioners and diagnostics, in preparation for project completion in 2009. Additional capabilities to support fusion ignition shots in a National Ignition Campaign (NIC) beginning in 2010 will include a cryogenic target system, target diagnostics, and integrated experimental shot data analysis with tools for data visualization and archiving. This talk discusses the current status of the control system implementation and discusses the plan to complete the control system on the path to ignition.

  5. 77 FR 33486 - Certain Integrated Circuit Packages Provided With Multiple Heat-Conducting Paths and Products...

    Science.gov (United States)

    2012-06-06

    ...-conducting paths and products containing same. The complaint names as respondents LG Electronics, Inc. of Korea; and LG Electronics, U.S.A., Inc. of NJ. Proposed respondents, other interested parties, and...

  6. The hamiltonian path integral for potentials of the albeverio høegh-krohn class-a white noise approach

    Science.gov (United States)

    Bock, Wolfgang; Capraro, Patrick

    2017-02-01

    We identify the integrand for the Hamiltonian path integral in space representation as a Kondratiev distribution. For this purpose we use methods from white noise analysis to compute also the Green's function of the underlying Schrödinger equation. We show that its generalized expectation solves the Schrödinger equation and that a functional form of the canonical commutation realtions is fulfilled.

  7. Nuclear quantum effect on hydrogen adsorption site of zeolite-templated carbon model using path integral molecular dynamics

    International Nuclear Information System (INIS)

    Suzuki, Kimichi; Kayanuma, Megumi; Tachikawa, Masanori; Ogawa, Hiroshi; Nishihara, Hirotomo; Kyotani, Takashi; Nagashima, Umpei

    2011-01-01

    Research highlights: → The stable hydrogen adsorption sites on C 36 H 12 were evaluated at 300 K using path integral molecular dynamics. → In the static MO calculation and conventional MD simulation, five stable adsorption sites of hydrogen atom were found. → In path integral simulation, only four stable adsorption sites were obtained. → The thermal and nuclear quantum effects are key role to settle the hydrogen adsorption sites on carbon materials. - Abstract: To settle the hydrogen adsorption sites on buckybowl C 36 H 12 , which is picked up from zeolite-templated carbon (ZTC), we have performed path integral molecular dynamics (PIMD) simulation including thermal and nuclear quantum fluctuations under semi-empirical PM3 method. In the static PM3 calculation and classical simulation the five stable adsorption sites of hydrogen atom are optimized inside a buckybowl C 36 H 12 , which are labeled as α-, β 1 -, β 2 -, γ-, and δ-carbons from edge to innermost carbon. In PIMD simulation, meanwhile, stable adsorption site is not appeared on δ-carbon, but on only α-, β 1 -, β 2 -, and γ-carbons. This result is due to the fact that the adsorbed hydrogen atom can easily go over the barrier for hydrogen transferring from δ- to β 1 -carbons by thermal and nuclear quantum fluctuations. The thermal and nuclear quantum effects are key role to settle the hydrogen adsorption sites on carbon materials.

  8. RadPath: A Web-based System for Integrating and Correlating Radiology and Pathology Findings During Cancer Diagnosis.

    Science.gov (United States)

    Arnold, Corey W; Wallace, W Dean; Chen, Shawn; Oh, Andrea; Abtin, Fereidoun; Genshaft, Scott; Binder, Scott; Aberle, Denise; Enzmann, Dieter

    2016-01-01

    The current paradigm of cancer diagnosis involves uncoordinated communication of findings from radiology and pathology to downstream physicians. Discordance between these findings can require additional time from downstream users to resolve, or given incorrect resolution, may adversely impact treatment decisions. To mitigate this problem, we developed a web-based system, called RadPath, for correlating and integrating radiology and pathology reporting. RadPath includes interfaces to our institution's clinical information systems, which are used to retrieve reports, images, and test results that are structured into an interactive compendium for a diagnostic patient case. The system includes an editing interface for physicians, allowing for the inclusion of additional clinical data, as well as the ability to retrospectively correlate and contextualize imaging findings following pathology diagnosis. During pilot deployment and testing over the course of 1 year, physicians at our institution have completed 60 RadPath cases, requiring an average of 128 seconds from a radiologist and an average of 93 seconds from a pathologist per case. Several technical and workflow challenges were encountered during development, including interfacing with diverse clinical information systems, automatically structuring report contents, and determining the appropriate physicians to create RadPath summaries. Reaction to RadPath has been positive, with users valuing the system's ability to consolidate diagnostic information. With the increasing complexity of medicine and the movement toward team-based disease management, there is a need for improved clinical communication and information exchange. RadPath provides a platform for generating coherent and correlated diagnostic summaries in cancer diagnosis with minimal additional effort from physicians. Copyright © 2016 The Association of University Radiologists. Published by Elsevier Inc. All rights reserved.

  9. An open-chain imaginary-time path-integral sampling approach to the calculation of approximate symmetrized quantum time correlation functions.

    Science.gov (United States)

    Cendagorta, Joseph R; Bačić, Zlatko; Tuckerman, Mark E

    2018-03-14

    We introduce a scheme for approximating quantum time correlation functions numerically within the Feynman path integral formulation. Starting with the symmetrized version of the correlation function expressed as a discretized path integral, we introduce a change of integration variables often used in the derivation of trajectory-based semiclassical methods. In particular, we transform to sum and difference variables between forward and backward complex-time propagation paths. Once the transformation is performed, the potential energy is expanded in powers of the difference variables, which allows us to perform the integrals over these variables analytically. The manner in which this procedure is carried out results in an open-chain path integral (in the remaining sum variables) with a modified potential that is evaluated using imaginary-time path-integral sampling rather than requiring the generation of a large ensemble of trajectories. Consequently, any number of path integral sampling schemes can be employed to compute the remaining path integral, including Monte Carlo, path-integral molecular dynamics, or enhanced path-integral molecular dynamics. We believe that this approach constitutes a different perspective in semiclassical-type approximations to quantum time correlation functions. Importantly, we argue that our approximation can be systematically improved within a cumulant expansion formalism. We test this approximation on a set of one-dimensional problems that are commonly used to benchmark approximate quantum dynamical schemes. We show that the method is at least as accurate as the popular ring-polymer molecular dynamics technique and linearized semiclassical initial value representation for correlation functions of linear operators in most of these examples and improves the accuracy of correlation functions of nonlinear operators.

  10. An open-chain imaginary-time path-integral sampling approach to the calculation of approximate symmetrized quantum time correlation functions

    Science.gov (United States)

    Cendagorta, Joseph R.; Bačić, Zlatko; Tuckerman, Mark E.

    2018-03-01

    We introduce a scheme for approximating quantum time correlation functions numerically within the Feynman path integral formulation. Starting with the symmetrized version of the correlation function expressed as a discretized path integral, we introduce a change of integration variables often used in the derivation of trajectory-based semiclassical methods. In particular, we transform to sum and difference variables between forward and backward complex-time propagation paths. Once the transformation is performed, the potential energy is expanded in powers of the difference variables, which allows us to perform the integrals over these variables analytically. The manner in which this procedure is carried out results in an open-chain path integral (in the remaining sum variables) with a modified potential that is evaluated using imaginary-time path-integral sampling rather than requiring the generation of a large ensemble of trajectories. Consequently, any number of path integral sampling schemes can be employed to compute the remaining path integral, including Monte Carlo, path-integral molecular dynamics, or enhanced path-integral molecular dynamics. We believe that this approach constitutes a different perspective in semiclassical-type approximations to quantum time correlation functions. Importantly, we argue that our approximation can be systematically improved within a cumulant expansion formalism. We test this approximation on a set of one-dimensional problems that are commonly used to benchmark approximate quantum dynamical schemes. We show that the method is at least as accurate as the popular ring-polymer molecular dynamics technique and linearized semiclassical initial value representation for correlation functions of linear operators in most of these examples and improves the accuracy of correlation functions of nonlinear operators.

  11. Centroid path integral molecular dynamics simulation of lithium para-hydrogen clusters

    Science.gov (United States)

    Kinugawa, Kenichi; Moore, Preston B.; Klein, Michael L.

    1997-01-01

    The real-time quantum dynamics of a series of lithium para-hydrogen clusters, Li(p-H2)n (n=13, 55, and 180), has been investigated at 2.5 and 4.0 K by means of normal mode centroid path integral molecular dynamics (NMCMD) simulation, following the methodology originally proposed by Cao and Voth [J. Chem. Phys. 101, 6168 (1994)]. The Li(p-H2)34 and neat (p-H2)34 clusters have also been simulated at 2.5 K to see the effect of doping of a Li atom on the cluster dynamics. We explicitly display both the microcanonical and the constant-temperature equations of motion for NMCMD simulations using the Nosé-Hoover chain thermostats and the reference system propagator algorithm (RESPA). In addition to the energetic and structural properties, the real-time semi-classical dynamics of the centroids of the Li atom and p-H2 molecules in the clusters has been explored to investigate the diffusive and vibrational properties. In general, quantization of the nuclear motion enhances the ease of melting and diffusion, and also causes the power spectra of the velocity autocorrelation functions of hydrogen molecules to be dramatically shifted to lower frequency than in the classical regime. The self-diffusion coefficient of p-H2 molecules in the Li(p-H2)13 cluster, which is melted completely at both 2.5 and 4.0 K, is comparable to the experimental value of bulk liquid p-H2 just above the melting temperature (14 K). No significant differences have been found for the structural properties, molecular diffusion, and the quantum vibrational spectra of p-H2 molecules between the neat (p-H2)34 and Li(p-H2)34 clusters at 2.5 K. The n=34, 55, and 180 clusters show a solidlike core and a tendency towards surface melting at 2.5 K, with diffusion restricted to the outer region. The core of the Li(p-H2)55 cluster exhibits slow liquidlike diffusion at 4.0 K, whereas that of the Li(p-H2)180 cluster remains solidlike at this temperature. The quantum power spectrum of the velocity autocorrelation

  12. Path integral Monte Carlo simulations of dense carbon-hydrogen plasmas

    Science.gov (United States)

    Zhang, Shuai; Militzer, Burkhard; Benedict, Lorin X.; Soubiran, François; Sterne, Philip A.; Driver, Kevin P.

    2018-03-01

    Carbon-hydrogen plasmas and hydrocarbon materials are of broad interest to laser shock experimentalists, high energy density physicists, and astrophysicists. Accurate equations of state (EOSs) of hydrocarbons are valuable for various studies from inertial confinement fusion to planetary science. By combining path integral Monte Carlo (PIMC) results at high temperatures and density functional theory molecular dynamics results at lower temperatures, we compute the EOSs for hydrocarbons from simulations performed at 1473 separate (ρ, T)-points distributed over a range of compositions. These methods accurately treat electronic excitation effects with neither adjustable parameter nor experimental input. PIMC is also an accurate simulation method that is capable of treating many-body interaction and nuclear quantum effects at finite temperatures. These methods therefore provide a benchmark-quality EOS that surpasses that of semi-empirical and Thomas-Fermi-based methods in the warm dense matter regime. By comparing our first-principles EOS to the LEOS 5112 model for CH, we validate the specific heat assumptions in this model but suggest that the Grüneisen parameter is too large at low temperatures. Based on our first-principles EOSs, we predict the principal Hugoniot curve of polystyrene to be 2%-5% softer at maximum shock compression than that predicted by orbital-free density functional theory and SESAME 7593. By investigating the atomic structure and chemical bonding of hydrocarbons, we show a drastic decrease in the lifetime of chemical bonds in the pressure interval from 0.4 to 4 megabar. We find the assumption of linear mixing to be valid for describing the EOS and the shock Hugoniot curve of hydrocarbons in the regime of partially ionized atomic liquids. We make predictions of the shock compression of glow-discharge polymers and investigate the effects of oxygen content and C:H ratio on its Hugoniot curve. Our full suite of first-principles simulation results may

  13. Vulnerabilities, Influences and Interaction Paths: Failure Data for Integrated System Risk Analysis

    Science.gov (United States)

    Malin, Jane T.; Fleming, Land

    2006-01-01

    We describe graph-based analysis methods for identifying and analyzing cross-subsystem interaction risks from subsystem connectivity information. By discovering external and remote influences that would be otherwise unexpected, these methods can support better communication among subsystem designers at points of potential conflict and to support design of more dependable and diagnosable systems. These methods identify hazard causes that can impact vulnerable functions or entities if propagated across interaction paths from the hazard source to the vulnerable target. The analysis can also assess combined impacts of And-Or trees of disabling influences. The analysis can use ratings of hazards and vulnerabilities to calculate cumulative measures of the severity and importance. Identification of cross-subsystem hazard-vulnerability pairs and propagation paths across subsystems will increase coverage of hazard and risk analysis and can indicate risk control and protection strategies.

  14. Path-integral calculation of the density of states in heavily doped strongly compensated semiconductors in a magnetic field

    International Nuclear Information System (INIS)

    Koinov, Z.G.; Yanchev, I.Y.

    1981-09-01

    The density of states in heavily doped strongly compansated semiconductors in a strong magnetic field is calculated by using the path-integral method. The case is considered when correlation exists in the impurity positions owing to the Coulomb interactions between the charged donors and acceptors during the high-temperature preparation of the samples. The semiclassical formula is rederived and corrections to it due to the long-range character of the potential and its short-range fluctuations are obtained. The density of states in the tail is studied and analytical results are given in the classical and quantum cases. (author)

  15. A kinetic model for voltage-gated ion channels in cell membranes based on the path integral method

    Science.gov (United States)

    Erdem, Rıza; Ekiz, Cesur

    2005-04-01

    A kinetic model of cell membrane ion channels is proposed based on the path integral method. From the Pauli-type master equations valid on a macroscopic time scale, we derive a first-order differential equation or the kinetic equation which governs temporal evolution of the channel system along the paths of extreme probability. Using known parameters for the batrachotoxin (BTX)-modified sodium channels in squid giant axon, the time dependence of the channel activation and the voltage dependence of the corresponding time constants ( τ) are examined numerically. It is found that the channel activation relaxes to the steady (or equilibrium)-state values for a given membrane potential and the corresponding time constant reaches a maximum at a certain potential and thereafter decreases in magnitude as the membrane potential increases. A qualitative comparison between these results and the results of Hodgkin-Huxley theory, path probability method and thermodynamic models as well as the cut-open axon technique is presented. Good agreement is achieved.

  16. From path integrals to the Wheeler-DeWitt equation: Time evolution in spacetimes with a spatial boundary

    Science.gov (United States)

    Feng, Justin C.; Matzner, Richard A.

    2017-11-01

    We reexamine the relationship between the path integral and canonical formulation of quantum general relativity. In particular, we present a formal derivation of the Wheeler-DeWitt equation from the path integral for quantum general relativity by way of boundary variations. One feature of this approach is that it does not require an explicit 3 +1 splitting of spacetime in the bulk. For spacetimes with a spatial boundary, we show that the dependence of the transition amplitudes on spatial boundary conditions is determined by a Wheeler-DeWitt equation for the spatial boundary surface. We find that variations in the induced metric at the spatial boundary can be used to describe time evolution—time evolution in quantum general relativity is therefore governed by boundary conditions on the gravitational field at the spatial boundary. We then briefly describe a formalism for computing the dependence of transition amplitudes on spatial boundary conditions. Finally, we argue that for nonsmooth boundaries meaningful transition amplitudes must depend on boundary conditions at the joint surfaces.

  17. Computation of the equation of state of the quantum hard-sphere fluid utilizing several path-integral strategies.

    Science.gov (United States)

    Sesé, Luis M

    2004-08-22

    The compressibility factor of the quantum hard-sphere fluid within the region (rho(N) (*)lambda(B) (*)computed by following four distinct routes involving the three pair radial correlation functions that are significant in the path-integral context, namely, instantaneous, pair linear response, and centroids. These functions are calculated with path-integral Monte Carlo simulations involving the Cao-Berne propagator. The first route to the equation of state is the instantaneous standard one, i.e., the usual volume derivative of the partition function expressed in terms of the instantaneous pair radial correlations. The other three routes stem from the extended compressibility theorem, which associates the isothermal compressibility with the three pair radial structures mentioned above and involves the solving of appropriate Ornstein-Zernike equations. An analysis of the error bars in the quantities computed is reported, and it is proven the usefulness of the centroid pair correlations to fix quantum equations of state. Also, the regions where the fluid-solid changes of phase should take place are identified with the use of indicators sensitive to order in the sample. The consistency of the current results is assessed and comparison with data available in the literature is made wherever possible. (c) 2004 American Institute of Physics

  18. Test-Taker Characteristics and Integrated Speaking Test Performance: A Path-Analytic Study

    Science.gov (United States)

    Huang, Heng-Tsung Danny; Hung, Shao-Ting Alan; Hong, He-Ting Vivian

    2016-01-01

    This study explored the relationships among language proficiency, two selected test-taker characteristics (i.e., topical knowledge and anxiety), and integrated speaking test performance. Data collection capitalized on three sets of instruments: three integrated tasks derived from TOEFL-iBT preparation materials, the state anxiety inventory created…

  19. Transculturalism: A Path to the Integration of the Multilingual/Multi ...

    African Journals Online (AJOL)

    DrNneka

    This paper believed that integration in Nigeria can be promoted through transculturalism. What then is ... freedom of choice and behaviour. The cultural integration and tolerance boils down to a new development known as ... dialogue requires continuous negotiation of meanings, and can thus create potentially infinite space ...

  20. Displaced Path Integral Formulation for the Momentum Distribution of Quantum Particles

    Science.gov (United States)

    Lin, Lin; Morrone, Joseph A.; Car, Roberto; Parrinello, Michele

    2010-09-01

    The proton momentum distribution, accessible by deep inelastic neutron scattering, is a very sensitive probe of the potential of mean force experienced by the protons in hydrogen-bonded systems. In this work we introduce a novel estimator for the end-to-end distribution of the Feynman paths, i.e., the Fourier transform of the momentum distribution. In this formulation, free particle and environmental contributions factorize. Moreover, the environmental contribution has a natural analogy to a free energy surface in statistical mechanics, facilitating the interpretation of experiments. The new formulation is not only conceptually but also computationally advantageous. We illustrate the method with applications to an empirical water model, ab initio ice, and one dimensional model systems.

  1. SEM technique for experimentally locating latch-up paths in integrated circuits

    International Nuclear Information System (INIS)

    Dressendorfer, P.V.; Armendariz, M.G.

    1980-01-01

    A technique is presented for using the scanning electron microscope (SEM) in the electron-beam-induced current (EBIC) mode to delineate latch-up paths in CMOS ICs. In the EBIC mode, the current produced by the collection and separation of the electron-beam-generated electron-hole pairs in the space charge regions of the device is measured and used to form an image. Since the collection of these carriers is dependent on space charge region width (and thus junction potential), anything that alters the depletion layer width will affect the collection efficiency. In a latch condition the junctions involved in the latch will be biased differently from those which are not, and thus the EBIC signal from those regions should be measurably different

  2. The Strategic Implications of E-Network Integration and Transformation Paths for Synchronizing Supply Chains

    OpenAIRE

    Minjoon Jun; Shaohan Cai; Daesoo Kim

    2008-01-01

    Streamlining information flows across the physical supply chain is crucial for successful supply chain management. This study examines different structures of e-networks (i.e., virtual supply chains linked via electronic information and communication technologies) and their maximum capabilities to gain e-network benefits. Further, this research explores four levels of e-network integration based on a 2x2 e-network technology and transaction integration matrix. Of the four levels, an e-network...

  3. An UML Statechart Diagram-Based MM-Path Generation Approach for Object-Oriented Integration Testing

    OpenAIRE

    Ruilian Zhao; Ling Lin

    2008-01-01

    MM-Path, an acronym for Method/Message Path, describes the dynamic interactions between methods in object-oriented systems. This paper discusses the classifications of MM-Path, based on the characteristics of object-oriented software. We categorize it according to the generation reasons, the effect scope and the composition of MM-Path. A formalized representation of MM-Path is also proposed, which has considered the influence of state on response method sequences of messages. .Moreover, an au...

  4. A novel integrated approach for path following and directional stability control of road vehicles after a tire blow-out

    Science.gov (United States)

    Wang, Fei; Chen, Hong; Guo, Konghui; Cao, Dongpu

    2017-09-01

    The path following and directional stability are two crucial problems when a road vehicle experiences a tire blow-out or sudden tire failure. Considering the requirement of rapid road vehicle motion control during a tire blow-out, this article proposes a novel linearized decoupling control procedure with three design steps for a class of second order multi-input-multi-output non-affine system. The evaluating indicators for controller performance are presented and a performance related control parameter distribution map is obtained based on the stochastic algorithm which is an innovation for non-blind parameter adjustment in engineering implementation. The analysis on the robustness of the proposed integrated controller is also performed. The simulation studies for a range of driving conditions are conducted, to demonstrate the effectiveness of the proposed controller.

  5. Toward an integrative theory of training motivation: a meta-analytic path analysis of 20 years of research.

    Science.gov (United States)

    Colquitt, J A; LePine, J A; Noe, R A

    2000-10-01

    This article meta-analytically summarizes the literature on training motivation, its antecedents, and its relationships with training outcomes such as declarative knowledge, skill acquisition, and transfer. Significant predictors of training motivation and outcomes included individual characteristics (e.g., locus of control, conscientiousness, anxiety, age, cognitive ability, self-efficacy, valence, job involvement) and situational characteristics (e.g., climate). Moreover, training motivation explained incremental variance in training outcomes beyond the effects of cognitive ability. Meta-analytic path analyses further showed that the effects of personality, climate, and age on training outcomes were only partially mediated by self-efficacy, valence, and job involvement. These findings are discussed in terms of their practical significance and their implications for an integrative theory of training motivation.

  6. Path integral for stochastic inflation: Nonperturbative volume weighting, complex histories, initial conditions, and the end of inflation

    Science.gov (United States)

    Gratton, Steven

    2011-09-01

    In this paper we present a path integral formulation of stochastic inflation. Volume weighting can be naturally implemented from this new perspective in a very straightforward way when compared to conventional Langevin approaches. With an in-depth study of inflation in a quartic potential, we investigate how the inflaton evolves and how inflation typically ends both with and without volume weighting. The calculation can be carried to times beyond those accessible to conventional Fokker-Planck approaches. Perhaps unexpectedly, complex histories sometimes emerge with volume weighting. The reward for this excursion into the complex plane is an insight into how volume-weighted inflation both loses memory of initial conditions and ends via slow roll. The slow-roll end of inflation mitigates certain “Youngness Paradox”-type criticisms of the volume-weighted paradigm. Thus it is perhaps time to rehabilitate proper-time volume weighting as a viable measure for answering at least some interesting cosmological questions.

  7. Path integral for stochastic inflation: Nonperturbative volume weighting, complex histories, initial conditions, and the end of inflation

    International Nuclear Information System (INIS)

    Gratton, Steven

    2011-01-01

    In this paper we present a path integral formulation of stochastic inflation. Volume weighting can be naturally implemented from this new perspective in a very straightforward way when compared to conventional Langevin approaches. With an in-depth study of inflation in a quartic potential, we investigate how the inflaton evolves and how inflation typically ends both with and without volume weighting. The calculation can be carried to times beyond those accessible to conventional Fokker-Planck approaches. Perhaps unexpectedly, complex histories sometimes emerge with volume weighting. The reward for this excursion into the complex plane is an insight into how volume-weighted inflation both loses memory of initial conditions and ends via slow roll. The slow-roll end of inflation mitigates certain ''Youngness Paradox''-type criticisms of the volume-weighted paradigm. Thus it is perhaps time to rehabilitate proper-time volume weighting as a viable measure for answering at least some interesting cosmological questions.

  8. The critical path method to analyze and modify OR-workflow: integration of an image documentation system.

    Science.gov (United States)

    Endress, A; Aydeniz, B; Wallwiener, D; Kurek, R

    2006-01-01

    Intraoperative image documentation is becoming more and more important for quality management in medicine, in terms of forensic documentation, research and teaching. Up to now, no software-based OR-image-documentation system fits satisfactorily into an OR-workflow. The objective of this study is to transparently show system integration in a clinical workflow for evaluating demands on future system developments. An example of the OR-workflow is presented for the department of obstetrics and gynecology at the University of Tuebingen (Germany). Twelve representative gynecologic laparoscopic surgeries were analyzed by using the critical path method (CPM). CPM network diagrams are shown for an actual laparoscopic workflow and for a workflow including an OR-image-documentation system. With the objective not to increase the total time of actual workflow, the maximum system operation time can be calculated for each period of time. Before surgery the maximum system operation time is x(max) = 7,3 minutes. After surgery it has to be assumed that system operation will increase total workflow time. Using the CPM to analyze requirements for system integration in a medical workflow has not yet been investigated. It is an appropriate method to transparently show integration possibilities and to define workflow-based requirements for the development process of new systems.

  9. Path-integral theory of the scattering of 4He atoms at the surface of liquid 4He

    International Nuclear Information System (INIS)

    Swanson, D.R.; Edwards, D.O.

    1988-01-01

    The path-integral theory of the scattering of a 4 He atom near the free surface of liquid 4 He, which was originally formulated by Echenique and Pendry, has been recalculated with use of a physically realistic static potential and atom-ripplon interaction outside the liquid. The static potential and atom-ripplon interaction are based on the variational calculation of Edwards and Fatouros. An important assumption in the path-integral theory is the ''impulse approximation'': that the motion of the scattered atom is very fast compared with the motion of the surface due to ripplons. This is found to be true only for ripplons with wave vectors smaller than q/sub m/∼0.2 A/sup -1/. If ripplons above q/sub m/ made an important contribution to the scattering of the atom there would be a substantial dependence of the elastic reflection coefficient on the angle of incidence of the atom. Since this is not observed experimentally, it is argued that ripplons above q/sub m/ give a negligible effect and should be excluded from the calculation. With this modification the theory gives a good fit to the experimental reflection coefficient as a function of the momentum and angle of incidence of the atom. The new version of the theory indicates that there is a substantial probability that an atom may reach the surface of the liquid without exciting any ripplons. The theory is not valid when the atom enters the liquid but analysis of the experiments shows that, once inside the liquid, the atom has a negligible chance of being scattered out again

  10. Study of the conformal symmetry breaking in field theories in gravitational background using path integrals

    International Nuclear Information System (INIS)

    Souza Alves, Marcelo de.

    1990-03-01

    Some general aspects on field theories in curved space-time and a introduction to conformal symmetry are presented.The behavior of the physical systems under Weyl transformations is discussed. The quantization of such systems are performed through the functional integration method. The regularization in curved space-time is also discussed. An application of this analysis in String theories is made. 42 refs

  11. Relations between the EU and Republic of Kosovo - The path of Kosovo integration towards the EU

    OpenAIRE

    Arif Riza

    2016-01-01

    Almost all the European Union member states have surpassed various challenges toward their integration into the European family. Although all these challenges are special cases on their own, Kosovo’s journey differs from the above mentioned cases, because Kosovo has not been recognized as an independent state by some members of the European family. The other key element that differs Kosovo’s journey from other cases is the presence of international institutions such as: EULEX, ICO, UNMIK, KFO...

  12. Continuous track paths reveal additive evidence integration in multistep decision making.

    Science.gov (United States)

    Buc Calderon, Cristian; Dewulf, Myrtille; Gevers, Wim; Verguts, Tom

    2017-10-03

    Multistep decision making pervades daily life, but its underlying mechanisms remain obscure. We distinguish four prominent models of multistep decision making, namely serial stage, hierarchical evidence integration, hierarchical leaky competing accumulation (HLCA), and probabilistic evidence integration (PEI). To empirically disentangle these models, we design a two-step reward-based decision paradigm and implement it in a reaching task experiment. In a first step, participants choose between two potential upcoming choices, each associated with two rewards. In a second step, participants choose between the two rewards selected in the first step. Strikingly, as predicted by the HLCA and PEI models, the first-step decision dynamics were initially biased toward the choice representing the highest sum/mean before being redirected toward the choice representing the maximal reward (i.e., initial dip). Only HLCA and PEI predicted this initial dip, suggesting that first-step decision dynamics depend on additive integration of competing second-step choices. Our data suggest that potential future outcomes are progressively unraveled during multistep decision making.

  13. A Path to Successful Energy Retrofits: Early Collaboration through Integrated Project Delivery Teams

    Energy Technology Data Exchange (ETDEWEB)

    Parrish, Kristen [Lawrence Berkeley National Lab. (LBNL), Berkeley, CA (United States)

    2012-10-01

    This document guides you through a process for the early design phases of retrofit projects to help you mitigate frustrations commonly experienced by building owners and designers. It outlines the value of forming an integrated project delivery team and developing a communication and information-sharing infrastructure that fosters collaboration. This guide does not present a complete process for designing an energy retrofit for a building. Instead, it focuses on the early design phase tasks related to developing and selecting energy efficiency measures (EEMs) that benefit from collaboration, and highlights the resulting advantages.

  14. European integration dimension of Republic of Moldova as development path in a globalization setting

    Directory of Open Access Journals (Sweden)

    Natalia ANTOCI

    2015-12-01

    Full Text Available In a global market economy, the opening towards outward, standard harmonization and convergence of national economies can create the necessary synergy in order to address the challenges of globalization. Republic of Moldova needs to develop partnership relations with European Union (EU countries, which have experience in relation to commodity markets, and without which it is difficult to modernize the economy and diversify its export. Moldova's integration into the European Union allows increasing dynamism and sustainability of the economic system of our country and allows implementing a new model of economic growth according to EU Member States' experience.

  15. Complex Path Integrals and Saddles in Two-Dimensional Gauge Theory.

    Science.gov (United States)

    Buividovich, P V; Dunne, Gerald V; Valgushev, S N

    2016-04-01

    We study numerically the saddle point structure of two-dimensional lattice gauge theory, represented by the Gross-Witten-Wadia unitary matrix model. The saddle points are, in general, complex valued, even though the original integration variables and action are real. We confirm the trans-series and instanton gas structure in the weak-coupling phase, and we identify a new complex-saddle interpretation of nonperturbative effects in the strong-coupling phase. In both phases, eigenvalue tunneling refers to eigenvalues moving off the real interval, into the complex plane, and the weak-to-strong coupling phase transition is driven by saddle condensation.

  16. Feynman formulae and phase space Feynman path integrals for tau-quantization of some Lévy-Khintchine type Hamilton functions

    International Nuclear Information System (INIS)

    Butko, Yana A.; Grothaus, Martin; Smolyanov, Oleg G.

    2016-01-01

    Evolution semigroups generated by pseudo-differential operators are considered. These operators are obtained by different (parameterized by a number τ) procedures of quantization from a certain class of functions (or symbols) defined on the phase space. This class contains Hamilton functions of particles with variable mass in magnetic and potential fields and more general symbols given by the Lévy-Khintchine formula. The considered semigroups are represented as limits of n-fold iterated integrals when n tends to infinity. Such representations are called Feynman formulae. Some of these representations are constructed with the help of another pseudo-differential operator, obtained by the same procedure of quantization; such representations are called Hamiltonian Feynman formulae. Some representations are based on integral operators with elementary kernels; these are called Lagrangian Feynman formulae. Langrangian Feynman formulae provide approximations of evolution semigroups, suitable for direct computations and numerical modeling of the corresponding dynamics. Hamiltonian Feynman formulae allow to represent the considered semigroups by means of Feynman path integrals. In the article, a family of phase space Feynman pseudomeasures corresponding to different procedures of quantization is introduced. The considered evolution semigroups are represented as phase space Feynman path integrals with respect to these Feynman pseudomeasures, i.e., different quantizations correspond to Feynman path integrals with the same integrand but with respect to different pseudomeasures. This answers Berezin’s problem of distinguishing a procedure of quantization on the language of Feynman path integrals. Moreover, the obtained Lagrangian Feynman formulae allow also to calculate these phase space Feynman path integrals and to connect them with some functional integrals with respect to probability measures

  17. TPP: Is the best path to regional integration of Asia Pacific?

    Directory of Open Access Journals (Sweden)

    Jason Carlos Martínez Jurado

    2012-10-01

    Full Text Available Asia-Pacific has distinguished itself for its high levels of interdependence and its fast economic growth, however, it lacks of a strong regional institutional framework. Despite the existence of APEC as a forum which includes the region’s diversity of economic development levels and cultural differences, its voluntary approach which relays on open regionalism has not allowed member economies to advance towards its ambitious goals of trade and investment liberalization. Therefore, several of its members have decided to embrace binding schemes, at a bilateral and multilateral basis, among them the TPP, which due to its comprehensive approach, for many represents the better route to achieve regional integration. However, there are questions raised regarding the convenience for Asia-Pacific to transit from a flexible model towards a reciprocal one, and the possible costs involved in such process.

  18. The hidden curriculum in radiology residency programs: A path to isolation or integration?

    International Nuclear Information System (INIS)

    Van Deven, T.; Hibbert, K.; Faden, L.; Chhem, R.K.

    2013-01-01

    Purpose: In this qualitative case study involving five academic Radiology centres across Canada, the authors seek to identify the hidden curriculum. Methods: A qualitative case study methodology was used for its potential to explore and provide rich descriptions and allow for the in-depth analysis of multiple data sources that include official institutional documents, surveys, observations and interviews (including undergraduate students, postgraduate, radiologists, imaging scientists, residents, faculty and administrators). This study relied on 48 interviews and involved primary data analysis by the core research team, and a secondary analysis by external examiners. Results: The results revealed that in four of the five major centres studied, a hidden curriculum of isolation prevailed, reinforcing an image of the radiologist as an independent operator within an organization dependent upon collaboration for optimal performance. The fifth site exhibited a hidden curriculum of collaboration and support, although the messages received were conflicting when addressing issues around teaching. Conclusions: The authors conclude by noting two possibilities for medical imaging departments to consider that of isolation or that of integration. They examine the implications of each and propose a way forward that situates Radiology as the crossroads of medicine. As such, the need for a new, generative metaphor reasserts the importance of recognizing the role and function of scholarship in teaching and learning contexts across Canada

  19. The hidden curriculum in radiology residency programs: A path to isolation or integration?

    Energy Technology Data Exchange (ETDEWEB)

    Van Deven, T. [Department of Medical Imaging, Schulich School of Medicine and Dentistry (Canada); Hibbert, K., E-mail: khibbert@uwo.ca [Faculty of Education, Schulich School of Medicine and Dentistry (Canada); Faden, L. [Faculty of Education, The University of Western Ontario (Canada); Chhem, R.K. [Institute of History, Philosophy and Ethics of Medicine, Ulm University, Ulm (Germany)

    2013-05-15

    Purpose: In this qualitative case study involving five academic Radiology centres across Canada, the authors seek to identify the hidden curriculum. Methods: A qualitative case study methodology was used for its potential to explore and provide rich descriptions and allow for the in-depth analysis of multiple data sources that include official institutional documents, surveys, observations and interviews (including undergraduate students, postgraduate, radiologists, imaging scientists, residents, faculty and administrators). This study relied on 48 interviews and involved primary data analysis by the core research team, and a secondary analysis by external examiners. Results: The results revealed that in four of the five major centres studied, a hidden curriculum of isolation prevailed, reinforcing an image of the radiologist as an independent operator within an organization dependent upon collaboration for optimal performance. The fifth site exhibited a hidden curriculum of collaboration and support, although the messages received were conflicting when addressing issues around teaching. Conclusions: The authors conclude by noting two possibilities for medical imaging departments to consider that of isolation or that of integration. They examine the implications of each and propose a way forward that situates Radiology as the crossroads of medicine. As such, the need for a new, generative metaphor reasserts the importance of recognizing the role and function of scholarship in teaching and learning contexts across Canada.

  20. A path reconstruction method integrating dead-reckoning and position fixes applied to humpback whales.

    Science.gov (United States)

    Wensveen, Paul J; Thomas, Len; Miller, Patrick J O

    2015-01-01

    Detailed information about animal location and movement is often crucial in studies of natural behaviour and how animals respond to anthropogenic activities. Dead-reckoning can be used to infer such detailed information, but without additional positional data this method results in uncertainty that grows with time. Combining dead-reckoning with new Fastloc-GPS technology should provide good opportunities for reconstructing georeferenced fine-scale tracks, and should be particularly useful for marine animals that spend most of their time under water. We developed a computationally efficient, Bayesian state-space modelling technique to estimate humpback whale locations through time, integrating dead-reckoning using on-animal sensors with measurements of whale locations using on-animal Fastloc-GPS and visual observations. Positional observation models were based upon error measurements made during calibrations. High-resolution 3-dimensional movement tracks were produced for 13 whales using a simple process model in which errors caused by water current movements, non-location sensor errors, and other dead-reckoning errors were accumulated into a combined error term. Positional uncertainty quantified by the track reconstruction model was much greater for tracks with visual positions and few or no GPS positions, indicating a strong benefit to using Fastloc-GPS for track reconstruction. Compared to tracks derived only from position fixes, the inclusion of dead-reckoning data greatly improved the level of detail in the reconstructed tracks of humpback whales. Using cross-validation, a clear improvement in the predictability of out-of-set Fastloc-GPS data was observed compared to more conventional track reconstruction methods. Fastloc-GPS observation errors during calibrations were found to vary by number of GPS satellites received and by orthogonal dimension analysed; visual observation errors varied most by distance to the whale. By systematically accounting for the

  1. Quantum Coherent States and Path Integral Method to Stochastically Determine the Anisotropic Volume Expansion in Lithiated Silicon Nanowires

    Directory of Open Access Journals (Sweden)

    Donald C. Boone

    2017-10-01

    Full Text Available This computational research study will analyze the multi-physics of lithium ion insertion into a silicon nanowire in an attempt to explain the electrochemical kinetics at the nanoscale and quantum level. The electron coherent states and a quantum field version of photon density waves will be the joining theories that will explain the electron-photon interaction within the lithium-silicon lattice structure. These two quantum particles will be responsible for the photon absorption rate of silicon atoms that are hypothesized to be the leading cause of breaking diatomic silicon covalent bonds that ultimately leads to volume expansion. It will be demonstrated through the combination of Maxwell stress tensor, optical amplification and path integrals that a stochastic analyze using a variety of Poisson distributions that the anisotropic expansion rates in the <110>, <111> and <112> orthogonal directions confirms the findings ascertained in previous works made by other research groups. The computational findings presented in this work are similar to those which were discovered experimentally using transmission electron microscopy (TEM and simulation models that used density functional theory (DFT and molecular dynamics (MD. The refractive index and electric susceptibility parameters of lithiated silicon are interwoven in the first principle theoretical equations and appears frequently throughout this research presentation, which should serve to demonstrate the importance of these parameters in the understanding of this component in lithium ion batteries.

  2. Path-integral derivation of black-hole radiance inside the de-Rham-Gabadadze-Tolley formulation of massive gravity

    Energy Technology Data Exchange (ETDEWEB)

    Arraut, Ivan [Institute of Theoretical Physics, Chinese Academy of Science, State Key Laboratory of Theoretical Physics, Beijing (China)

    2017-08-15

    If we apply the path-integral formulation in order to analyze the particle creation process of black holes inside the non-linear formulation of massive gravity, it is possible to demonstrate that the effect of the extra degrees of freedom is to deform the periodicity of the poles of the propagator in the complex t-plane. This might create the effect of extra particle creation process at scales where the extra degrees of freedom become relevant. For stationary solutions, depending on the values taken by the free parameters of the theory, the periodicity structure of the propagator reveal two effects. The first one is a shift on the positions of the pole of the propagator with respect to the GR case, affecting then the instant at which the particles are detected. The second one is the existence of branch points, affecting then the perception of particles. The branch point can be finite (including the zero order case) or infinite, depending on the free parameters of the theory. (orig.)

  3. Förster resonance energy transfer, absorption and emission spectra in multichromophoric systems. III. Exact stochastic path integral evaluation.

    Science.gov (United States)

    Moix, Jeremy M; Ma, Jian; Cao, Jianshu

    2015-03-07

    A numerically exact path integral treatment of the absorption and emission spectra of open quantum systems is presented that requires only the straightforward solution of a stochastic differential equation. The approach converges rapidly enabling the calculation of spectra of large excitonic systems across the complete range of system parameters and for arbitrary bath spectral densities. With the numerically exact absorption and emission operators, one can also immediately compute energy transfer rates using the multi-chromophoric Förster resonant energy transfer formalism. Benchmark calculations on the emission spectra of two level systems are presented demonstrating the efficacy of the stochastic approach. This is followed by calculations of the energy transfer rates between two weakly coupled dimer systems as a function of temperature and system-bath coupling strength. It is shown that the recently developed hybrid cumulant expansion (see Paper II) is the only perturbative method capable of generating uniformly reliable energy transfer rates and emission spectra across a broad range of system parameters.

  4. Path-integral derivation of black-hole radiance inside the de-Rham-Gabadadze-Tolley formulation of massive gravity

    Science.gov (United States)

    Arraut, Ivan

    2017-08-01

    If we apply the path-integral formulation in order to analyze the particle creation process of black holes inside the non-linear formulation of massive gravity, it is possible to demonstrate that the effect of the extra degrees of freedom is to deform the periodicity of the poles of the propagator in the complex t-plane. This might create the effect of extra particle creation process at scales where the extra degrees of freedom become relevant. For stationary solutions, depending on the values taken by the free parameters of the theory, the periodicity structure of the propagator reveal two effects. The first one is a shift on the positions of the pole of the propagator with respect to the GR case, affecting then the instant at which the particles are detected. The second one is the existence of branch points, affecting then the perception of particles. The branch point can be finite (including the zero order case) or infinite, depending on the free parameters of the theory.

  5. Path Integral Monte Carlo Study Confirms a Highly Ordered Snowball in 4He Nanodroplets Doped with an Ar+ Ion

    Science.gov (United States)

    Tramonto, F.; Salvestrini, P.; Nava, M.; Galli, D. E.

    2015-07-01

    By means of the Path Integral Monte Carlo method, we have performed a detailed microscopic study of 4He nanodroplets doped with an argon ion, Ar, at K. We have computed density profiles, energies, dissociation energies, and characterized the local order around the ion for nanodroplets with a number of 4He atoms ranging from 10 to 64 and also 128. We have found the formation of a stable solid structure around the ion, a "snowball", consisting of three concentric shells in which the 4He atoms are placed at the vertices of platonic solids: the first inner shell is an icosahedron (12 atoms); the second one is a dodecahedron with 20 atoms placed on the faces of the icosahedron of the first shell; the third shell is again an icosahedron composed of 12 atoms placed on the faces of the dodecahedron of the second shell. The "magic numbers" implied by this structure, 12, 32, and 44 helium atoms, have been observed in a recent experimental study (Bartl et al., J Phys Chem A 118:8050, 2014) of these complexes; the dissociation energy curve computed in the present work shows jumps in correspondence with those found in the nanodroplets abundance distribution measured in that experiment, strengthening the agreement between theory and experiment. The same structures were predicted in Galli et al. (J Phys Chem A 115:7300, 2011) in a study regarding Na+@4He when ; a comparison between Ar+@4He and Na+@4He complexes is also presented.

  6. Airborne Measurements of CO2 Column Absorption and Range Using a Pulsed Direct-Detection Integrated Path Differential Absorption Lidar

    Science.gov (United States)

    Abshire, James B.; Riris, Haris; Weaver, Clark J.; Mao, Jianping; Allan, Graham R.; Hasselbrack, William E.; Browell, Edward V.

    2013-01-01

    We report on airborne CO2 column absorption measurements made in 2009 with a pulsed direct-detection lidar operating at 1572.33 nm and utilizing the integrated path differential absorption technique. We demonstrated these at different altitudes from an aircraft in July and August in flights over four locations in the central and eastern United States. The results show clear CO2 line shape and absorption signals, which follow the expected changes with aircraft altitude from 3 to 13 km. The lidar measurement statistics were also calculated for each flight as a function of altitude. The optical depth varied nearly linearly with altitude, consistent with calculations based on atmospheric models. The scatter in the optical depth measurements varied with aircraft altitude as expected, and the median measurement precisions for the column varied from 0.9 to 1.2 ppm. The altitude range with the lowest scatter was 810 km, and the majority of measurements for the column within it had precisions between 0.2 and 0.9 ppm.

  7. Airborne measurements of CO2 column absorption and range using a pulsed direct-detection integrated path differential absorption lidar.

    Science.gov (United States)

    Abshire, James B; Riris, Haris; Weaver, Clark J; Mao, Jianping; Allan, Graham R; Hasselbrack, William E; Browell, Edward V

    2013-07-01

    We report on airborne CO(2) column absorption measurements made in 2009 with a pulsed direct-detection lidar operating at 1572.33 nm and utilizing the integrated path differential absorption technique. We demonstrated these at different altitudes from an aircraft in July and August in flights over four locations in the central and eastern United States. The results show clear CO(2) line shape and absorption signals, which follow the expected changes with aircraft altitude from 3 to 13 km. The lidar measurement statistics were also calculated for each flight as a function of altitude. The optical depth varied nearly linearly with altitude, consistent with calculations based on atmospheric models. The scatter in the optical depth measurements varied with aircraft altitude as expected, and the median measurement precisions for the column varied from 0.9 to 1.2 ppm. The altitude range with the lowest scatter was 8-10 km, and the majority of measurements for the column within it had precisions between 0.2 and 0.9 ppm.

  8. Effect of the shape on the spin state and exchange in quantum dots. Feynman path integral analysis

    International Nuclear Information System (INIS)

    Shevkunov, S. V.

    2015-01-01

    The ab initio computer simulation of the mixed quantum states of 1–5-nm model ellipsoid quantum dots with “soft” walls containing two and three quantum-indistinguishable nonrelativistic electrons has been performed by the path integral method. The calculation has been carried out beyond the single-electron and mean-field approximations with the fundamentally exact inclusion of Coulomb and exchange correlations of all orders and the spin variable. Distributions over the eigenfunctions of the spin-squared operator, as well as the equilibrium spin numbers, have been obtained depending on the shape of a quantum dot and the temperature. The complete set of basis functions symmetrized in permutations according to the spin of the system has been obtained by application of the Young symmetry operators. The dependence of the energy on the shape of the quantum dot corresponds to the negative sign of the surface tension at its boundary. The calculation indicates that the spin magnetic susceptibility in the system of two electrons decreases strongly for spherical quantum dots (“pairing” of spins) and the temperature dependences have a pronounced maximum whose position depends on the shape of the quantum dot. For three electrons in an oblate quantum dot, the inversion of the energy levels of spin states is observed and affects the spin magnetic susceptibility. The results indicate a strong dependence of the energy of collective spin states of electrons on the detailed inclusion of exchange and Coulomb spatial correlations

  9. Accurate path integral molecular dynamics simulation of ab-initio water at near-zero added cost

    Science.gov (United States)

    Elton, Daniel; Fritz, Michelle; Soler, José; Fernandez-Serra, Marivi

    It is now established that nuclear quantum motion plays an important role in determining water's structure and dynamics. These effects are important to consider when evaluating DFT functionals and attempting to develop better ones for water. The standard way of treating nuclear quantum effects, path integral molecular dynamics (PIMD), multiplies the number of energy/force calculations by the number of beads, which is typically 32. Here we introduce a method whereby PIMD can be incorporated into a DFT molecular dynamics simulation at virtually zero cost. The method is based on the cluster (many body) expansion of the energy. We first subtract the DFT monomer energies, using a custom DFT-based monomer potential energy surface. The evolution of the PIMD beads is then performed using only the more-accurate Partridge-Schwenke monomer energy surface. The DFT calculations are done using the centroid positions. Various bead thermostats can be employed to speed up the sampling of the quantum ensemble. The method bears some resemblance to multiple timestep algorithms and other schemes used to speed up PIMD with classical force fields. We show that our method correctly captures some of key effects of nuclear quantum motion on both the structure and dynamics of water. We acknowledge support from DOE Award No. DE-FG02-09ER16052 (D.E.) and DOE Early Career Award No. DE-SC0003871 (M.V.F.S.).

  10. Path integral Monte Carlo simulations of H2 adsorbed to lithium-doped benzene: A model for hydrogen storage materials

    Science.gov (United States)

    Lindoy, Lachlan P.; Kolmann, Stephen J.; D'Arcy, Jordan H.; Crittenden, Deborah L.; Jordan, Meredith J. T.

    2015-11-01

    Finite temperature quantum and anharmonic effects are studied in H2-Li+-benzene, a model hydrogen storage material, using path integral Monte Carlo (PIMC) simulations on an interpolated potential energy surface refined over the eight intermolecular degrees of freedom based upon M05-2X/6-311+G(2df,p) density functional theory calculations. Rigid-body PIMC simulations are performed at temperatures ranging from 77 K to 150 K, producing both quantum and classical probability density histograms describing the adsorbed H2. Quantum effects broaden the histograms with respect to their classical analogues and increase the expectation values of the radial and angular polar coordinates describing the location of the center-of-mass of the H2 molecule. The rigid-body PIMC simulations also provide estimates of the change in internal energy, ΔUads, and enthalpy, ΔHads, for H2 adsorption onto Li+-benzene, as a function of temperature. These estimates indicate that quantum effects are important even at room temperature and classical results should be interpreted with caution. Our results also show that anharmonicity is more important in the calculation of U and H than coupling—coupling between the intermolecular degrees of freedom becomes less important as temperature increases whereas anharmonicity becomes more important. The most anharmonic motions in H2-Li+-benzene are the "helicopter" and "ferris wheel" H2 rotations. Treating these motions as one-dimensional free and hindered rotors, respectively, provides simple corrections to standard harmonic oscillator, rigid rotor thermochemical expressions for internal energy and enthalpy that encapsulate the majority of the anharmonicity. At 150 K, our best rigid-body PIMC estimates for ΔUads and ΔHads are -13.3 ± 0.1 and -14.5 ± 0.1 kJ mol-1, respectively.

  11. Investigations of an O-H...S hydrogen bond via Car-Parrinello and path integral molecular dynamics.

    Science.gov (United States)

    Jezierska, Aneta; Panek, Jarosław J

    2009-06-01

    The presence of intramolecular hydrogen bonds influences the binding energy, tautomeric equilibrium, and spectroscopic properties of various classes of organic molecules. This article discusses the O-H...S bridge, one of the less commonly investigated types of intramolecular interactions. 3-mercapto-1,3-diphenylprop-2-en-1-one was considered as the model structure. This compound exhibits photochromic properties. Car-Parrinello molecular dynamics (CPMD) was applied to investigate the spectroscopic and molecular properties of this compound in the gas phase and in the solid state. The second part of the study is devoted to the effects of the quantization of nuclear motions, with special attention to the O-H...S moiety. Path integral molecular dynamics (PIMD) of the molecular crystal of 3-mercapto-1,3-diphenylprop-2-en-1-one was carried out for this purpose. The employment of this fully quantum mechanical technique enables one to study, in a time-averaged sense, the zero-point motion important for flat potential energy surfaces. Finally, the potentials of mean force (Pmfs) were calculated from the CPMD and PIMD data obtained for the solid-state calculations. The effect of including quantum nuclear motion was investigated. In the studied compound, quantum effects shortened the H-bridge and provided a better description of the free energy minimum. The computational results place this uncommon intramolecular H-bonding among the class of strong hydrogen bonds with large red shifts of O-H stretching modes, which correspond well with previously presented experimental data in the literature concerning this structure. 2008 Wiley Periodicals, Inc.

  12. Linking Cellular Mechanisms to Behavior: Entorhinal Persistent Spiking and Membrane Potential Oscillations May Underlie Path Integration, Grid Cell Firing, and Episodic Memory

    Directory of Open Access Journals (Sweden)

    Michael E. Hasselmo

    2008-01-01

    Full Text Available The entorhinal cortex plays an important role in spatial memory and episodic memory functions. These functions may result from cellular mechanisms for integration of the afferent input to entorhinal cortex. This article reviews physiological data on persistent spiking and membrane potential oscillations in entorhinal cortex then presents models showing how both these cellular mechanisms could contribute to properties observed during unit recording, including grid cell firing, and how they could underlie behavioural functions including path integration. The interaction of oscillations and persistent firing could contribute to encoding and retrieval of trajectories through space and time as a mechanism relevant to episodic memory.

  13. Real-time path-integral approach for dissipative quantum dot-cavity quantum electrodynamics: impure dephasing-induced effects.

    Science.gov (United States)

    Nahri, Davoud G; Mathkoor, Faisal H A; Raymond Ooi, C H

    2017-02-08

    A dissipative quantum dot (QD)-cavity system, where the QD is initially prepared in the excited state with no photon in the cavity, coupled to a longitudinal acoustic (LA) phonon reservoir is studied using a numerically exact real-time path-integral approach. Three distinct dynamical regimes of weak (WC), strong (SC), and coherent coupling (CC) are discussed and more accurate conditions identifying them are presented. Our results show that to have the CC regime, which is characterized by clear vacuum Rabi oscillation (VRO), vacuum Rabi splitting (VRS) should be larger than the sum of the widths of the corresponding peaks. In order to distinguish between contributions of population decay and impure dephasing, induced by LA phonon bath and the dissipations, we propose a two-part phenomenological expression, corresponding to the population decay and impure dephasing, which fits the QD-cavity decay curves perfectly and is used to calculate the corresponding spectra. We demonstrate that the effective population decay rate (the emission rate) increases from the carrier recombination rate to a maximum value, which is the mean of the QD and cavity dissipation rates, with QD-cavity coupling strength. To study the role of the effective impure dephasing rate on the width of the central peak of the spectra we introduce a quantity that can also be applied in determining the distinct coupling regimes. This quantity enables us to identify the onset of the SC regime as the point where the impure dephasing term begins to contribute to the central band of the spectrum significantly, as a result of the existence of VRO with a very small frequency (unclear VRO) at the corresponding decay curve. Its contribution to the width of the central peak increases with the coupling strength up to the onset of the CC regime, then reduces as a result of the appearance of sidebands in the spectra, which originates from clear VRO. The effective population decay and impure dephasing rate contribute

  14. 2-Micron Triple-Pulse Integrated Path Differential Absorption Lidar Development for Simultaneous Airborne Column Measurements of Carbon Dioxide and Water Vapor in the Atmosphere

    Science.gov (United States)

    Singh, Upendra N.; Petros, Mulugeta; Refaat, Tamer F.; Yu, Jirong

    2016-01-01

    For more than 15 years, NASA Langley Research Center (LaRC) has contributed in developing several 2-micron carbon dioxide active remote sensors using the DIAL technique. Currently, an airborne 2-micron triple-pulse integrated path differential absorption (IPDA) lidar is under development at NASA LaRC. This paper focuses on the advancement of the 2-micron triple-pulse IPDA lidar development. Updates on the state-of-the-art triple-pulse laser transmitter will be presented including the status of wavelength control, packaging and lidar integration. In addition, receiver development updates will also be presented, including telescope integration, detection systems and data acquisition electronics. Future plan for IPDA lidar system for ground integration, testing and flight validation will be presented.

  15. An Integrated Architecture for On-Board Aircraft Engine Performance Trend Monitoring and Gas Path Fault Diagnostics

    Science.gov (United States)

    Simon, Donald L.

    2010-01-01

    Aircraft engine performance trend monitoring and gas path fault diagnostics are closely related technologies that assist operators in managing the health of their gas turbine engine assets. Trend monitoring is the process of monitoring the gradual performance change that an aircraft engine will naturally incur over time due to turbomachinery deterioration, while gas path diagnostics is the process of detecting and isolating the occurrence of any faults impacting engine flow-path performance. Today, performance trend monitoring and gas path fault diagnostic functions are performed by a combination of on-board and off-board strategies. On-board engine control computers contain logic that monitors for anomalous engine operation in real-time. Off-board ground stations are used to conduct fleet-wide engine trend monitoring and fault diagnostics based on data collected from each engine each flight. Continuing advances in avionics are enabling the migration of portions of the ground-based functionality on-board, giving rise to more sophisticated on-board engine health management capabilities. This paper reviews the conventional engine performance trend monitoring and gas path fault diagnostic architecture commonly applied today, and presents a proposed enhanced on-board architecture for future applications. The enhanced architecture gains real-time access to an expanded quantity of engine parameters, and provides advanced on-board model-based estimation capabilities. The benefits of the enhanced architecture include the real-time continuous monitoring of engine health, the early diagnosis of fault conditions, and the estimation of unmeasured engine performance parameters. A future vision to advance the enhanced architecture is also presented and discussed

  16. Time-dependent tunnelling via path integrals. Connection to results of the quantum mechanics of decaying states

    Energy Technology Data Exchange (ETDEWEB)

    Douvropoulos, Theodosios G; Nicolaides, Cleanthes A [Physics Department, National Technical University, Athens (Greece); Theoretical and Physical Chemistry Institute, National Hellenic Research Foundation, 48 Vasileos Constantinou Avenue, Athens (Greece)

    2002-11-14

    The probability, P(t), of the irreversible dissipation into a continuous spectrum of an initially (t=0) localized ({psi}{sub o}) nonstationary state acquires, as time increases, 'memory' due to the lower energy bound of the spectrum, and eventually follows a nonexponential decay (NED). Regardless of the degree of dependence on energy, the magnitude of this deviation from exponential decay depends on the degree of proximity to threshold, and on whether the theory employs a real energy distribution, one form of which is g(E) {identical_to} ({psi}{sub o} vertical bar {delta}(H-E)|{psi}{sub o} ), or a complex energy distribution, G(E) {identical_to} ({psi}{sub o} vertical bar (H-E+i0)|{psi}{sub o} ). It is the latter that is physically consistent, since it originates from the singularity at t=0, which breaks the S-matrix unitarity, in accordance with the non-Hermitian character of decaying states. In order to test the quantum mechanical theory, we carried out semiclassical path integral calculations of the P(t) for an isolated narrow tunnelling state, whereby the truncated Fourier transform of a semiclassical Green function, G{sub sc}(E), is obtained. The results are in agreement with the analytic results of quantum mechanics when energy and time asymmetry are taken into account. It is shown that the analytic structure of G{sub sc}(E) is [D{sub regular} + D{sub pole}], where D{sub pole} is a finite sum over complex poles, which are the complex eigenvalues, W{sub n}, that the potential can support. The W{sub n} are given by E{sub n} + {delta}{sub n}-(i/2){gamma}{sub n}, where E{sub n} are the real eigenvalues of the corresponding bound potential, {gamma}{sub n} are the energy widths and {delta}{sub n} are the energy shifts, both expressed in terms of computable semiclassical quantities. The spherical harmonic oscillator (SHO) with and without angular momentum, and unstable ground states of diatomic molecules, are treated as particular cases. The exact spectrum

  17. Schwinger's quantum action principle from Dirac’s formulation through Feynman’s path integrals, the Schwinger-Keldysh method, quantum field theory, to source theory

    CERN Document Server

    Milton, Kimball A

    2015-01-01

    Starting from the earlier notions of stationary action principles, these tutorial notes shows how Schwinger’s Quantum Action Principle descended from Dirac’s formulation, which independently led Feynman to his path-integral formulation of quantum mechanics. Part I brings out in more detail the connection between the two formulations, and applications are discussed. Then, the Keldysh-Schwinger time-cycle method of extracting matrix elements is described. Part II will discuss the variational formulation of quantum electrodynamics and the development of source theory.

  18. Path integral approach for superintegrable potentials on spaces of non-constant curvature. Pt. 1. Darboux spaces D{sub I} and D{sub II}

    Energy Technology Data Exchange (ETDEWEB)

    Grosche, C. [Hamburg Univ. (Germany). 2. Inst. fuer Theoretische Physik; Pogosyan, G.S. [Joint Inst. of Nuclear Research, Moscow (Russian Federation). Bogoliubov Lab. of Theoretical Physics]|[Guadalajara Univ., Jalisco (Mexico). Dept. de Matematicas CUCEI; Sissakian, A.N. [Joint Inst. of Nuclear Research, Moscow (Russian Federation). Bogoliubov Lab. of Theoretical Physics

    2006-07-15

    In this paper the Feynman path integral technique is applied for superintegrable potentials on two-dimensional spaces of non-constant curvature: these spaces are Darboux spaces D{sub I} and D{sub II}, respectively. On D{sub I} there are three and on D{sub II} foru such potentials, respectively. We are able to evaluate the path integral in most of the separating coordinate systems, leading to expressions for the Green functions, the discrete and continuous wave-functions, and the discrete energy-spectra. In some cases, however, the discrete spectrum cannot be stated explicitly, because it is either determined by a transcendental equation involving parabolic cylinder functions (Darboux space I), or by a higher order polynomial equation. The solutions on D{sub I} in particular show that superintegrable systems are not necessarily degenerate. We can also show how the limiting cases of flat space (Constant curvature zero) and the two-dimensional hyperboloid (constant negative curvature) emerge. (Orig.)

  19. Path Pascal

    Science.gov (United States)

    Campbell, R. H.; Kolstad, R. B.; Holle, D. F.; Miller, T. J.; Krause, P.; Horton, K.; Macke, T.

    1983-01-01

    Path Pascal is high-level experimental programming language based on PASCAL, which incorporates extensions for systems and real-time programming. Pascal is extended to treat real-time concurrent systems.

  20. Test on the effectiveness of the sum over paths approach in favoring the construction of an integrated knowledge of quantum physics in high school

    Science.gov (United States)

    Malgieri, Massimiliano; Onorato, Pasquale; De Ambrosis, Anna

    2017-06-01

    In this paper we present the results of a research-based teaching-learning sequence on introductory quantum physics based on Feynman's sum over paths approach in the Italian high school. Our study focuses on students' understanding of two founding ideas of quantum physics, wave particle duality and the uncertainty principle. In view of recent research reporting the fragmentation of students' mental models of quantum concepts after initial instruction, we collected and analyzed data using the assessment tools provided by knowledge integration theory. Our results on the group of n =14 students who performed the final test indicate that the functional explanation of wave particle duality provided by the sum over paths approach may be effective in leading students to build consistent mental models of quantum objects, and in providing them with a unified perspective on both the photon and the electron. Results on the uncertainty principle are less clear cut, as the improvements over traditional instruction appear less significant. Given the low number of students in the sample, this work should be interpreted as a case study, and we do not attempt to draw definitive conclusions. However, our study suggests that (i) the sum over paths approach may deserve more attention from researchers and educators as a possible route to introduce basic concepts of quantum physics in high school, and (ii) more research should be focused not only on the correctness of students' mental models on individual concepts, but also on the ability of students to connect different ideas and experiments related to quantum theory in an organized whole.

  1. Integrated Geophysical Investigation of Preferential Flow Paths at the Former Tyson Valley Powder Farm near Eureka, Missouri, May 2006

    Science.gov (United States)

    Burton, Bethany L.; Ball, Lyndsay B.; Stanton, Gregory P.; Hobza, Christopher M.

    2009-01-01

    In May 2006, the U.S. Geological Survey, in cooperation with the U.S. Army Corps of Engineers, conducted surface and borehole geophysical surveys at the former Tyson Valley Powder Farm near Eureka, Mo., to identify preferential pathways for potential contaminant transport along the bedrock surface and into dissolution-enhanced fractures. The Tyson Valley Powder Farm was formerly used as a munitions storage and disposal facility in the 1940s and 1950s, and the site at which the surveys were performed was a disposal area for munitions and waste solvents such as trichloroethylene and dichloroethylene. Direct-current resistivity and seismic refraction data were acquired on the surface; gamma, electromagnetic induction, and full waveform sonic logs were acquired in accessible boreholes. Through the combined interpretation of the seismic refraction tomographic and resistivity inversion results and borehole logs, inconsistencies in the bedrock surface were identified that may provide horizontal preferential flow paths for dense nonaqueous phase liquid contaminants. These results, interpreted and displayed in georeferenced three-dimensional space, should help to establish more effective monitoring and remediation strategies.

  2. Path-integral Monte Carlo simulation of time-reversal noninvariant bulk systems with a case study of rotating Yukawa gases

    Science.gov (United States)

    Haidekker Galambos, Tamás; Tőke, Csaba

    2018-02-01

    We elaborate on the methodology to simulate bulk systems in the absence of time-reversal symmetry by the phase-fixed path-integral Monte Carlo method under (possibly twisted) periodic boundary conditions. Such systems include two-dimensional electrons in the quantum Hall regime and rotating ultracold Bose and Fermi gases; time-reversal symmetry is broken by an external magnetic field and the Coriolis force, respectively. We provide closed-form expressions in terms of Jacobi elliptic functions for the thermal density matrix (or the Euclidean propagator) of a single particle on a flat torus under very general conditions. We then modify the multislice sampling method in order to sample paths by the magnitude of the complex-valued thermal density matrix. Finally, we demonstrate that these inventions let us study the vortex melting process of a two-dimensional Yukawa gas in terms of the de Boer interaction strength parameter, temperature, and rotation (Coriolis force). The bosonic case is relevant to ultracold Fermi-Fermi mixtures of widely different masses under rotation.

  3. Teaching Art a Greener Path: Integrating Sustainability Concepts of Interior Design Curriculum into the Art Education Curriculum

    Science.gov (United States)

    Hasio, Cindy; Crane, Tommy J.

    2014-01-01

    Interior design is seldom integrated within the general art education curriculum because the subject matter is generally segregated as a commercial art. However, the importance of interior design concepts of sustainability in art education can really help a student understand the scale and proportion of space and mass, and how sustainability is…

  4. Column CO2 Measurement From an Airborne Solid-State Double-Pulsed 2-Micron Integrated Path Differential Absorption Lidar

    Science.gov (United States)

    Singh, U. N.; Yu, J.; Petros, M.; Refaat, T. F.; Remus, R.; Fay, J.; Reithmaier, K.

    2014-01-01

    NASA LaRC is developing and integrating a double-Pulsed 2-micron direct detection IPDA lidar for CO2 column measurement from an airborne platform. The presentation will describe the development of the 2-micrometers IPDA lidar system and present the airborne measurement of column CO2 and will compare to in-situ measurement for various ground target of different reflectivity.

  5. On Hilbert space of paths

    International Nuclear Information System (INIS)

    Exner, P.; Kolerov, G.I.

    1980-01-01

    A Hilbert space of paths, the elements of which are determined by trigonometric series, was proposed and used recently by Truman. This space is shown to consist precisely of all absolutely continuous paths ending in the origin with square-integrable derivatives

  6. Path-integral bosonization of a non-local interaction and its application to the study of 1d many-body systems

    International Nuclear Information System (INIS)

    Naon, C.M.; Reichenbach, M.C. von; Trobo, M.L.

    1995-01-01

    We extend the path-integral approach to bosonization to the case in which the fermionic interaction is non-local. In particular we obtain a completely bosonized version of a Thirring-like model with currents coupled by general (symmetric) bilocal potentials. The model contains the Tomonaga-Luttinger model as a special case; exploiting this fact we study the basic properties of the 1d spinless fermionic gas: fermionic correlators, the spectrum of collective modes, etc. Finally, we discuss the generalization of our procedure to the non-abelian case, thus providing a new tool to be used in the study of 1d many-body systems with spin-flipping interactions. ((orig.))

  7. Die Baltischen handels-beziehungen mit Russland: Pfadabhängigkeiten trotz EU-Integration? Challenging the Baltic states trade relations with Russia: caught in path dependencies?

    Directory of Open Access Journals (Sweden)

    Klaus Schrader

    2015-08-01

    Full Text Available Against the backdrop of the lingering Ukraine crisis, Russia retaliated against the EU sanctions imposed on selected Russian enterprises and representatives by boycotting import goods from European and North American suppliers. Russian politicians further threatened to restrict the export of raw materials, especially natural gas, provided that the EU-Russia relations further worsen and sanctions gather momen-tum. Hence, the paper deals with the question to what extent the EU economies Estonia, Latvia and Lithuania are vulnerable to Russian reprisals and would experience comparatively high costs of the EU sanction policy. The focus of the analysis is on the Baltic States’ trade relations with Russia because these countries were integrated in the Soviet division of labor before regaining independence. It is analyzed whether path dependencies in Baltic trade patterns still exist that could make Estonia, Latvia and Lithuania more vulnerable to political blackmail than other EU countries.

  8. Utterance paths

    NARCIS (Netherlands)

    Zhang, Lei; Hoede, C.

    2002-01-01

    In this paper the concept of utterance path is investigated. In the theory of knowledge graphs sentences are represented by socalled sentence graphs. The sentence graph of a sentence can be obtained by structural parsing of the sentence. Here we study the problem of determining rules for uttering

  9. Integrating advanced 3D Mapping into Improved Hydrogeologic Frameworks, a Future path for Groundwater Modeling? Results from Western Nebraska

    Science.gov (United States)

    Cannia, J. C.; Abraham, J. D.; Peterson, S. M.; Sibray, S. S.

    2012-12-01

    The U.S. Geological Survey and its partners have collaborated to provide an innovative, advanced 3 dimensional hydrogeologic framework which was used in a groundwater model designed to test water management scenarios. Principal aquifers for the area mostly consist of Quaternary alluvium and Tertiary-age fluvial sediments which are heavily used for irrigation, municipal and environmental uses. This strategy used airborne electromagnetic (AEM) surveys, validated through sensitivity analysis of geophysical and geological ground truth to provide new geologic interpretation to characterize the hydrogeologic framework in the area. The base of aquifer created through this work leads to new interpretations of saturated thickness and groundwater connectivity to the surface water system. The current version of the groundwater model which uses the advanced hydrogeologic framework shows a distinct change in flow path orientation, timing and amount of base flow to the streams of the area. Ongoing efforts for development of the hydrogeologic framework development include subdivision of the aquifers into new hydrostratigraphic units based on analysis of geophysical and lithologic characteristics which will be incorporated into future groundwater models. The hydrostratigraphic units are further enhanced by Nuclear Magnetic Resonance (NMR) measurements to characterize aquifers. NMR measures the free water in the aquifer in situ allowing for a determination of hydraulic conductivity. NMR hydraulic conductivity values will be mapped to the hydrostratigraphic units, which in turn are incorporated into the latest versions of the groundwater model. The addition of innovative, advanced 3 dimensional hydrogeologic frameworks, which incorporates AEM and NMR, for groundwater modeling, has a definite advantage over traditional frameworks. These groundwater models represent the natural system at a level of reality not achievable by other methods, which lead to greater confidence in the

  10. Path Creation

    DEFF Research Database (Denmark)

    Karnøe, Peter; Garud, Raghu

    2012-01-01

    This paper employs path creation as a lens to follow the emergence of the Danish wind turbine cluster. Supplier competencies, regulations, user preferences and a market for wind power did not pre-exist; all had to emerge in a tranformative manner involving multiple actors and artefacts. Competenc......This paper employs path creation as a lens to follow the emergence of the Danish wind turbine cluster. Supplier competencies, regulations, user preferences and a market for wind power did not pre-exist; all had to emerge in a tranformative manner involving multiple actors and artefacts....... Competencies emerged through processes and mechanisms such as co-creation that implicated multiple learning processes. The process was not an orderly linear one as emergent contingencies influenced the learning processes. An implication is that public policy to catalyse clusters cannot be based...

  11. Microwave measurements of temperature profiles, integrated water vapour, and liquid water path at Thule Air Base, Greenland.

    Science.gov (United States)

    Pace, Giandomenico; Di Iorio, Tatiana; di Sarra, Alcide; Iaccarino, Antonio; Meloni, Daniela; Mevi, Gabriele; Muscari, Giovanni; Cacciani, Marco

    2017-04-01

    A RPG Humidity And Temperature PROfiler (HATPRO-G2 ) radiometer was installed at Thule Air Base (76.5° N, 68.8° W), Greenland, in June 2016 in the framework of the Study of the water VApour in the polar AtmosPhere (SVAAP) project. The Danish Meteorological Institute started measurements of atmospheric properties at Thule Air Base in early '90s. The Thule High Arctic Atmospheric Observatory (THAAO) has grown in size and observing capabilities during the last three decades through the international effort of United States (NCAR and University of Alaska Fairbanks) and Italian (ENEA, INGV, University of Roma and Firenze) institutions (http://www.thuleatmos-it.it). Within this context, the intensive field campaign of the SVAAP project was aimed at the investigation of the surface radiation budget and took place from 5 to 28 July, 2016. After the summer campaign the HATPRO has continued to operate in order to monitor the annual variability of the temperature profile and integrated water vapour as well as the presence and characteristics of liquid clouds in the Artic environment. The combined use of the HATPRO together with other automatic instruments, such as a new microwave spectrometer (the water Vapour Emission Spectrometer for Polar Atmosphere VESPA-22), upward- and downward-looking pyranometers and pyrgeometers, a zenith-looking pyrometer operating in the 9.6-11.5 µm spectral range, an all sky camera, and a meteorological station, allows to investigate the clouds' physical and optical properties, as well as their impact on the surface radiation budget. This study will present and discuss the first few months of HATPRO observations; the effectiveness of the statistical retrieval used to derive the physical parameters from the HATPRO brightness temperatures will also be investigated through the comparison of the temperature and humidity profiles, and integrated water vapour, with data from radiosondes launched during the summer campaign and in winter time.

  12. On the Path to SunShot. Emerging Issues and Challenges in Integrating Solar with the Distribution System

    Energy Technology Data Exchange (ETDEWEB)

    Palmintier, Bryan [National Renewable Energy Lab. (NREL), Golden, CO (United States); Broderick, Robert [Sandia National Lab. (SNL-NM), Albuquerque, NM (United States); Mather, Barry [National Renewable Energy Lab. (NREL), Golden, CO (United States); Coddington, Michael [National Renewable Energy Lab. (NREL), Golden, CO (United States); Baker, Kyri [National Renewable Energy Lab. (NREL), Golden, CO (United States); Ding, Fei [National Renewable Energy Lab. (NREL), Golden, CO (United States); Reno, Matthew [Sandia National Lab. (SNL-NM), Albuquerque, NM (United States); Lave, Matthew [Sandia National Lab. (SNL-NM), Albuquerque, NM (United States); Bharatkumar, Ashwini [Massachusetts Inst. of Technology (MIT), Cambridge, MA (United States)

    2016-05-01

    This report analyzes distribution-integration challenges, solutions, and research needs in the context of distributed generation from PV (DGPV) deployment to date and the much higher levels of deployment expected with achievement of the U.S. Department of Energy's SunShot targets. Recent analyses have improved estimates of the DGPV hosting capacities of distribution systems. This report uses these results to statistically estimate the minimum DGPV hosting capacity for the contiguous United States using traditional inverters of approximately 170 GW without distribution system modifications. This hosting capacity roughly doubles if advanced inverters are used to manage local voltage and additional minor, low-cost changes could further increase these levels substantially. Key to achieving these deployment levels at minimum cost is siting DGPV based on local hosting capacities, suggesting opportunities for regulatory, incentive, and interconnection innovation. Already, pre-computed hosting capacity is beginning to expedite DGPV interconnection requests and installations in select regions; however, realizing SunShot-scale deployment will require further improvements to DGPV interconnection processes, standards and codes, and compensation mechanisms so they embrace the contributions of DGPV to system-wide operations. SunShot-scale DGPV deployment will also require unprecedented coordination of the distribution and transmission systems. This includes harnessing DGPV's ability to relieve congestion and reduce system losses by generating closer to loads; minimizing system operating costs and reserve deployments through improved DGPV visibility; developing communication and control architectures that incorporate DGPV into system operations; providing frequency response, transient stability, and synthesized inertia with DGPV in the event of large-scale system disturbances; and potentially managing reactive power requirements due to large-scale deployment of advanced

  13. Engineering the path to higher-order thinking in elementary education: A problem-based learning approach for STEM integration

    Science.gov (United States)

    Rehmat, Abeera Parvaiz

    As we progress into the 21st century, higher-order thinking skills and achievement in science and math are essential to meet the educational requirement of STEM careers. Educators need to think of innovative ways to engage and prepare students for current and future challenges while cultivating an interest among students in STEM disciplines. An instructional pedagogy that can capture students' attention, support interdisciplinary STEM practices, and foster higher-order thinking skills is problem-based learning. Problem-based learning embedded in the social constructivist view of teaching and learning (Savery & Duffy, 1995) promotes self-regulated learning that is enhanced through exploration, cooperative social activity, and discourse (Fosnot, 1996). This quasi-experimental mixed methods study was conducted with 98 fourth grade students. The study utilized STEM content assessments, a standardized critical thinking test, STEM attitude survey, PBL questionnaire, and field notes from classroom observations to investigate the impact of problem-based learning on students' content knowledge, critical thinking, and their attitude towards STEM. Subsequently, it explored students' experiences of STEM integration in a PBL environment. The quantitative results revealed a significant difference between groups in regards to their content knowledge, critical thinking skills, and STEM attitude. From the qualitative results, three themes emerged: learning approaches, increased interaction, and design and engineering implementation. From the overall data set, students described the PBL environment to be highly interactive that prompted them to employ multiple approaches, including design and engineering to solve the problem.

  14. Utterance paths

    OpenAIRE

    Zhang, Lei; Hoede, C.

    2002-01-01

    In this paper the concept of utterance path is investigated. In the theory of knowledge graphs sentences are represented by socalled sentence graphs. The sentence graph of a sentence can be obtained by structural parsing of the sentence. Here we study the problem of determining rules for uttering the sentence graph. Given a sentence graph there are usually several ways how such a graph can be brought under words, i.e. can be uttered. The sentences arising from these ways of uttering consist o...

  15. Integration of Building Information Modeling and Critical Path Method Schedules to Simulate the Impact of Temperature and Humidity at the Project Level

    Directory of Open Access Journals (Sweden)

    Yongwei Shan

    2014-07-01

    Full Text Available Steel construction activities are often undertaken in an environment with limited climate control. Both hot and cold temperatures can physically and psychologically affect construction workers, thus decreasing their productivity. Temperature and humidity are two factors that constantly exert forces on workers and influence their performance and efficiency. Previous studies have established a relationship between labor productivity and temperature and humidity. This research is built on the existing body of knowledge and develops a framework of integrating building information modeling (BIM with a lower level critical path method (CPM schedule to simulate the overall impact of temperature and humidity on a healthcare facility’s structural steel installation project in terms of total man hours required to build the project. This research effort utilized historical weather data of four cities across the U.S., with each city having workable seasons year-round and conducted a baseline assessment to test if various project starting dates and locations could significantly impact the project’s schedule performance. It was found that both varied project start dates and locations can significantly contribute to the difference in the man hours required to build the model project and that the project start date and location can have an interaction effect. This study contributes to the overall body of knowledge by providing a framework that can help practitioners better understand the overall impact of a productivity influencing factor at a project level, in order to facilitate better decision making.

  16. Molecular collective dynamics in solid para-hydrogen and ortho-deuterium: The Parrinello-Rahman-type path integral centroid molecular dynamics approach

    Science.gov (United States)

    Saito, Hiroaki; Nagao, Hidemi; Nishikawa, Kiyoshi; Kinugawa, Kenichi

    2003-07-01

    The single-particle and collective dynamics of hydrogen/deuterium molecules in solid hcp para-hydrogen (p-H2) and ortho-deuterium (o-D2) has been investigated by using the path integral centroid molecular dynamics (CMD) simulations at zero-pressure and 5.4 and 5.0 K, respectively. For this purpose, we have newly unified the standard CMD method with the Parrinello-Rahman-Nosé-Hoover-chain-type isothermal-isobaric technique. The phonon density of states have been obtained and the dynamic structure factors have been calculated to observe the phonon dispersion relations of both crystals. For solid p-H2, the high energy edge of the phonon energies of solid p-H2 is >13 meV, and the calculated phonon energies are significantly higher than those observed in Nielsen's previous neutron scattering experiments in the energy region >9 meV. The relationship between the present results and the data reported so far is discussed to resolve the outstanding controversy regarding the phonon energies in solid p-H2. On the other hand, the excitation energies for solid o-D2 are in fairly good agreement with those of the neutron experiments. The calculated isothermal compressibility of solid p-H2 is found to be very close to the experimental result.

  17. Path integral density matrix dynamics: a method for calculating time-dependent properties in thermal adiabatic and non-adiabatic systems.

    Science.gov (United States)

    Habershon, Scott

    2013-09-14

    We introduce a new approach for calculating quantum time-correlation functions and time-dependent expectation values in many-body thermal systems; both electronically adiabatic and non-adiabatic cases can be treated. Our approach uses a path integral simulation to sample an initial thermal density matrix; subsequent evolution of this density matrix is equivalent to solution of the time-dependent Schrödinger equation, which we perform using a linear expansion of Gaussian wavepacket basis functions which evolve according to simple classical-like trajectories. Overall, this methodology represents a formally exact approach for calculating time-dependent quantum properties; by introducing approximations into both the imaginary-time and real-time propagations, this approach can be adapted for complex many-particle systems interacting through arbitrary potentials. We demonstrate this method for the spin Boson model, where we find good agreement with numerically exact calculations. We also discuss future directions of improvement for our approach with a view to improving accuracy and efficiency.

  18. Self-Calibration and Laser Energy Monitor Validations for a Double-Pulsed 2-Micron CO2 Integrated Path Differential Absorption Lidar Application

    Science.gov (United States)

    Refaat, Tamer F.; Singh, Upendra N.; Petros, Mulugeta; Remus, Ruben; Yu, Jirong

    2015-01-01

    Double-pulsed 2-micron integrated path differential absorption (IPDA) lidar is well suited for atmospheric CO2 remote sensing. The IPDA lidar technique relies on wavelength differentiation between strong and weak absorbing features of the gas normalized to the transmitted energy. In the double-pulse case, each shot of the transmitter produces two successive laser pulses separated by a short interval. Calibration of the transmitted pulse energies is required for accurate CO2 measurement. Design and calibration of a 2-micron double-pulse laser energy monitor is presented. The design is based on an InGaAs pin quantum detector. A high-speed photo-electromagnetic quantum detector was used for laser-pulse profile verification. Both quantum detectors were calibrated using a reference pyroelectric thermal detector. Calibration included comparing the three detection technologies in the single-pulsed mode, then comparing the quantum detectors in the double-pulsed mode. In addition, a self-calibration feature of the 2-micron IPDA lidar is presented. This feature allows one to monitor the transmitted laser energy, through residual scattering, with a single detection channel. This reduces the CO2 measurement uncertainty. IPDA lidar ground validation for CO2 measurement is presented for both calibrated energy monitor and self-calibration options. The calibrated energy monitor resulted in a lower CO2 measurement bias, while self-calibration resulted in a better CO2 temporal profiling when compared to the in situ sensor.

  19. On the accuracy of integrated water vapor observations and the potential for mitigating electromagnetic path delay error in InSAR

    Directory of Open Access Journals (Sweden)

    D. Cimini

    2012-05-01

    Full Text Available A field campaign was carried out in the framework of the Mitigation of Electromagnetic Transmission errors induced by Atmospheric Water Vapour Effects (METAWAVE project sponsored by the European Space Agency (ESA to investigate the accuracy of currently available sources of atmospheric columnar integrated water vapor measurements. The METAWAVE campaign took place in Rome, Italy, for the 2-week period from 19 September to 4 October 2008. The collected dataset includes observations from ground-based microwave radiometers and Global Positioning System (GPS receivers, from meteorological numerical model analysis and predictions, from balloon-borne in-situ radiosoundings, as well as from spaceborne infrared radiometers. These different sources of integrated water vapor (IWV observations have been analyzed and compared to quantify the accuracy and investigate the potential for mitigating IWV-related electromagnetic path delay errors in Interferometric Synthetic Aperture Radar (InSAR imaging. The results, which include a triple collocation analysis accounting for errors inherently present in every IWV measurements, are valid not only to InSAR but also to any other application involving water vapor sensing. The present analysis concludes that the requirements for mitigating the effects of turbulent water vapor component into InSAR are significantly higher than the accuracy of the instruments analyzed here. Nonetheless, information on the IWV vertical stratification from satellite observations, numerical models, and GPS receivers may provide valuable aid to suppress the long spatial wavelength (>20 km component of the atmospheric delay, and thus significantly improve the performances of InSAR phase unwrapping techniques.

  20. Dead reckoning (path integration) requires the hippocampal formation: evidence from spontaneous exploration and spatial learning tasks in light (allothetic) and dark (idiothetic) tests.

    Science.gov (United States)

    Whishaw, I Q; Hines, D J; Wallace, D G

    2001-12-14

    Animals navigate using cues generated by their own movements (self-movement cues or idiothetic cues), as well as the cues they encounter in their environment (distal cues or allothetic cues). Animals use these cues to navigate in two different ways. When dead reckoning (deduced reckoning or path integration), they integrate self-movement cues over time to locate a present position or to return to a starting location. When piloting, they use allothetic cues as beacons, or they use the relational properties of allothetic cues to locate places in space. The neural structures involved in cue use and navigational strategies are still poorly understood, although considerable attention is directed toward the contributions of the hippocampal formation (hippocampus and associated pathways and structures, including the fimbria-fornix and the retrosplenial cortex). In the present study, using tests in allothetic and idiothetic paradigms, we present four lines of evidence to support the hypothesis that the hippocampal formation plays a central role in dead reckoning. (1) Control but not fimbria-fornix lesion rats can return to a novel refuge location in both light and dark (infrared) food carrying tasks. (2). Control but not fimbria-fornix lesion rats make periodic direct high velocity returns to a starting location in both light and dark exploratory tests. Control but not fimbria-fornix rats trained in the light to carry food from a fixed location to a refuge are able to maintain accurate outward and homebound trajectories when tested in the dark. (3). Control but not fimbria-fornix rats are able to correct an outward trajectory to a food source when the food source is moved when allothetic cues are present. These, tests of spontaneous exploration and foraging suggest a role for the hippocampal formation in dead reckoning.

  1. Path integral of unimodular gravity

    Science.gov (United States)

    de León Ardón, R.; Ohta, N.; Percacci, R.

    2018-01-01

    We compute the one-loop effective action in unimodular gravity, starting from two different classical formulations of the theory. We find that the effective action is the same in both cases, and agrees with the one of general relativity.

  2. Hilbert spaces from path integrals

    Energy Technology Data Exchange (ETDEWEB)

    Dowker, Fay; Johnston, Steven [Theoretical Physics, Blackett Laboratory, Imperial College London, London, SW7 2AZ (United Kingdom); Sorkin, Rafael D, E-mail: f.dowker@imperial.ac.u, E-mail: steven.johnston02@imperial.ac.u, E-mail: rsorkin@perimeterinstitute.c [Perimeter Institute, 31 Caroline Street North, Waterloo ON, N2L 2Y5 (Canada)

    2010-07-09

    It is shown that a Hilbert space can be constructed for a quantum system starting from a framework in which histories are fundamental. The decoherence functional provides the inner product on this 'history Hilbert space'. It is also shown that the history Hilbert space is the standard Hilbert space in the case of non-relativistic quantum mechanics.

  3. Efficient methods for including quantum effects in Monte Carlo calculations of large systems: extension of the displaced points path integral method and other effective potential methods to calculate properties and distributions.

    Science.gov (United States)

    Mielke, Steven L; Dinpajooh, Mohammadhasan; Siepmann, J Ilja; Truhlar, Donald G

    2013-01-07

    We present a procedure to calculate ensemble averages, thermodynamic derivatives, and coordinate distributions by effective classical potential methods. In particular, we consider the displaced-points path integral (DPPI) method, which yields exact quantal partition functions and ensemble averages for a harmonic potential and approximate quantal ones for general potentials, and we discuss the implementation of the new procedure in two Monte Carlo simulation codes, one that uses uncorrelated samples to calculate absolute free energies, and another that employs Metropolis sampling to calculate relative free energies. The results of the new DPPI method are compared to those from accurate path integral calculations as well as to results of two other effective classical potential schemes for the case of an isolated water molecule. In addition to the partition function, we consider the heat capacity and expectation values of the energy, the potential energy, the bond angle, and the OH distance. We also consider coordinate distributions. The DPPI scheme performs best among the three effective potential schemes considered and achieves very good accuracy for all of the properties considered. A key advantage of the effective potential schemes is that they display much lower statistical sampling variances than those for accurate path integral calculations. The method presented here shows great promise for including quantum effects in calculations on large systems.

  4. Path integral Monte Carlo simulations of H{sub 2} adsorbed to lithium-doped benzene: A model for hydrogen storage materials

    Energy Technology Data Exchange (ETDEWEB)

    Lindoy, Lachlan P.; Kolmann, Stephen J.; D’Arcy, Jordan H.; Jordan, Meredith J. T., E-mail: m.jordan@chem.usyd.edu.au [School of Chemistry, The University of Sydney, Sydney (Australia); Crittenden, Deborah L. [Department of Chemistry, University of Canterbury, Christchurch (New Zealand)

    2015-11-21

    Finite temperature quantum and anharmonic effects are studied in H{sub 2}–Li{sup +}-benzene, a model hydrogen storage material, using path integral Monte Carlo (PIMC) simulations on an interpolated potential energy surface refined over the eight intermolecular degrees of freedom based upon M05-2X/6-311+G(2df,p) density functional theory calculations. Rigid-body PIMC simulations are performed at temperatures ranging from 77 K to 150 K, producing both quantum and classical probability density histograms describing the adsorbed H{sub 2}. Quantum effects broaden the histograms with respect to their classical analogues and increase the expectation values of the radial and angular polar coordinates describing the location of the center-of-mass of the H{sub 2} molecule. The rigid-body PIMC simulations also provide estimates of the change in internal energy, ΔU{sub ads}, and enthalpy, ΔH{sub ads}, for H{sub 2} adsorption onto Li{sup +}-benzene, as a function of temperature. These estimates indicate that quantum effects are important even at room temperature and classical results should be interpreted with caution. Our results also show that anharmonicity is more important in the calculation of U and H than coupling—coupling between the intermolecular degrees of freedom becomes less important as temperature increases whereas anharmonicity becomes more important. The most anharmonic motions in H{sub 2}–Li{sup +}-benzene are the “helicopter” and “ferris wheel” H{sub 2} rotations. Treating these motions as one-dimensional free and hindered rotors, respectively, provides simple corrections to standard harmonic oscillator, rigid rotor thermochemical expressions for internal energy and enthalpy that encapsulate the majority of the anharmonicity. At 150 K, our best rigid-body PIMC estimates for ΔU{sub ads} and ΔH{sub ads} are −13.3 ± 0.1 and −14.5 ± 0.1 kJ mol{sup −1}, respectively.

  5. Test on the Effectiveness of the Sum over Paths Approach in Favoring the Construction of an Integrated Knowledge of Quantum Physics in High School

    Science.gov (United States)

    Malgieri, Massimiliano; Onorato, Pasquale; De Ambrosis, Anna

    2017-01-01

    In this paper we present the results of a research-based teaching-learning sequence on introductory quantum physics based on Feynman's sum over paths approach in the Italian high school. Our study focuses on students' understanding of two founding ideas of quantum physics, wave particle duality and the uncertainty principle. In view of recent…

  6. Path coupling and aggregate path coupling

    CERN Document Server

    Kovchegov, Yevgeniy

    2018-01-01

    This book describes and characterizes an extension to the classical path coupling method applied to statistical mechanical models, referred to as aggregate path coupling. In conjunction with large deviations estimates, the aggregate path coupling method is used to prove rapid mixing of Glauber dynamics for a large class of statistical mechanical models, including models that exhibit discontinuous phase transitions which have traditionally been more difficult to analyze rigorously. The book shows how the parameter regions for rapid mixing for several classes of statistical mechanical models are derived using the aggregate path coupling method.

  7. Development of a modelling learning path

    NARCIS (Netherlands)

    van Buuren, O.P.M.

    2014-01-01

    A learning path on computational modelling, integrated into the Dutch lower secondary physics curriculum has been developed and tested in school practice. The instructional materials that have been developed cover the first two years of this curriculum. In the learning path, modelling has been

  8. Contributions of foreign, domestic and natural emissions to US ozone estimated using the path-integral method in CAMx nested within GEOS-Chem

    Science.gov (United States)

    Dunker, Alan M.; Koo, Bonyoung; Yarwood, Greg

    2017-10-01

    The Goddard Earth Observing System global chemical transport (GEOS-Chem) model was used at 2° × 2.5° resolution to simulate ozone formation for a base case representing year 2010 and a natural background case without worldwide anthropogenic emissions. These simulations provided boundary concentrations for base and natural background simulations with the Comprehensive Air Quality Model with Extensions (CAMx) on a North American domain (one-way nested) at 12 km × 12 km resolution over March-September 2010. The predicted maximum daily average 8 h (MDA8) background ozone for the US is largest in the mountainous areas of Colorado, New Mexico, Arizona, and California. The background MDA8 ozone in some of these locations exceeds 60 ppb, when averaged over the 10 days with the largest base-case ozone (T10base average). The background ozone generally becomes both a larger fraction of the base-case ozone in the western US and a smaller fraction in the eastern US when proceeding from spring to summer to the T10base average. The ozone difference between the base and background cases represents the increment to ozone from all anthropogenic sources. The path-integral method was applied to allocate this anthropogenic ozone increment to US anthropogenic emissions, Canadian/Mexican anthropogenic emissions, and the anthropogenic components of the lateral and top boundary concentrations (BCs). Using the T10base average MDA8 ozone, the relative importance of the sources is generally US emissions > anthropogenic lateral BCs > Canadian/Mexican emissions ≫ anthropogenic top BCs. Specifically, for 10 US urban areas, the source contributions were 12-53 ppb for US emissions, 3-9 ppb for lateral BCs, 0.2-3 ppb for Canadian/Mexican emissions, and ≤ 0.1 ppb for top BCs. The contributions of the lateral BCs are largest for the higher-elevation US sites in the Intermountain West and along the western boundary of the domain. In Denver, for example, the lateral BCs contribute 44 % to the T

  9. A Path Space Extension for Robust Light Transport Simulation

    DEFF Research Database (Denmark)

    Hachisuka, Toshiya; Pantaleoni, Jacopo; Jensen, Henrik Wann

    2012-01-01

    We present a new sampling space for light transport paths that makes it possible to describe Monte Carlo path integration and photon density estimation in the same framework. A key contribution of our paper is the introduction of vertex perturbations, which extends the space of paths with loosely...... coupled connections. The new framework enables the computation of path probabilities in the same space under the same measure, which allows us to use multiple importance sampling to combine Monte Carlo path integration and photon density estimation. The resulting algorithm, unified path sampling, can...... robustly render complex combinations and glossy surfaces and caustics that are problematic for existing light transport simulation methods....

  10. Development of an Airborne Triple-Pulse 2-Micron Integrated Path Differential Absorption Lidar (IPDA) for Simultaneous Airborne Column Measurements of Carbon Dioxide and Water Vapor in the Atmosphere

    Science.gov (United States)

    Singh, Upendra N.; Petros, Mulugeta; Refaat, Tamer F.; Yu, Jirong; Antill, Charles W.; Remus, Ruben

    2016-01-01

    This presentation will provide status and details of an airborne 2-micron triple-pulse integrated path differential absorption (IPDA) lidar being developed at NASA Langley Research Center with support from NASA ESTO Instrument Incubator Program. The development of this active optical remote sensing IPDA instrument is targeted for measuring both atmospheric carbon dioxide and water vapor in the atmosphere from an airborne platform. This presentation will focus on the advancement of the 2-micron triple-pulse IPDA lidar development. Updates on the state-of-the-art triple-pulse laser transmitter will be presented including the status of seed laser locking, wavelength control, receiver and detector upgrades, laser packaging and lidar integration. Future plan for IPDA lidar system for ground integration, testing and flight validation will also be presented.

  11. The path of code linting

    CERN Multimedia

    CERN. Geneva

    2017-01-01

    Join the path of code linting and discover how it can help you reach higher levels of programming enlightenment. Today we will cover how to embrace code linters to offload cognitive strain on preserving style standards in your code base as well as avoiding error-prone constructs. Additionally, I will show you the journey ahead for integrating several code linters in the programming tools your already use with very little effort.

  12. Moments of inertia and the shapes of Brownian paths

    International Nuclear Information System (INIS)

    Fougere, F.; Desbois, J.

    1993-01-01

    The joint probability law of the principal moments of inertia of Brownian paths (open or closed) is computed, using constrained path integrals and Random Matrix Theory. The case of two-dimensional paths is discussed in detail. In particular, it is shown that the ratio of the average values of the largest and smallest moments is equal to 4.99 (open paths) and 3.07 (closed paths). Results of numerical simulations are also presented, which include investigation of the relationships between the moments of inertia and the arithmetic area enclosed by a path. (authors) 28 refs., 2 figs

  13. Path space measures for Dirac and Schroedinger equations: Nonstandard analytical approach

    International Nuclear Information System (INIS)

    Nakamura, T.

    1997-01-01

    A nonstandard path space *-measure is constructed to justify the path integral formula for the Dirac equation in two-dimensional space endash time. A standard measure as well as a standard path integral is obtained from it. We also show that, even for the Schroedinger equation, for which there is no standard measure appropriate for a path integral, there exists a nonstandard measure to define a *-path integral whose standard part agrees with the ordinary path integral as defined by a limit from time-slice approximant. copyright 1997 American Institute of Physics

  14. Altered Processing and Integration of Multisensory Bodily Representations and Signals in Eating Disorders: A Possible Path Toward the Understanding of Their Underlying Causes.

    Science.gov (United States)

    Riva, Giuseppe; Dakanalis, Antonios

    2018-01-01

    According to the Diagnostic and Statistical Manual of Mental Disorders (DSM V) eating problems are the clinical core of eating disorders (EDs). However, the importance of shape and weight overvaluation symptoms in these disorders underlines the critical role of the experience of the body in the etiology of EDs. This article suggests that the transdiagnostic centrality of these symptoms in individuals with EDs may reflect a deficit in the processing and integration of multisensory bodily representations and signals. Multisensory body integration is a critical cognitive and perceptual process, allowing the individual to protect and extend her/his boundaries at both the homeostatic and psychological levels. To achieve this goal the brain integrates sensory data arriving from real-time multiple sensory modalities and internal bodily information with predictions made using the stored information about the body from conceptual, perceptual, and episodic memory. In this view the emotional, visual, tactile, proprioceptive and interoceptive deficits reported by many authors in individuals with EDs may reflect a broader impairment in multisensory body integration that affects the individual's abilities: (a) to identify the relevant interoceptive signals that predict potential pleasant (or aversive) consequences; and (b) to modify/correct the autobiographical allocentric (observer view) memories of body related events (self-objectified memories). Based on this view, the article also proposes a strategy, based on new technologies (i.e., virtual reality and brain/body stimulation), for using crossmodal associations to reactivate and correct the multisensory body integration processes.

  15. Altered Processing and Integration of Multisensory Bodily Representations and Signals in Eating Disorders: A Possible Path Toward the Understanding of Their Underlying Causes

    Directory of Open Access Journals (Sweden)

    Giuseppe Riva

    2018-02-01

    Full Text Available According to the Diagnostic and Statistical Manual of Mental Disorders (DSM V eating problems are the clinical core of eating disorders (EDs. However, the importance of shape and weight overvaluation symptoms in these disorders underlines the critical role of the experience of the body in the etiology of EDs. This article suggests that the transdiagnostic centrality of these symptoms in individuals with EDs may reflect a deficit in the processing and integration of multisensory bodily representations and signals. Multisensory body integration is a critical cognitive and perceptual process, allowing the individual to protect and extend her/his boundaries at both the homeostatic and psychological levels. To achieve this goal the brain integrates sensory data arriving from real-time multiple sensory modalities and internal bodily information with predictions made using the stored information about the body from conceptual, perceptual, and episodic memory. In this view the emotional, visual, tactile, proprioceptive and interoceptive deficits reported by many authors in individuals with EDs may reflect a broader impairment in multisensory body integration that affects the individual’s abilities: (a to identify the relevant interoceptive signals that predict potential pleasant (or aversive consequences; and (b to modify/correct the autobiographical allocentric (observer view memories of body related events (self-objectified memories. Based on this view, the article also proposes a strategy, based on new technologies (i.e., virtual reality and brain/body stimulation, for using crossmodal associations to reactivate and correct the multisensory body integration processes.

  16. Integration of On-Column Chemical Reactions in Protein Characterization by Liquid Chromatography/Mass Spectrometry: Cross-Path Reactive Chromatography.

    Science.gov (United States)

    Pawlowski, Jake W; Carrick, Ian; Kaltashov, Igor A

    2018-01-16

    Profiling of complex proteins by means of mass spectrometry (MS) frequently requires that certain chemical modifications of their covalent structure (e.g., reduction of disulfide bonds), be carried out prior to the MS or MS/MS analysis. Traditionally, these chemical reactions take place in the off-line mode to allow the excess reagents (the majority of which interfere with the MS measurements and degrade the analytical signal) to be removed from the protein solution prior to MS measurements. In addition to a significant increase in the analysis time, chemical reactions may result in a partial or full loss of the protein if the modifications adversely affect its stability, e.g,, making it prone to aggregation. In this work we present a new approach to solving this problem by carrying out the chemical reactions online using the reactive chromatography scheme on a size exclusion chromatography (SEC) platform with MS detection. This is achieved by using a cross-path reaction scheme, i.e., by delaying the protein injection onto the SEC column (with respect to the injection of the reagent plug containing a disulfide-reducing agent), which allows the chemical reactions to be carried out inside the column for a limited (and precisely controlled) period of time, while the two plugs overlap inside the column. The reduced protein elutes separately from the unconsumed reagents, allowing the signal suppression in ESI to be avoided and enabling sensitive MS detection. The new method is used to measure fucosylation levels of a plasma protein haptoglobin at the whole protein level following online reduction of disulfide-linked tetrameric species to monomeric units. The feasibility of top-down fragmentation of disulfide-containing proteins is also demonstrated using β 2 -microglobulin and a monoclonal antibody (mAb). The new online technique is both robust and versatile, as the cross-path scheme can be readily expanded to include multiple reactions in a single experiment (as

  17. A Novel Satellite Mission Concept for Upper Air Water Vapour, Aerosol and Cloud Observations Using Integrated Path Differential Absorption LiDAR Limb Sounding

    Directory of Open Access Journals (Sweden)

    Claudia Weitnauer

    2012-03-01

    Full Text Available We propose a new satellite mission to deliver high quality measurements of upper air water vapour. The concept centres around a LiDAR in limb sounding by occultation geometry, designed to operate as a very long path system for differential absorption measurements. We present a preliminary performance analysis with a system sized to send 75 mJ pulses at 25 Hz at four wavelengths close to 935 nm, to up to 5 microsatellites in a counter-rotating orbit, carrying retroreflectors characterized by a reflected beam divergence of roughly twice the emitted laser beam divergence of 15 µrad. This provides water vapour profiles with a vertical sampling of 110 m; preliminary calculations suggest that the system could detect concentrations of less than 5 ppm. A secondary payload of a fairly conventional medium resolution multispectral radiometer allows wide-swath cloud and aerosol imaging. The total weight and power of the system are estimated at 3 tons and 2,700 W respectively. This novel concept presents significant challenges, including the performance of the lasers in space, the tracking between the main spacecraft and the retroreflectors, the refractive effects of turbulence, and the design of the telescopes to achieve a high signal-to-noise ratio for the high precision measurements. The mission concept was conceived at the Alpbach Summer School 2010.

  18. Path probabilities of continuous time random walks

    International Nuclear Information System (INIS)

    Eule, Stephan; Friedrich, Rudolf

    2014-01-01

    Employing the path integral formulation of a broad class of anomalous diffusion processes, we derive the exact relations for the path probability densities of these processes. In particular, we obtain a closed analytical solution for the path probability distribution of a Continuous Time Random Walk (CTRW) process. This solution is given in terms of its waiting time distribution and short time propagator of the corresponding random walk as a solution of a Dyson equation. Applying our analytical solution we derive generalized Feynman–Kac formulae. (paper)

  19. Path probabilities of continuous time random walks

    Science.gov (United States)

    Eule, Stephan; Friedrich, Rudolf

    2014-12-01

    Employing the path integral formulation of a broad class of anomalous diffusion processes, we derive the exact relations for the path probability densities of these processes. In particular, we obtain a closed analytical solution for the path probability distribution of a Continuous Time Random Walk (CTRW) process. This solution is given in terms of its waiting time distribution and short time propagator of the corresponding random walk as a solution of a Dyson equation. Applying our analytical solution we derive generalized Feynman-Kac formulae.

  20. Path optimization method for the sign problem

    Directory of Open Access Journals (Sweden)

    Ohnishi Akira

    2018-01-01

    Full Text Available We propose a path optimization method (POM to evade the sign problem in the Monte-Carlo calculations for complex actions. Among many approaches to the sign problem, the Lefschetz-thimble path-integral method and the complex Langevin method are promising and extensively discussed. In these methods, real field variables are complexified and the integration manifold is determined by the flow equations or stochastically sampled. When we have singular points of the action or multiple critical points near the original integral surface, however, we have a risk to encounter the residual and global sign problems or the singular drift term problem. One of the ways to avoid the singular points is to optimize the integration path which is designed not to hit the singular points of the Boltzmann weight. By specifying the one-dimensional integration-path as z = t +if(t(f ϵ R and by optimizing f(t to enhance the average phase factor, we demonstrate that we can avoid the sign problem in a one-variable toy model for which the complex Langevin method is found to fail. In this proceedings, we propose POM and discuss how we can avoid the sign problem in a toy model. We also discuss the possibility to utilize the neural network to optimize the path.

  1. Multi-Dimensional Path Queries

    DEFF Research Database (Denmark)

    Bækgaard, Lars

    1998-01-01

    that connects a pair of paths. A path expression is a function that maps a set of path sets into a path set. Path sets can be joined, filtering conditions can restrict the set of qualifying paths, and aggregation functions can be applied to path elements. In particular, the aggregation function SET can be used...... to create nested path structures. We present an SQL-like query language that is based on path expressions and we show how to use it to express multi-dimensional path queries that are suited for advanced data analysis in decision support environments like data warehousing environments...

  2. Path integration absent in scent-tracking fimbria-fornix rats: evidence for hippocampal involvement in "sense of direction" and "sense of distance" using self-movement cues.

    Science.gov (United States)

    Whishaw, I Q; Gorny, B

    1999-06-01

    Allothetic and idiothetic navigation strategies use very different cue constellations and computational processes. Allothetic navigation requires the use of the relationships between relatively stable external (visual, olfactory, auditory) cues, whereas idiothetic navigation requires the integration of cues generated by self-movement and/or efferent copy of movement commands. The flexibility with which animals can switch between these strategies and the neural structures that support these strategies are not well understood. By capitalizing on the proclivity of foraging rats to carry large food pellets back to a refuge for eating, the present study examined the contribution of the hippocampus to the use of allothetic versus idiothetic navigation strategies. Control rats and fimbria-fornix-ablated rats were trained to follow linear, polygonal, and octagonal scent trails that led to a piece of food. The ability of the rats to return to the refuge with the food via the shortest route using allothetic cues (visual cues and/or the odor trail available) or using ideothetic cues (the odor trail removed and the rats blindfolded or tested in infrared light) was examined. Control rats "closed the polygon" by returning directly home in all cue conditions. Fimbria-fornix rats successfully used allothetic cues (closed the polygon using visual cues or tracked back on the string) but were insensitive to the direction and distance of the refuge and were lost when restricted to idiothetic cues. The results support the hypothesis that the hippocampal formation is necessary for navigation requiring the integration of idiothetic cues.

  3. On the Path to SunShot. Emerging Issues and Challenges in Integrating High Levels of Solar into the Electrical Generation and Transmission System

    Energy Technology Data Exchange (ETDEWEB)

    Denholm, Paul [National Renewable Energy Lab. (NREL), Golden, CO (United States); Clark, Kara [National Renewable Energy Lab. (NREL), Golden, CO (United States); O' Connell, Matt [National Renewable Energy Lab. (NREL), Golden, CO (United States)

    2016-05-01

    This report examines how the bulk power system may need to evolve to accommodate the increased photovoltaic (PV) penetration resulting from achievement of the U.S. Department of Energy's SunShot cost targets. The variable and uncertain nature of PV-generated electricity presents grid-integration challenges. For example, the changing net load associated with high midday PV generation and low electricity demand can create 'overgeneration' that requires curtailment of PV output and reduces PV's value and cost-competitiveness. Accommodating the changes in net load resulting from increased variable generation requires enhancements to a power system's 'flexibility,' or ability to balance supply and demand over multiple time scales through options including changes in system operation, flexible generation, reserves from solar, demand response, energy storage, and enhanced transmission and regional coordination. For utility-scale PV with a baseline SunShot levelized cost of electricity (LCOE) of 6 cents/kWh, increasing the annual energy demand met by solar energy from 10% to 20% would increase the marginal LCOE of PV from 6 cents/kWh to almost 11 cents/kWh in a California grid system with limited flexibility. However, increasing system flexibility could minimize solar curtailment and keep PV cost-competitive at penetrations at least as high as 25%. In the longer term, energy storage technologies--such as concentrating solar power with thermal energy storage--could facilitate the cost-effective integration of even higher PV penetration. Efficient deployment of the grid-flexibility options needed to maintain solar's value will require various innovations, from the development of communication, control, and energy storage technologies to the implementation of new market rules and operating procedures.

  4. Zero-Slack, Noncritical Paths

    Science.gov (United States)

    Simons, Jacob V., Jr.

    2017-01-01

    The critical path method/program evaluation and review technique method of project scheduling is based on the importance of managing a project's critical path(s). Although a critical path is the longest path through a network, its location in large projects is facilitated by the computation of activity slack. However, logical fallacies in…

  5. Two dimensional simplicial paths

    International Nuclear Information System (INIS)

    Piso, M.I.

    1994-07-01

    Paths on the R 3 real Euclidean manifold are defined as 2-dimensional simplicial strips which are orbits of the action of a discrete one-parameter group. It is proven that there exists at least one embedding of R 3 in the free Z-module generated by S 2 (x 0 ). The speed is defined as the simplicial derivative of the path. If mass is attached to the simplex, the free Lagrangian is proportional to the width of the path. In the continuum limit, the relativistic form of the Lagrangian is recovered. (author). 7 refs

  6. Accelerating cleanup: Paths to closure

    Energy Technology Data Exchange (ETDEWEB)

    Edwards, C.

    1998-06-30

    This document was previously referred to as the Draft 2006 Plan. As part of the DOE`s national strategy, the Richland Operations Office`s Paths to Closure summarizes an integrated path forward for environmental cleanup at the Hanford Site. The Hanford Site underwent a concerted effort between 1994 and 1996 to accelerate the cleanup of the Site. These efforts are reflected in the current Site Baseline. This document describes the current Site Baseline and suggests strategies for further improvements in scope, schedule and cost. The Environmental Management program decided to change the name of the draft strategy and the document describing it in response to a series of stakeholder concerns, including the practicality of achieving widespread cleanup by 2006. Also, EM was concerned that calling the document a plan could be misconstrued to be a proposal by DOE or a decision-making document. The change in name, however, does not diminish the 2006 vision. To that end, Paths to Closure retains a focus on 2006, which serves as a point in time around which objectives and goals are established.

  7. Science and technology needs: Integrated research and development, the path to gaining a defensible understanding on ''watch list'' tank risk and interim stabilization needs

    International Nuclear Information System (INIS)

    Johnson, B.M.; Mellinger, G.; Strachan, D.; Hallen, R.

    1991-09-01

    The ''watch list'' waste tanks at the Hanford Site in Washington state are those that the Secretary of the Department of Energy reports upon to the Congress because of the unresolved safety question. As such, they are subject to intense surveillance and an enhanced list of controls and safety procedures. The objective of the Waste Tank Safety Program is to mitigate the safety concerns with respect to these tanks, thereby removing them from the ''watch list.'' The essential step in this process is the development of a defensible position that reduce the risk of these tanks to an acceptable level. An integrated research and development (R ampersand D) program is believed to be the most cost-effective means of achieving the information required to mitigate the safety concern and to resolve the safety issues. This program uses chemical and physical modeling studies of synthetic waste, is substantiated with limited field data and radioactive samples from a tank, and uses numerical modeling to extrapolate results to actual tank-scale operations. 3 refs., 4 figs

  8. Path planning in changeable environments

    NARCIS (Netherlands)

    Nieuwenhuisen, D.

    2007-01-01

    This thesis addresses path planning in changeable environments. In contrast to traditional path planning that deals with static environments, in changeable environments objects are allowed to change their configurations over time. In many cases, path planning algorithms must facilitate quick

  9. Integration of Fluorescence Differential Path-Length Spectroscopy to Photodynamic Therapy of the Head and Neck Tumors is Useful in Monitoring Clinical Outcome

    Science.gov (United States)

    Karakullukcu, Baris; Kanick, Stephen; Aans, Jan Bonne; Sterenborg, Henricus; Tan, Bing; Amelink, Arjen; Robinson, Dominic

    2015-04-01

    The use of fluorescence differential pathlength spectroscopy (FDPS) has the potential to provide real-time information on photosensitiser pharmacokinetics, vascular physiology and photosensitizer photobleaching based dosimetry of tumors in the oral cavity receiving m-tetrahydroxyphenylchlorin (mTHPC) photodynamic therapy (PDT). Reflectance spectra can be used provide quantitative values of oxygen saturation, blood volume fraction, blood vessel diameter, and to determine the local optical properties that can be used to correct raw fluorescence for tissue absorption. Patients and methods: Twenty-seven lesions in the oral cavity, either dysplasias or cancer were interrogated using FDPS, before and immediately after the therapeutic illumination. The average tumor center to normal mucosa ratio of fluorescence was 1.50 ± 0.66. mTHPC photobleaching was observed in 24 of the lesions treated. The average extent of photobleaching was 81% ± 17%. Information from FDPS spectroscopy coupled with the clinical results of the treatment identified 3 types of correctable errors in the application of mTHPC-PDT: Two patients exhibited very low concentrations of photosensitizer in tumour center, indicating an ineffective i.v. injection of photosensitiser or an erroneous systemic distribution of mTHPC. In one in tumor we observed no photobleaching accompanied by a high blood volume fraction in the illuminated tissue, suggesting that the presence of blood prevented therapeutic light reaching the target tissue. All 3 of the these lesions had no clinical response to PDT. In four patients we observed less than 50% photobleaching at the tumor margins , suggesting a possible geographic miss. One patient in this group had a recurrence within 2 months after PDT even though the initial response was good. The integration of FDPS to clinical PDT yields data on tissue physiology, photosensitiser content and photobleaching that can help identify treatment errors that can potentially be corrected.

  10. On the Path to SunShot - Emerging Issues and Challenges in Integrating High Levels of Solar into the Electrical Generation and Transmission System

    Energy Technology Data Exchange (ETDEWEB)

    Denholm, Paul [National Renewable Energy Lab. (NREL), Golden, CO (United States); Clark, Kara [National Renewable Energy Lab. (NREL), Golden, CO (United States); O' Connell, Matt [National Renewable Energy Lab. (NREL), Golden, CO (United States)

    2016-05-01

    Increasing the use of grid-flexibility options (improved grid management, demand response, and energy storage) could enable 25% or higher penetration of PV at low costs (see Denholm et al. 2016). Considering the large-scale integration of solar into electric-power systems complicates the calculation of the value of solar. In fact a comprehensive examination reveals that the value of solar technologies—or any other power-system technology or operating strategy—can only be understood in the context of the generation system as a whole. This is well illustrated by analysis of curtailment at high PV penetrations within the bulk power and transmission systems. As the deployment of PV increases, it is possible that during some sunny midday periods due to limited flexibility of conventional generators, system operators would need to reduce (curtail) PV output in order to maintain the crucial balance between electric supply and demand. As a result, PV’s value and cost competitiveness would degrade. For example, for utility-scale PV with a baseline SunShot LCOE of 6¢/kWh, increasing the annual energy demand met by solar energy from 10% to 20% would increase the marginal LCOE of PV from 6¢/kWh to almost 11¢/kWh in a California grid system with limited flexibility. However, this loss of value could be stemmed by increasing system flexibility via enhanced control of variable-generation resources, added energy storage, and the ability to motivate more electricity consumers to shift consumption to lower-demand periods. The combination of these measures would minimize solar curtailment and keep PV cost-competitive at penetrations at least as high as 25%. Efficient deployment of the grid-flexibility options needed to maintain solar’s value will require various innovations, from the development of communication, control, and energy storage technologies to the implementation of new market rules and operating procedures.

  11. Integration

    DEFF Research Database (Denmark)

    Emerek, Ruth

    2004-01-01

    Bidraget diskuterer de forskellige intergrationsopfattelse i Danmark - og hvad der kan forstås ved vellykket integration......Bidraget diskuterer de forskellige intergrationsopfattelse i Danmark - og hvad der kan forstås ved vellykket integration...

  12. Paths correlation matrix.

    Science.gov (United States)

    Qian, Weixian; Zhou, Xiaojun; Lu, Yingcheng; Xu, Jiang

    2015-09-15

    Both the Jones and Mueller matrices encounter difficulties when physically modeling mixed materials or rough surfaces due to the complexity of light-matter interactions. To address these issues, we derived a matrix called the paths correlation matrix (PCM), which is a probabilistic mixture of Jones matrices of every light propagation path. Because PCM is related to actual light propagation paths, it is well suited for physical modeling. Experiments were performed, and the reflection PCM of a mixture of polypropylene and graphite was measured. The PCM of the mixed sample was accurately decomposed into pure polypropylene's single reflection, pure graphite's single reflection, and depolarization caused by multiple reflections, which is consistent with the theoretical derivation. Reflection parameters of rough surface can be calculated from PCM decomposition, and the results fit well with the theoretical calculations provided by the Fresnel equations. These theoretical and experimental analyses verify that PCM is an efficient way to physically model light-matter interactions.

  13. Leavitt path algebras

    CERN Document Server

    Abrams, Gene; Siles Molina, Mercedes

    2017-01-01

    This book offers a comprehensive introduction by three of the leading experts in the field, collecting fundamental results and open problems in a single volume. Since Leavitt path algebras were first defined in 2005, interest in these algebras has grown substantially, with ring theorists as well as researchers working in graph C*-algebras, group theory and symbolic dynamics attracted to the topic. Providing a historical perspective on the subject, the authors review existing arguments, establish new results, and outline the major themes and ring-theoretic concepts, such as the ideal structure, Z-grading and the close link between Leavitt path algebras and graph C*-algebras. The book also presents key lines of current research, including the Algebraic Kirchberg Phillips Question, various additional classification questions, and connections to noncommutative algebraic geometry. Leavitt Path Algebras will appeal to graduate students and researchers working in the field and related areas, such as C*-algebras and...

  14. Toward solving the sign problem with path optimization method

    Science.gov (United States)

    Mori, Yuto; Kashiwa, Kouji; Ohnishi, Akira

    2017-12-01

    We propose a new approach to circumvent the sign problem in which the integration path is optimized to control the sign problem. We give a trial function specifying the integration path in the complex plane and tune it to optimize the cost function which represents the seriousness of the sign problem. We call it the path optimization method. In this method, we do not need to solve the gradient flow required in the Lefschetz-thimble method and then the construction of the integration-path contour arrives at the optimization problem where several efficient methods can be applied. In a simple model with a serious sign problem, the path optimization method is demonstrated to work well; the residual sign problem is resolved and precise results can be obtained even in the region where the global sign problem is serious.

  15. Acquisition Path Analysis as a Collaborative Activity

    International Nuclear Information System (INIS)

    Nakao, A.; Grundule, R.; Gushchyn, K.; El Gebaly, A.; Higgy, R.; Tsvetkov, I.; Mandl, W.

    2015-01-01

    In the International Atomic Energy Agency, acquisition path analysis (APA) is indispensable to safeguards implementation. It is an integral part of both State evaluation process and the development of State level safeguards approaches, all performed through ongoing collaborative analysis of all available safeguards relevant information by State evaluation groups (SEG) with participation of other contributors, as required. To perform comprehensive State evaluation, to develop and revise State-level safeguards approaches, and to prepare annual implementation plans, the SEG in its collaborative analysis follows accepted safeguards methodology and guidance. In particular, the guide ''Performing Acquisition Path Analysis for the Development of a State-level Safeguards Approach for a State with a CSA'' is used. This guide identifies four major steps of the APA process: 1. Consolidating information about the State's past, present and planned nuclear fuel cycle-related capabilities and infrastructure; 2. Identifying and visually presenting technically plausible acquisition paths for the State; 3. Assessing acquisition path steps (State's technical capabilities and possible actions) along the identified acquisition paths; and 4. Assessing the time needed to accomplish each identified technically plausible acquisition path for the State. The paper reports on SEG members' and other contributors' experience with APA when following the above steps, including the identification of plausible acquisition pathways, estimation of time frames for all identified steps and determination of the time needed to accomplish each acquisition path. The difficulties that the SEG encountered during the process of performing the APA are also addressed. Feedback in the form of practical suggestions for improving the clarity of the acquisition path step assessment forms and a proposal for software support are also included. (author)

  16. A NEW APPROACH ON SHORTEST PATH IN FUZZY ENVIRONMENT

    OpenAIRE

    A. Nagoorgani; A. Mumtaj Begam

    2010-01-01

    This paper introduces a new type of fuzzy shortest path network problem using triangular fuzzy number. To find the smallest edge by the fuzzy distance using graded mean integration representation of generalized fuzzy number for every node. Thus the optimum shortest path for the given problem is obtained.

  17. Fermion path integrals and topological phases

    Science.gov (United States)

    Witten, Edward

    2016-07-01

    Symmetry-protected topological (SPT) phases of matter have been interpreted in terms of anomalies, and it has been expected that a similar picture should hold for SPT phases with fermions. Here a description is given in detail of what this picture means for phases of quantum matter that can be understood via band theory and free fermions. The main examples considered are time-reversal invariant topological insulators and superconductors in two or three space dimensions. Along the way, the precise meaning of the statement that in the bulk of a 3D topological insulator, the electromagnetic θ angle is equal to π , is clarified.

  18. The path to integrated information technology

    International Nuclear Information System (INIS)

    Oser, H.

    1988-01-01

    The past and future of computer sciences are addressed and an overview of operating systems is presented. On the subject of instrumentation and control, aspects of real time software, language, man-machine communication and sensors are discussed. The reliability of systems, knowledge engineering and expert systems are also discussed

  19. Lexicographic Path Induction

    DEFF Research Database (Denmark)

    Schürmann, Carsten; Sarnat, Jeffrey

    2009-01-01

    an induction principle that combines the comfort of structural induction with the expressive strength of transfinite induction. Using lexicographic path induction, we give a consistency proof of Martin-Löf’s intuitionistic theory of inductive definitions. The consistency of Heyting arithmetic follows directly...

  20. MEASURING PATH DEPENDENCY

    Directory of Open Access Journals (Sweden)

    Peter Juhasz

    2017-03-01

    Full Text Available While risk management gained popularity during the last decades even some of the basic risk types are still far out of focus. One of these is path dependency that refers to the uncertainty of how we reach a certain level of total performance over time. While decision makers are careful in accessing how their position will look like the end of certain periods, little attention is given how they will get there through the period. The uncertainty of how a process will develop across a shorter period of time is often “eliminated” by simply choosing a longer planning time interval, what makes path dependency is one of the most often overlooked business risk types. After reviewing the origin of the problem we propose and compare seven risk measures to access path. Traditional risk measures like standard deviation of sub period cash flows fail to capture this risk type. We conclude that in most cases considering the distribution of the expected cash flow effect caused by the path dependency may offer the best method, but we may need to use several measures at the same time to include all the optimisation limits of the given firm

  1. Call-graph-based inter-class MM path generation

    Science.gov (United States)

    He, Wei; Zhao, Ruilian

    2012-01-01

    Inter-class testing is the testing of classes for composing an object-oriented system or subsystem during integration. MM Path is defined as an interleaved sequence of method executions linked by messages. It represents the interactions between methods in object-oriented software well, hence fits for object-oriented integration testing. However, the current MM Path generation methods only support intra-class testing. In this paper, a call-graph-based approach is proposed to promote MM Path automatic generation from intra-class to inter-class level. The approach is evaluated by controlled experiments on 12 Java benchmark programs with two typical call graph construction algorithms, Class Hierarchy Analysis and Anderson's Points-to Analysis. Then, the impact of the two algorithms on inter-class MM path generation efficiency is studied. The result shows that our approach is practicable and Anderson's Points-to Analysis outperforms Class Hierarchy Analysis for inter-class MM Path generation.

  2. Shortest Paths and Vehicle Routing

    DEFF Research Database (Denmark)

    Petersen, Bjørn

    This thesis presents how to parallelize a shortest path labeling algorithm. It is shown how to handle Chvátal-Gomory rank-1 cuts in a column generation context. A Branch-and-Cut algorithm is given for the Elementary Shortest Paths Problem with Capacity Constraint. A reformulation of the Vehicle R...... Routing Problem based on partial paths is presented. Finally, a practical application of finding shortest paths in the telecommunication industry is shown....

  3. Path planning in dynamic environments

    NARCIS (Netherlands)

    Berg, J.P. van den

    2007-01-01

    Path planning plays an important role in various fields of application, such as CAD design, computer games and virtual environments, molecular biology, and robotics. In its most general form, the path planning problem is formulated as finding a collision-free path for a moving entity between a start

  4. Two Generations of Path Dependence

    DEFF Research Database (Denmark)

    Madsen, Mogens Ove

      Even if there is no fully articulated and generally accepted theory of Path Dependence it has eagerly been taken up across a wide range of social sciences - primarily coming from economics. Path Dependence is most of all a metaphor that offers reason to believe, that some political, social...... or economic processes have multiple possible paths of outcomes, rather than a unique path of equilibria. The selection among outcomes may depend on contingent choices or events - outcomes of path-dependent processes require a very relevant study - a perception of history....

  5. JAVA PathFinder

    Science.gov (United States)

    Mehhtz, Peter

    2005-01-01

    JPF is an explicit state software model checker for Java bytecode. Today, JPF is a swiss army knife for all sort of runtime based verification purposes. This basically means JPF is a Java virtual machine that executes your program not just once (like a normal VM), but theoretically in all possible ways, checking for property violations like deadlocks or unhandled exceptions along all potential execution paths. If it finds an error, JPF reports the whole execution that leads to it. Unlike a normal debugger, JPF keeps track of every step how it got to the defect.

  6. Path Through the Wheat

    Directory of Open Access Journals (Sweden)

    David Middleton

    2005-01-01

    Full Text Available The hillside’s tidal waves of yellow-green Break downward into full-grown stalks of wheat In which a peasant, shouldering his hoe Passes along a snaking narrow path -- A teeming place through which his hard thighs press And where his head just barely stays above The swaying grain, drunken in abundance, Farm buildings almost floating on the swells Beyond which sea gulls gliding white in air Fly down on out of sight to salty fields, Taking the channel fish off Normandy, A surfeit fit for Eden i...

  7. Path to Prosperity

    OpenAIRE

    Wolfowitz,Paul

    2006-01-01

    Paul Wolfowitz, President of the World Bank, discussed Singapore's remarkable progress along the road from poverty to prosperity which has also been discovered by many other countries in East Asia and around the world. He spoke of how each country must find its own path for people to pursue the same dreams of the chance to go to school, the security of a good job, and the ability to provide a better future for their children. Throughout the world, and importantly in the developing world, ther...

  8. Rocket Flight Path

    Directory of Open Access Journals (Sweden)

    Jamie Waters

    2014-09-01

    Full Text Available This project uses Newton’s Second Law of Motion, Euler’s method, basic physics, and basic calculus to model the flight path of a rocket. From this, one can find the height and velocity at any point from launch to the maximum altitude, or apogee. This can then be compared to the actual values to see if the method of estimation is a plausible. The rocket used for this project is modeled after Bullistic-1 which was launched by the Society of Aeronautics and Rocketry at the University of South Florida.

  9. 'Integration'

    DEFF Research Database (Denmark)

    Olwig, Karen Fog

    2011-01-01

    , while the countries have adopted disparate policies and ideologies, differences in the actual treatment and attitudes towards immigrants and refugees in everyday life are less clear, due to parallel integration programmes based on strong similarities in the welfare systems and in cultural notions...

  10. World nuclear energy paths

    International Nuclear Information System (INIS)

    Connolly, T.J.; Hansen, U.; Jaek, W.; Beckurts, K.H.

    1979-01-01

    In examing the world nuclear energy paths, the following assumptions were adopted: the world economy will grow somewhat more slowly than in the past, leading to reductions in electricity demand growth rates; national and international political impediments to the deployment of nuclear power will gradually disappear over the next few years; further development of nuclear power will proceed steadily, without serious interruption but with realistic lead times for the introduction of advanced technologies. Given these assumptions, this paper attempts a study of possible world nuclear energy developments, disaggregated on a regional and national basis. The scenario technique was used and a few alternative fuel-cycle scenarios were developed. Each is an internally consistent model of technically and economically feasible paths to the further development of nuclear power in an aggregate of individual countries and regions of the world. The main purpose of this modeling exercise was to gain some insight into the probable international locations of reactors and other nuclear facilities, the future requirements for uranium and for fuel-cycle services, and the problems of spent-fuel storage and waste management. The study also presents an assessment of the role that nuclear power might actually play in meeting future world energy demand

  11. Quad-rotor flight path energy optimization

    Science.gov (United States)

    Kemper, Edward

    Quad-Rotor unmanned areal vehicles (UAVs) have been a popular area of research and development in the last decade, especially with the advent of affordable microcontrollers like the MSP 430 and the Raspberry Pi. Path-Energy Optimization is an area that is well developed for linear systems. In this thesis, this idea of path-energy optimization is extended to the nonlinear model of the Quad-rotor UAV. The classical optimization technique is adapted to the nonlinear model that is derived for the problem at hand, coming up with a set of partial differential equations and boundary value conditions to solve these equations. Then, different techniques to implement energy optimization algorithms are tested using simulations in Python. First, a purely nonlinear approach is used. This method is shown to be computationally intensive, with no practical solution available in a reasonable amount of time. Second, heuristic techniques to minimize the energy of the flight path are tested, using Ziegler-Nichols' proportional integral derivative (PID) controller tuning technique. Finally, a brute force look-up table based PID controller is used. Simulation results of the heuristic method show that both reliable control of the system and path-energy optimization are achieved in a reasonable amount of time.

  12. innovation path exploration

    Directory of Open Access Journals (Sweden)

    Li Jian

    2016-01-01

    Full Text Available The world has entered the information age, all kinds of information technologies such as cloud technology, big data technology are in rapid development, and the “Internet plus” appeared. The main purpose of “Internet plus” is to provide an opportunity for the further development of the enterprise, the enterprise technology, business and other aspects of factors combine. For enterprises, grasp the “Internet plus” the impact of the market economy will undoubtedly pave the way for the future development of enterprises. This paper will be on the innovation path of the enterprise management “Internet plus” era tied you study, hope to be able to put forward some opinions and suggestions.

  13. Interactive cutting path analysis programs

    Science.gov (United States)

    Weiner, J. M.; Williams, D. S.; Colley, S. R.

    1975-01-01

    The operation of numerically controlled machine tools is interactively simulated. Four programs were developed to graphically display the cutting paths for a Monarch lathe, Cintimatic mill, Strippit sheet metal punch, and the wiring path for a Standard wire wrap machine. These programs are run on a IMLAC PDS-ID graphic display system under the DOS-3 disk operating system. The cutting path analysis programs accept input via both paper tape and disk file.

  14. Motion Reliability Modeling and Evaluation for Manipulator Path Planning Task

    OpenAIRE

    Li, Tong; Jia, Qingxuan; Chen, Gang; Sun, Hanxu

    2015-01-01

    Motion reliability as a criterion can reflect the accuracy of manipulator in completing operations. Since path planning task takes a significant role in operations of manipulator, the motion reliability evaluation of path planning task is discussed in the paper. First, a modeling method for motion reliability is proposed by taking factors related to position accuracy of manipulator into account. In the model, multidimensional integral for PDF is carried out to calculate motion reliability. Co...

  15. Sustainable Energy Path

    Directory of Open Access Journals (Sweden)

    Hiromi Yamamoto

    2005-12-01

    Full Text Available The uses of fossil fuels cause not only the resources exhaustion but also the environmental problems such as global warming. The purposes of this study are to evaluate paths toward sustainable energy systems and roles of each renewable. In order to realize the purposes, the authors developed the global land use and energy model that figured the global energy supply systems in the future considering the cost minimization. Using the model, the authors conducted a simulation in C30R scenario, which is a kind of strict CO2 emission limit scenarios and reduced CO2 emissions by 30% compared with Kyoto protocol forever scenario, and obtained the following results. In C30R scenario bioenergy will supply 33% of all the primary energy consumption. However, wind and photovoltaic will supply 1.8% and 1.4% of all the primary energy consumption, respectively, because of the limits of power grid stability. The results imply that the strict limits of CO2 emissions are not sufficient to achieve the complete renewable energy systems. In order to use wind and photovoltaic as major energy resources, we need not only to reduce the plant costs but also to develop unconventional renewable technologies.

  16. On Minc's sheltered middle path

    OpenAIRE

    Repovš, Dušan; Rosicki, Witold; Virk, Žiga; Zastrow, Andreas

    2012-01-01

    This paper shows that a construction, which was introduced by Piotr Minc in connection with a problem that came from Helly type theorems and that allows to replace three PL-arcs with a "sheltered middle path", can in the case of general (non-PL) paths result in the topologist's sine curve.

  17. Characterization of Flow Paths, Residence Time and Media Chemistry in Complex Landscapes to Integrate Surface, Groundwater and Stream Processes and Inform Models of Hydrologic and Water Quality Response to Land Use Activities; Savannah River Site

    Energy Technology Data Exchange (ETDEWEB)

    Bitew, Menberu [Univ. of Georgia Research Foundation, Inc., Athens, GA (United States); Jackson, Rhett [University of Georgia Research Foundation, Inc.

    2015-02-01

    The objective of this report is to document the methodology used to calculate the three hydro-geomorphic indices: C Index, Nhot spot, and Interflow Contributing Area (IFC Area). These indices were applied in the Upper Four Mile Creek Watershed in order to better understand the potential mechanisms controlling retention time, path lengths, and potential for nutrient and solute metabolism and exchange associated with the geomorphic configurations of the upland contributing areas, groundwater, the riparian zone, and stream channels.

  18. Probabilistic Connections for Bidirectional Path Tracing

    OpenAIRE

    Popov, Stefan; Ramamoorthi, Ravi; Durand, Fredo; Drettakis, George

    2015-01-01

    International audience; Bidirectional Path Tracing Probabilistic Connections for Bidirectional Path Tracing Figure 1: Our Probabilistic Connections for Bidirectional Path Tracing approach importance samples connections to an eye sub-path, and greatly reduces variance, by considering and reusing multiple light sub-paths at once. Our approach (right) achieves much higher quality than bidirectional path-tracing on the left for the same computation time (~8.4 min).. Abstract Bidirectional path tr...

  19. Hard paths, soft paths or no paths? Cross-cultural perceptions of water solutions

    Science.gov (United States)

    Wutich, A.; White, A. C.; White, D. D.; Larson, K. L.; Brewis, A.; Roberts, C.

    2014-01-01

    In this study, we examine how development status and water scarcity shape people's perceptions of "hard path" and "soft path" water solutions. Based on ethnographic research conducted in four semi-rural/peri-urban sites (in Bolivia, Fiji, New Zealand, and the US), we use content analysis to conduct statistical and thematic comparisons of interview data. Our results indicate clear differences associated with development status and, to a lesser extent, water scarcity. People in the two less developed sites were more likely to suggest hard path solutions, less likely to suggest soft path solutions, and more likely to see no path to solutions than people in the more developed sites. Thematically, people in the two less developed sites envisioned solutions that involve small-scale water infrastructure and decentralized, community-based solutions, while people in the more developed sites envisioned solutions that involve large-scale infrastructure and centralized, regulatory water solutions. People in the two water-scarce sites were less likely to suggest soft path solutions and more likely to see no path to solutions (but no more likely to suggest hard path solutions) than people in the water-rich sites. Thematically, people in the two water-rich sites seemed to perceive a wider array of unrealized potential soft path solutions than those in the water-scarce sites. On balance, our findings are encouraging in that they indicate that people are receptive to soft path solutions in a range of sites, even those with limited financial or water resources. Our research points to the need for more studies that investigate the social feasibility of soft path water solutions, particularly in sites with significant financial and natural resource constraints.

  20. Pathways with PathWhiz.

    Science.gov (United States)

    Pon, Allison; Jewison, Timothy; Su, Yilu; Liang, Yongjie; Knox, Craig; Maciejewski, Adam; Wilson, Michael; Wishart, David S

    2015-07-01

    PathWhiz (http://smpdb.ca/pathwhiz) is a web server designed to create colourful, visually pleasing and biologically accurate pathway diagrams that are both machine-readable and interactive. As a web server, PathWhiz is accessible from almost any place and compatible with essentially any operating system. It also houses a public library of pathways and pathway components that can be easily viewed and expanded upon by its users. PathWhiz allows users to readily generate biologically complex pathways by using a specially designed drawing palette to quickly render metabolites (including automated structure generation), proteins (including quaternary structures, covalent modifications and cofactors), nucleic acids, membranes, subcellular structures, cells, tissues and organs. Both small-molecule and protein/gene pathways can be constructed by combining multiple pathway processes such as reactions, interactions, binding events and transport activities. PathWhiz's pathway replication and propagation functions allow for existing pathways to be used to create new pathways or for existing pathways to be automatically propagated across species. PathWhiz pathways can be saved in BioPAX, SBGN-ML and SBML data exchange formats, as well as PNG, PWML, HTML image map or SVG images that can be viewed offline or explored using PathWhiz's interactive viewer. PathWhiz has been used to generate over 700 pathway diagrams for a number of popular databases including HMDB, DrugBank and SMPDB. © The Author(s) 2015. Published by Oxford University Press on behalf of Nucleic Acids Research.

  1. Accelerating cleanup. Paths to closure Hanford Site

    International Nuclear Information System (INIS)

    Edwards, C.

    1998-01-01

    This document was previously referred to as the Draft 2006 Plan. As part of the DOE's national strategy, the Richland Operations Office's Paths to Closure summarizes an integrated path forward for environmental cleanup at the Hanford Site. The Hanford Site underwent a concerted effort between 1994 and 1996 to accelerate the cleanup of the Site. These efforts are reflected in the current Site Baseline. This document describes the current Site Baseline and suggests strategies for further improvements in scope, schedule and cost. The Environmental Management program decided to change the name of the draft strategy and the document describing it in response to a series of stakeholder concerns, including the practicality of achieving widespread cleanup by 2006. Also, EM was concerned that calling the document a plan could be misconstrued to be a proposal by DOE or a decision-making document. The change in name, however, does not diminish the 2006 vision. To that end, Paths to Closure retains a focus on 2006, which serves as a point in time around which objectives and goals are established

  2. The Path Ahead

    Science.gov (United States)

    Tuszynski, Jack A.; Woolf, Nancy

    This chapter provides an introduction to the rest of the book, which has a multidisciplinary approach to the physics of consciousness. We summarize the various contributions and present our own point of view, which is that there are some deficiencies in defining higher-order consciousness in strict terms of classic physics. We favor a proposal that considers some aspects of quantum-mechanical operations among molecules involved with neurotransmission and mechanical transport of synaptic proteins. In our view, the wiring of the brain is not as complex, and certainly not as integrated, as commonly assumed. Instead, the wiring pattern redundantly obeys a few general principles focused on high resolution rather than crossmodal integration. Basing cognitive functions, such as higher-order consciousness, solely on electrophysiological responses in neural networks thus wired may not suffice. On the other hand, coherent quantum computing, executed by tubulins, the protein subunits of microtubules, may exert en masse influences over the transport of many receptor and scaffolding proteins to various activated synapses, thereby accounting for the unity of conscious experience. We discuss the potential problems of quantum computing, such as decoherence, and also present counterarguments, as well as recent empirical results consistent with the notion that quantum computing in the interiors of neurons, in particular, within the interiors of dendrites may indeed be possible.

  3. Presenting and exploring biological pathways with PathVisio

    Directory of Open Access Journals (Sweden)

    Hanspers Kristina

    2008-09-01

    Full Text Available Abstract Background Biological pathways are a useful abstraction of biological concepts, and software tools to deal with pathway diagrams can help biological research. PathVisio is a new visualization tool for biological pathways that mimics the popular GenMAPP tool with a completely new Java implementation that allows better integration with other open source projects. The GenMAPP MAPP file format is replaced by GPML, a new XML file format that provides seamless exchange of graphical pathway information among multiple programs. Results PathVisio can be combined with other bioinformatics tools to open up three possible uses: visual compilation of biological knowledge, interpretation of high-throughput expression datasets, and computational augmentation of pathways with interaction information. PathVisio is open source software and available at http://www.pathvisio.org. Conclusion PathVisio is a graphical editor for biological pathways, with flexibility and ease of use as primary goals.

  4. Innovation paths in wind power

    DEFF Research Database (Denmark)

    Lema, Rasmus; Nordensvärd, Johan; Urban, Frauke

    Denmark and Germany both make substantial investments in low carbon innovation, not least in the wind power sector. These investments in wind energy are driven by the twin objectives of reducing carbon emissions and building up international competitive advantage. Support for wind power dates back...... paths: government policies, demand conditions, geography, value chains, and the strategies undertaken by firms. It demonstrates that the innovation paths common to both countries have roots in a confluence of determining factors which are mainly due to social and political priorities, preferences...... Denmark and Germany have common national causes, while company-specific strategies also influence the innovation paths in significant ways. This raises important questions about the national specificity of innovation paths in wind power development. Finally, the paper briefly addresses the increasing...

  5. An Introduction to Path Analysis

    Science.gov (United States)

    Wolfe, Lee M.

    1977-01-01

    The analytical procedure of path analysis is described in terms of its use in nonexperimental settings in the social sciences. The description assumes a moderate statistical background on the part of the reader. (JKS)

  6. Paths into Professional School: A Research Note

    Science.gov (United States)

    Helfrich, Margaret L.

    1975-01-01

    The literature of occupations and professions implies that there may be different paths into given work activities. Four different paths into dental school are described and illustrated, and different conditions are associated with each path. (Author/BP)

  7. Path-based Queries on Trajectory Data

    DEFF Research Database (Denmark)

    Krogh, Benjamin Bjerre; Pelekis, Nikos; Theodoridis, Yannis

    2014-01-01

    In traffic research, management, and planning a number of path-based analyses are heavily used, e.g., for computing turn-times, evaluating green waves, or studying traffic flow. These analyses require retrieving the trajectories that follow the full path being analyzed. Existing path queries cannot...... sufficiently support such path-based analyses because they retrieve all trajectories that touch any edge in the path. In this paper, we define and formalize the strict path query. This is a novel query type tailored to support path-based analysis, where trajectories must follow all edges in the path...... a specific path by only retrieving data from the first and last edge in the path. To correctly answer strict path queries existing network-constrained trajectory indexes must retrieve data from all edges in the path. An extensive performance study of NETTRA using a very large real-world trajectory data set...

  8. Development of PATH Gaming Methodology

    Science.gov (United States)

    1988-06-30

    In open games, on the other hand , the teams are allowed to interact directly (either verbally or in writing) without the control team restricting the...real world this loss is not serious. A path game can consist of as few as one team to as many as four. A color coding scheme is used as a short hand ... Strenghts ---------------------------------- 74 6.4 Weaknesses --------------------------------- 76 7 Extended Path Games ----------------------------- 78

  9. Formal language constrained path problems

    Energy Technology Data Exchange (ETDEWEB)

    Barrett, C.; Jacob, R.; Marathe, M.

    1997-07-08

    In many path finding problems arising in practice, certain patterns of edge/vertex labels in the labeled graph being traversed are allowed/preferred, while others are disallowed. Motivated by such applications as intermodal transportation planning, the authors investigate the complexity of finding feasible paths in a labeled network, where the mode choice for each traveler is specified by a formal language. The main contributions of this paper include the following: (1) the authors show that the problem of finding a shortest path between a source and destination for a traveler whose mode choice is specified as a context free language is solvable efficiently in polynomial time, when the mode choice is specified as a regular language they provide algorithms with improved space and time bounds; (2) in contrast, they show that the problem of finding simple paths between a source and a given destination is NP-hard, even when restricted to very simple regular expressions and/or very simple graphs; (3) for the class of treewidth bounded graphs, they show that (i) the problem of finding a regular language constrained simple path between source and a destination is solvable in polynomial time and (ii) the extension to finding context free language constrained simple paths is NP-complete. Several extensions of these results are presented in the context of finding shortest paths with additional constraints. These results significantly extend the results in [MW95]. As a corollary of the results, they obtain a polynomial time algorithm for the BEST k-SIMILAR PATH problem studied in [SJB97]. The previous best algorithm was given by [SJB97] and takes exponential time in the worst case.

  10. On optimal population paths

    CERN Document Server

    Lane, John S

    1977-01-01

    The overall purpose of this monograph is to integrate and critically evaluate the existing literature in the area of optimal joint savings population programs. The existing diverse presentations are all seen to be discussions within a unified framework. The central problem is to compare the desirability of alternative inter-temporal sequences of total savings and population sizes. Of critical importance is whether one regards persons as the fundamental moral entities or whether one takes Sidgwick's viewpoint that something good being the result of one's action is the baSic reason for dOing anything. The latter viewpoint is consistent with defining a complete social preference ordering over these alternative sequences. Since part of one's interest is to evaluate the consequences of various ethical beliefs a com­ parative study of several such orderings is presented; in particular the Mill-Wolfe average utilitarian, and Sidgwick-Meade classical utilitarian) formulations. A possible problem with the social pref...

  11. Asteroidal Quadruples in non Rooted Path Graphs

    Directory of Open Access Journals (Sweden)

    Gutierrez Marisa

    2015-11-01

    Full Text Available A directed path graph is the intersection graph of a family of directed subpaths of a directed tree. A rooted path graph is the intersection graph of a family of directed subpaths of a rooted tree. Rooted path graphs are directed path graphs. Several characterizations are known for directed path graphs: one by forbidden induced subgraphs and one by forbidden asteroids. It is an open problem to find such characterizations for rooted path graphs. For this purpose, we are studying in this paper directed path graphs that are non rooted path graphs. We prove that such graphs always contain an asteroidal quadruple.

  12. Mindfulness as a Path of Women's Empowerment

    Directory of Open Access Journals (Sweden)

    Nadja FURLAN ŠTANTE

    2016-08-01

    Full Text Available The paper brings together social mindfulness as a path of empowerment for women within its concept of the interrelatedness of all beings in the web of life. The paradigm of social mindfulness is thus established as the foundation of feminist spirituality. The focus of this work is on the possibility of applying the ethics of mindfulness as a paradigm to interpersonal interrelatedness. The relations among humans, nature, reason and emotion in self-development are confronted with the paradigm of mindfulness. This paper carries out a theoretical analysis of the possibility of integrating the paradigm of mindfulness with the paradigm of feminist spirituality. In this view, the paradigm shift toward integrating spiritual and social justice and ecological balance is examined. It also examines possibility of transformation of negative gender stereotypes with the help of mindfulness, loving kindness, compassion and ethics. From this point of view, the application of mindfulness in education (especially childhood, primary and secondary schools is considered.

  13. Light transport on path-space manifolds

    Science.gov (United States)

    Jakob, Wenzel Alban

    The pervasive use of computer-generated graphics in our society has led to strict demands on their visual realism. Generally, users of rendering software want their images to look, in various ways, "real", which has been a key driving force towards methods that are based on the physics of light transport. Until recently, industrial practice has relied on a different set of methods that had comparatively little rigorous grounding in physics---but within the last decade, advances in rendering methods and computing power have come together to create a sudden and dramatic shift, in which physics-based methods that were formerly thought impractical have become the standard tool. As a consequence, considerable attention is now devoted towards making these methods as robust as possible. In this context, robustness refers to an algorithm's ability to process arbitrary input without large increases of the rendering time or degradation of the output image. One particularly challenging aspect of robustness entails simulating the precise interaction of light with all the materials that comprise the input scene. This dissertation focuses on one specific group of materials that has fundamentally been the most important source of difficulties in this process. Specular materials, such as glass windows, mirrors or smooth coatings (e.g. on finished wood), account for a significant percentage of the objects that surround us every day. It is perhaps surprising, then, that it is not well-understood how they can be accommodated within the theoretical framework that underlies some of the most sophisticated rendering methods available today. Many of these methods operate using a theoretical framework known as path space integration. But this framework makes no provisions for specular materials: to date, it is not clear how to write down a path space integral involving something as simple as a piece of glass. Although implementations can in practice still render these materials by side

  14. An Integrated Model of Emotional Problems, Beta Power of Electroencephalography, and Low Frequency of Heart Rate Variability after Childhood Trauma in a Non-Clinical Sample: A Path Analysis Study

    Directory of Open Access Journals (Sweden)

    Min Jin Jin

    2018-01-01

    Full Text Available Childhood trauma is known to be related to emotional problems, quantitative electroencephalography (EEG indices, and heart rate variability (HRV indices in adulthood, whereas directions among these factors have not been reported yet. This study aimed to evaluate pathway models in young and healthy adults: (1 one with physiological factors first and emotional problems later in adulthood as results of childhood trauma and (2 one with emotional problems first and physiological factors later. A total of 103 non-clinical volunteers were included. Self-reported psychological scales, including the Childhood Trauma Questionnaire (CTQ, State–Trait Anxiety Inventory, Beck Depression Inventory, and Affective Lability Scale were administered. For physiological evaluation, EEG record was performed during resting eyes closed condition in addition to the resting-state HRV, and the quantitative power analyses of eight EEG bands and three HRV components were calculated in the frequency domain. After a normality test, Pearson’s correlation analysis to make path models and path analyses to examine them were conducted. The CTQ score was significantly correlated with depression, state and trait anxiety, affective lability, and HRV low-frequency (LF power. LF power was associated with beta2 (18–22 Hz power that was related to affective lability. Affective lability was associated with state anxiety, trait anxiety, and depression. Based on the correlation and the hypothesis, two models were composed: a model with pathways from CTQ score to affective lability, and a model with pathways from CTQ score to LF power. The second model showed significantly better fit than the first model (AICmodel1 = 63.403 > AICmodel2 = 46.003, which revealed that child trauma could affect emotion, and then physiology. The specific directions of relationships among emotions, the EEG, and HRV in adulthood after childhood trauma was discussed.

  15. The Global Optimal Algorithm of Reliable Path Finding Problem Based on Backtracking Method

    Directory of Open Access Journals (Sweden)

    Liang Shen

    2017-01-01

    Full Text Available There is a growing interest in finding a global optimal path in transportation networks particularly when the network suffers from unexpected disturbance. This paper studies the problem of finding a global optimal path to guarantee a given probability of arriving on time in a network with uncertainty, in which the travel time is stochastic instead of deterministic. Traditional path finding methods based on least expected travel time cannot capture the network user’s risk-taking behaviors in path finding. To overcome such limitation, the reliable path finding algorithms have been proposed but the convergence of global optimum is seldom addressed in the literature. This paper integrates the K-shortest path algorithm into Backtracking method to propose a new path finding algorithm under uncertainty. The global optimum of the proposed method can be guaranteed. Numerical examples are conducted to demonstrate the correctness and efficiency of the proposed algorithm.

  16. Islamic Spirituality in America: A Middle Path to Unity.

    Science.gov (United States)

    Altareb, Belkeis Y.

    1996-01-01

    Summarizes the concept of Islamic spirituality and its emphasis on personal and community forms of worship. Explains the concept of the "middle path," briefly describes the five pillars of faith, and shows how integration of various realms (spiritual, social, moral, and individual) allows Muslims to live a peaceful life. (RJM)

  17. Comparison between A* and RRT Algorithms for UAV Path Planning

    NARCIS (Netherlands)

    Zammit, C.; van Kampen, E.

    2018-01-01

    Unmanned Aerial Vehicles (UAVs) are being integrated into a wide range of indoor
    and outdoor applications. In this light, robust and ecient path planning is paramount. An extensive literature review showed that the A* and Rapidly{Exploring Random Tree (RRT) algorithms and their variants are the

  18. Shortest Paths in Multiplex Networks.

    Science.gov (United States)

    Ghariblou, Saeed; Salehi, Mostafa; Magnani, Matteo; Jalili, Mahdi

    2017-05-12

    The shortest path problem is one of the most fundamental networks optimization problems. Nowadays, individuals interact in extraordinarily numerous ways through their offline and online life (e.g., co-authorship, co-workership, or retweet relation in Twitter). These interactions have two key features. First, they have a heterogeneous nature, and second, they have different strengths that are weighted based on their degree of intimacy, trustworthiness, service exchange or influence among individuals. These networks are known as multiplex networks. To our knowledge, none of the previous shortest path definitions on social interactions have properly reflected these features. In this work, we introduce a new distance measure in multiplex networks based on the concept of Pareto efficiency taking both heterogeneity and weighted nature of relations into account. We then model the problem of finding the whole set of paths as a form of multiple objective decision making and propose an exact algorithm for that. The method is evaluated on five real-world datasets to test the impact of considering weights and multiplexity in the resulting shortest paths. As an application to find the most influential nodes, we redefine the concept of betweenness centrality based on the proposed shortest paths and evaluate it on a real-world dataset from two-layer trade relation among countries between years 2000 and 2015.

  19. Autonomous Control Modes and Optimized Path Guidance for Shipboard Landing in High Sea States

    Science.gov (United States)

    2016-08-12

    the analysis used for this research. A linearized SIMULINK model of the 46 state aircraft dynamics, the actuators, and the DI control laws was used to...Minor Components Analysis was developed and integrated with landing path generation algorithms. Path optimization studies developed feasible methods for...that has been thoroughly tested for a variety of wind -over- deck (WOD) conditions. The current operational paths may not be an optimal, and operations

  20. UV laser long-path absorption spectroscopy

    Science.gov (United States)

    Dorn, Hans-Peter; Brauers, Theo; Neuroth, Rudolf

    1994-01-01

    Long path Differential Optical Absorption Spectroscopy (DOAS) using a picosecond UV laser as a light source was developed in our institute. Tropospheric OH radicals are measured by their rotational absorption lines around 308 nm. The spectra are obtained using a high resolution spectrograph. The detection system has been improved over the formerly used optomechanical scanning device by application of a photodiode array which increased the observed spectral range by a factor of 6 and which utilizes the light much more effectively leading to a considerable reduction of the measurement time. This technique provides direct measurements of OH because the signal is given by the product of the absorption coefficient and the OH concentration along the light path according to Lambert-Beers law. No calibration is needed. Since the integrated absorption coefficient is well known the accuracy of the measurement essentially depends on the extent to which the OH absorption pattern can be detected in the spectra. No interference by self generated OH radicals in the detection lightpath has been observed. The large bandwidth (greater than 0.15 nm) and the high spectral resolution (1.5 pm) allows absolute determination of interferences by other trace gas absorptions. The measurement error is directly accessible from the absorption-signal to baseline-noise ratio in the spectra. The applicability of the method strongly depends on visibility. Elevated concentrations of aerosols lead to considerable attenuation of the laser light which reduces the S/N-ratio. In the moderately polluted air of Julich, where we performed a number of OH measurement spectra. In addition absorption features of unidentified species were frequently detected. A quantitative deconvolution even of the known species is not easy to achieve and can leave residual structures in the spectra. Thus interferences usually increase the noise and deteriorate the OH detection sensitivity. Using diode arrays for sensitive

  1. Crack path predictions and experiments in plane structures considering anisotropic properties and material interfaces

    Directory of Open Access Journals (Sweden)

    P.O. Judt

    2015-10-01

    Full Text Available In many engineering applications special requirements are directed to a material's fracture behavior and the prediction of crack paths. Especially if the material exhibits anisotropic elastic properties or fracture toughnesses, e.g. in textured or composite materials, the simulation of crack paths is challenging. Here, the application of path independent interaction integrals (I-integrals, J-, L- and M-integrals is beneficial for an accurate crack tip loading analysis. Numerical tools for the calculation of loading quantities using these path-invariant integrals are implemented into the commercial finite element (FE-code ABAQUS. Global approaches of the integrals are convenient considering crack tips approaching other crack faces, internal boundaries or material interfaces. Curved crack faces require special treatment with respect to integration contours. Numerical crack paths are predicted based on FE calculations of the boundary value problem in connection with an intelligent adaptive re-meshing algorithm. Considering fracture toughness anisotropy and accounting for inelastic effects due to small plastic zones in the crack tip region, the numerically predicted crack paths of different types of specimens with material interfaces and internal boundaries are compared to subcritically grown paths obtained from experiments.

  2. Assessment of Hydrogen Sulfide Minimum Detection Limits of an Open Path Tunable Diode Laser

    Science.gov (United States)

    During June 2007, U.S. EPA conducted a feasibility study to determine whether the EPA OTM 10 measurement approach, also known as radial plume mapping (RPM), was feasible. A Boreal open-path tunable diode laser (OP-TDL) to collect path-integrated hydrogen sulfide measurements alon...

  3. Adaptive path following for Unmanned Aerial Vehicles in time-varying unknown wind environments

    NARCIS (Netherlands)

    Zhou, Bingyu; Satyavada, Harish; Baldi, S.; Sun, J.; Rajamani, R.

    2017-01-01

    In this paper, an adaptive control scheme for Unmanned Aerial Vehicles (UAVs) path following under slowly time-varying wind is developed. The proposed control strategy integrates the path following law based on the vector field method with an adaptive term counteracting the effect of wind's

  4. Path-decomposition expansion and edge effects in a magnetized electron gas

    NARCIS (Netherlands)

    Suttorp, L.G.

    2000-01-01

    The influence of boundaries on the properties of a magnetized free-electron gas is discussed with the help of a path-integral representation for the temperature Green function. By using a suitable decomposition of the paths the profiles of the excess particle density and the current density are

  5. Rainbow paths with prescribed ends

    DEFF Research Database (Denmark)

    Alishahi, Meysam; Taherkhani, Ali; Thomassen, Carsten

    2011-01-01

    It was conjectured in [S. Akbari, F. Khaghanpoor, and S. Moazzeni. Colorful paths in vertex coloring of graphs. Preprint] that, if G is a connected graph distinct from C-7, then there is a chi(G)-coloring of G in which every vertex v is an element of V(G) is an initial vertex of a path P with chi......(G) vertices whose colors are different. In[S. Akbari, V. Liaghat, and A. Nikzad. Colorful paths in vertex coloring of graphs. Electron. J. Combin. 18(1):P17, 9pp, 2011] this was proved with left perpendicular chi(G)/2right perpendicular vertices instead of chi(G) vertices. We strengthen this to chi(G) - 1...... finite, and has finite chromatic number, then the k-coloring exists for every k >= chi(G). In fact, the k-coloring can be chosen such that every vertex is a starting vertex of an infinite path such that the color increases by 1 (mod k) along each edge. The method is based on the circular chromatic number...

  6. Relationship between total quality management, critical paths, and outcomes management.

    Science.gov (United States)

    Lynn, P A

    1996-09-01

    Total quality management (TQM), clinical paths, and outcomes management are high-profile strategies in today's health care environment. Each strategy is distinct, yet there are interrelationships among them. TQM supports a customer-focused organizational culture, providing tools and techniques to identify and solve problems. Clinical paths are tools for enhancing patient care coordination and for identifying system-wide and patient population specific issues. Outcomes management is an integrated system for measuring the results in patient populations over time. There is a recent shift in outcomes measurement towards expanding both the nature of the outcomes examined and the timeframes in which they are studied.

  7. Motion Reliability Modeling and Evaluation for Manipulator Path Planning Task

    Directory of Open Access Journals (Sweden)

    Tong Li

    2015-01-01

    Full Text Available Motion reliability as a criterion can reflect the accuracy of manipulator in completing operations. Since path planning task takes a significant role in operations of manipulator, the motion reliability evaluation of path planning task is discussed in the paper. First, a modeling method for motion reliability is proposed by taking factors related to position accuracy of manipulator into account. In the model, multidimensional integral for PDF is carried out to calculate motion reliability. Considering the complex of multidimensional integral, the approach of equivalent extreme value is introduced, with which multidimensional integral is converted into one dimensional integral for convenient calculation. Then a method based on the maximum entropy principle is proposed for model calculation. With the method, the PDF can be obtained efficiently at the state of maximum entropy. As a result, the evaluation of motion reliability can be achieved by one dimensional integral for PDF. Simulations on a particular path planning task are carried out, with which the feasibility and effectiveness of the proposed methods are verified. In addition, the modeling method which takes the factors related to position accuracy into account can represent the contributions of these factors to motion reliability. And the model calculation method can achieve motion reliability evaluation with high precision and efficiency.

  8. INNOVATIVE APPROACH FOR MEASURING AMMONIA AND METHANE FLUXES FROM A HOG FARM USING OPEN-PATH FOURIER TRANSFORM INFRARED SPECTROSCOPY

    Science.gov (United States)

    The paper describes a new approach to quantify emissions from area air pollution sources. The approach combines path-integrated concentration data acquired with any path-integrated optical remote sensing (PI-ORS) technique and computed tomography (CT) technique. In this study, an...

  9. Study of the conformal symmetry breaking in field theories in gravitational background using path integrals; Estudo da quebra de simetria conforme em teorias de campo em fundo gravitacional com uso de integrais de caminho

    Energy Technology Data Exchange (ETDEWEB)

    Souza Alves, Marcelo de

    1990-03-01

    Some general aspects on field theories in curved space-time and a introduction to conformal symmetry are presented.The behavior of the physical systems under Weyl transformations is discussed. The quantization of such systems are performed through the functional integration method. The regularization in curved space-time is also discussed. An application of this analysis in String theories is made. 42 refs.

  10. Enzymatic reaction paths as determined by transition path sampling

    Science.gov (United States)

    Masterson, Jean Emily

    Enzymes are biological catalysts capable of enhancing the rates of chemical reactions by many orders of magnitude as compared to solution chemistry. Since the catalytic power of enzymes routinely exceeds that of the best artificial catalysts available, there is much interest in understanding the complete nature of chemical barrier crossing in enzymatic reactions. Two specific questions pertaining to the source of enzymatic rate enhancements are investigated in this work. The first is the issue of how fast protein motions of an enzyme contribute to chemical barrier crossing. Our group has previously identified sub-picosecond protein motions, termed promoting vibrations (PVs), that dynamically modulate chemical transformation in several enzymes. In the case of human heart lactate dehydrogenase (hhLDH), prior studies have shown that a specific axis of residues undergoes a compressional fluctuation towards the active site, decreasing a hydride and a proton donor--acceptor distance on a sub-picosecond timescale to promote particle transfer. To more thoroughly understand the contribution of this dynamic motion to the enzymatic reaction coordinate of hhLDH, we conducted transition path sampling (TPS) using four versions of the enzymatic system: a wild type enzyme with natural isotopic abundance; a heavy enzyme where all the carbons, nitrogens, and non-exchangeable hydrogens were replaced with heavy isotopes; and two versions of the enzyme with mutations in the axis of PV residues. We generated four separate ensembles of reaction paths and analyzed each in terms of the reaction mechanism, time of barrier crossing, dynamics of the PV, and residues involved in the enzymatic reaction coordinate. We found that heavy isotopic substitution of hhLDH altered the sub-picosecond dynamics of the PV, changed the favored reaction mechanism, dramatically increased the time of barrier crossing, but did not have an effect on the specific residues involved in the PV. In the mutant systems

  11. A practical receding horizon control framework for path planning and control of autonomous vtol vehicles

    Science.gov (United States)

    Liu, C.; Chen, W.-H.

    2013-12-01

    This paper describes an integrated path planning and tracking control framework for autonomous vertical-take-off-and-landing (VTOL) vehicles, particularly quadrotors. The path planning adopts a receding horizon strategy to repeatedly plan a local trajectory that satisfies both the vehicle dynamics and obstacle-free requirement. A tracking controller is then designed to track the planned path. The differential flatness property of the quadrotor is exploited in both path planner and tracking controller designs. The proposed framework is verified by real-time simulations incorporating online optimization.

  12. Institutional care paths: Development, implementation, and evaluation.

    Science.gov (United States)

    Leonard, Mandy C; Bauer, Seth R; Ahrens, Christine; Reddy, Anita; Katzan, Irene

    2017-09-15

    The Cleveland Clinic experience with care paths, including their creation and implementation, challenges overcome during development and testing, and outcomes of selected care path evaluations, is described. Care paths are tools to assist healthcare professionals in practicing evidence-based medicine. The Cleveland Clinic health system has implemented or is developing approximately 100 care paths, including care paths designed to optimize management of sepsis and septic shock and to promote timely use of i.v. tissue plasminogen activator and correct dosing of antithrombotics and statins in patients with stroke. Key steps in successful care path initiatives include (1) identifying key stakeholders, (2) achieving stakeholder consensus on a standardized approach to disease or condition management, (3) cultivating provider awareness of care paths, (4) incorporating care path tools into the electronic health record and workflow processes, and (5) securing the resources to develop, implement, and maintain care paths. Electronic health records facilitate the use of and adherence to care paths. After care path implementation, revisions are typically needed due to unexpected issues not initially identified and to optimize care path features and support resources for clinical practice. Ongoing evaluation is required to determine whether an implemented care path is producing the intended patient and quality performance outcomes. Care paths provide a standardized approach to treatment or prevention of a disease or condition, reducing unnecessary variability and expense while promoting optimal, cost-effective patient care. Copyright © 2017 by the American Society of Health-System Pharmacists, Inc. All rights reserved.

  13. An algorithm for determination of geodetic path for application in long-range acoustic propagation

    Digital Repository Service at National Institute of Oceanography (India)

    Murty, T.V.R.; Sivakholundu, K.M.; Navelkar, G.S.; Somayajulu, Y.K.; Murty, C.S.

    A computer program has been developed for the construction of geodetic path between two points on the spheroidal surface for application in long range acoustic propagation in the ocean. Geodetic equations have integrated numerically upto...

  14. Direct Entry Minimal Path UAV Loitering Path Planning

    Directory of Open Access Journals (Sweden)

    Jay P. Wilhelm

    2017-04-01

    Full Text Available Fixed Wing Unmanned Aerial Vehicles (UAVs performing Intelligence, Surveillance and Reconnaissance (ISR typically fly over Areas of Interest (AOIs to collect sensor data of the ground from the air. If needed, the traditional method of extending sensor collection time is to loiter or turn circularly around the center of an AOI. Current Autopilot systems on small UAVs can be limited in their feature set and typically follow a waypoint chain system that allows for loitering, but requires that the center of the AOI to be traversed which may produce unwanted turns outside of the AOI before entering the loiter. An investigation was performed to compare the current loitering techniques against two novel smart loitering methods. The first method investigated, Tangential Loitering Path Planner (TLPP, utilized paths tangential to the AOIs to enter and exit efficiently, eliminating unnecessary turns outside of the AOI. The second method, Least Distance Loitering Path Planner (LDLPP, utilized four unique flight maneuvers that reduce transit distances while eliminating unnecessary turns outside of the AOI present in the TLPP method. Simulation results concluded that the Smart Loitering Methods provide better AOI coverage during six mission scenarios. It was also determined that the LDLPP method spends less time in transit between AOIs. The reduction in required transit time could be used for surveying additional AOIs.

  15. Path modeling and process control

    DEFF Research Database (Denmark)

    Høskuldsson, Agnar; Rodionova, O.; Pomerantsev, A.

    2007-01-01

    and having three or more stages. The methods are applied to a process control of a multi-stage production process having 25 variables and one output variable. When moving along the process, variables change their roles. It is shown how the methods of path modeling can be applied to estimate variables......Many production processes are carried out in stages. At the end of each stage, the production engineer can analyze the intermediate results and correct process parameters (variables) of the next stage. Both analysis of the process and correction to process parameters at next stage should...... be performed regarding the foreseeable output property y, and with respect to an admissible range of correcting actions for the parameters of the next stage. In this paper the basic principles of path modeling is presented. The mathematics is presented for processes having only one stage, having two stages...

  16. Smooth paths of conditional expectations

    OpenAIRE

    Andruchow, Esteban; Larotonda, Gabriel

    2010-01-01

    Let A be a von Neumann algebra with a finite trace $\\tau$, represented in $H=L^2(A,\\tau)$, and let $B_t\\subset A$ be sub-algebras, for $t$ in an interval $I$. Let $E_t:A\\to B_t$ be the unique $\\tau$-preserving conditional expectation. We say that the path $t\\mapsto E_t$ is smooth if for every $a\\in A$ and $v \\in H$, the map $$ I\

  17. Career path for operations personnel

    International Nuclear Information System (INIS)

    Asher, J.A.

    1985-01-01

    This paper explains how selected personnel can now obtain a Bachelor of Science degree in Physics with a Nuclear Power Operations option. The program went into effect the Fall of 1984. Another program was worked out in 1982 whereby students attending the Nuclear Operators Training Program could obtain an Associates of Science degree in Mechanical Engineering Technology at the end of two years of study. This paper presents tables and charts which describe these programs and outline the career path for operators

  18. Path selection during wormhole growth

    OpenAIRE

    Yang, Y.; Hakim, S. S.; Bruns, S.; Uesugi, K.; Dalby, K. N.; Stipp, S. L. S.; Sørensen, H. O.

    2017-01-01

    Growth of wormholes in porous media can lead to self-organization of flow networks with an overwhelming geometric complexity. Despite decades of study, the mechanism by which a dominant wormhole develops its path during growth remains elusive. Here we show that the trajectory of a growing wormhole can be predicted by identifying the flowpath with a so-called minimum cumulative surface. Our theoretical analysis indicates that the cumulative surface determines the position of the dissolution fr...

  19. Elastic path controller for assistive devices.

    Science.gov (United States)

    Long, B; Rebsamen, B; Burdet, E; Yu, H; Teo, C L

    2005-01-01

    Robotic assistive devices that constrain motion along pre-defined paths are useful in reducing maneuvering efforts by human. This paper introduces an Elastic Path Controller (EPC) that adds "elasticity" to the path following and enables dynamic modification of the paths. This permits the users to compensate for changes in the environment such as introduction of new obstacles or for errors in position sensing. The experiments performed on a Scooter cobot show that users can learn to use this novel tool to modify and design guiding paths in a relatively simple way. The operators use the EPC by pushing/pulling against the guided paths to produce the desired deformations. Then, by just dropping the forces and trusting the path controller, they will be brought back to the guided paths.

  20. Cooperative path planning of unmanned aerial vehicles

    CERN Document Server

    Tsourdos, Antonios; Shanmugavel, Madhavan

    2010-01-01

    An invaluable addition to the literature on UAV guidance and cooperative control, Cooperative Path Planning of Unmanned Aerial Vehicles is a dedicated, practical guide to computational path planning for UAVs. One of the key issues facing future development of UAVs is path planning: it is vital that swarm UAVs/ MAVs can cooperate together in a coordinated manner, obeying a pre-planned course but able to react to their environment by communicating and cooperating. An optimized path is necessary in order to ensure a UAV completes its mission efficiently, safely, and successfully. Focussing on the path planning of multiple UAVs for simultaneous arrival on target, Cooperative Path Planning of Unmanned Aerial Vehicles also offers coverage of path planners that are applicable to land, sea, or space-borne vehicles. Cooperative Path Planning of Unmanned Aerial Vehicles is authored by leading researchers from Cranfield University and provides an authoritative resource for researchers, academics and engineers working in...

  1. Time optimal paths for high speed maneuvering

    Energy Technology Data Exchange (ETDEWEB)

    Reister, D.B.; Lenhart, S.M.

    1993-01-01

    Recent theoretical results have completely solved the problem of determining the minimum length path for a vehicle with a minimum turning radius moving from an initial configuration to a final configuration. Time optimal paths for a constant speed vehicle are a subset of the minimum length paths. This paper uses the Pontryagin maximum principle to find time optimal paths for a constant speed vehicle. The time optimal paths consist of sequences of axes of circles and straight lines. The maximum principle introduces concepts (dual variables, bang-bang solutions, singular solutions, and transversality conditions) that provide important insight into the nature of the time optimal paths. We explore the properties of the optimal paths and present some experimental results for a mobile robot following an optimal path.

  2. Partial Path Column Generation for the ESPPRC

    DEFF Research Database (Denmark)

    Jepsen, Mads Kehlet; Petersen, Bjørn

    This talk introduces a decomposition of the Elementary Shortest Path Problem with Resource Constraints(ESPPRC), where the path is combined by smaller sub paths. We show computational result by comparing different approaches for the decomposition and compare the best of these with existing algorit...

  3. Optical path control in the MAM testbed

    Science.gov (United States)

    Regehr, M. W.; Hines, B.; Holmes, B.

    2003-01-01

    Future space-based optical interferometers will require control of the optical path delay to accomplish some or all of the three objectives: balancing the optical path in the two arms to within a tolerance corresponding to the coherence length of the star light being observed, modulating the optical path in order to observe the phase of the star light interference fringe, and modulating the path length in order to reduce the effect of cyclic errors in the laser metrology system used to measure the optical path length in the two arms of the interferometer.

  4. Two Generations of Path Dependence in Economics?

    DEFF Research Database (Denmark)

    Madsen, Mogens Ove

    2010-01-01

    Even if there is no fully articulated and generally accepted theory of Path Dependence it has eagerly been taken up across a wide range of social sciences – primarily coming from economics. Path Dependence is most of all a metaphor that offers reason to believe, that some political, social...... or economic processes have multiple possible paths of outcomes, rather than a unique path of equilibria. The selection among outcomes may depend on contingent choices or events – outcomes of path-dependent processes require a very relevant study – a perception of history....

  5. Uncommon paths in quantum physics

    CERN Document Server

    Kazakov, Konstantin V

    2014-01-01

    Quantum mechanics is one of the most fascinating, and at the same time most controversial, branches of contemporary science. Disputes have accompanied this science since its birth and have not ceased to this day. Uncommon Paths in Quantum Physics allows the reader to contemplate deeply some ideas and methods that are seldom met in the contemporary literature. Instead of widespread recipes of mathematical physics, based on the solutions of integro-differential equations, the book follows logical and partly intuitional derivations of non-commutative algebra. Readers can directly penetrate the

  6. Welding Robot Collision-Free Path Optimization

    Directory of Open Access Journals (Sweden)

    Xuewu Wang

    2017-02-01

    Full Text Available Reasonable welding path has a significant impact on welding efficiency, and a collision-free path should be considered first in the process of welding robot path planning. The shortest path length is considered as an optimization objective, and obstacle avoidance is considered as the constraint condition in this paper. First, a grid method is used as a modeling method after the optimization objective is analyzed. For local collision-free path planning, an ant colony algorithm is selected as the search strategy. Then, to overcome the shortcomings of the ant colony algorithm, a secondary optimization is presented to improve the optimization performance. Finally, the particle swarm optimization algorithm is used to realize global path planning. Simulation results show that the desired welding path can be obtained based on the optimization strategy.

  7. SSME propellant path leak detection

    Science.gov (United States)

    Crawford, Roger; Shohadaee, Ahmad Ali; Powers, W. T.

    1995-01-01

    The primary objective of this phase of the investigation is the experimental validation of techniques for detecting and analyzing propellant path external leaks which have a high probability of occurring on the SSME. The selection of candidate detection methods requires a good analytic model for leak plumes which would develop from external leaks and an understanding of radiation transfer through the leak plume. One advanced propellant path leak detection technique is obtained by using state-of-art technology of infrared (IR) thermal imaging systems combined with computer, digital image processing and expert systems for the engine protection. The feasibility of the IR leak plume detection will be evaluated on subscale simulated laboratory plumes to determine sensitivity, signal to noise, and general suitability for the application. The theoretical analysis was undertaken with the objective of developing and testing simple, easy-to-use models to predict the amount of radiation coming from a radiation source, background plate (BP), which can be absorbed, emitted and scattered by the gas leaks.

  8. Bench Testing Results for the Electrical PCM-Assisted Thermal Heating System (ePATHS)

    Energy Technology Data Exchange (ETDEWEB)

    LaClair, Tim J. [Oak Ridge National Lab. (ORNL), Oak Ridge, TN (United States); Gao, Zhiming [Oak Ridge National Lab. (ORNL), Oak Ridge, TN (United States); Abdelaziz, Omar [Oak Ridge National Lab. (ORNL), Oak Ridge, TN (United States)

    2016-04-20

    Bench testing of the Electrical PCM-Assisted Thermal Heating System (ePATHS) was completed at the Building Technologies Research and Integration Center (BTRIC) at the Oak Ridge National Laboratory (ORNL). The ePATHS is a thermal energy storage device designed to reduce the energy required from the battery for cabin heating of electric vehicles (EVs) and plug-in hybrid electric vehicles (PHEVs). ORNL s testing of the ePATHS assessed three main aspects of operation of the device: 1.ePATHS charging evaluation: measure the time to charge and the energy input needed to fully charge the PCM for a range of different ambient conditions. 2.ePATHS Discharge Evaluations: measure the energy provided by the PCM HX, both during mode 1 and mode 2 operation, and confirm the cabin heating duration that can be provided by the ePATHS. This is the primary evaluation to validate the system performance, and an array of multiple ambient conditions and operating scenarios were tested. 3.Evaluation of Thermal Losses from the ePATHS during Cold Soak: this test will evaluate the performance of the insulation system for the ePATHS. The charged ePATHS undergoes a long-term soak in cold ambient temperature conditions, and the heat losses will be evaluated to validate that the performance meets the maximum energy loss requirement.

  9. Energy-optimal path planning in the coastal ocean

    Science.gov (United States)

    Subramani, Deepak N.; Haley, Patrick J.; Lermusiaux, Pierre F. J.

    2017-05-01

    We integrate data-driven ocean modeling with the stochastic Dynamically Orthogonal (DO) level-set optimization methodology to compute and study energy-optimal paths, speeds, and headings for ocean vehicles in the Middle-Atlantic Bight (MAB) region. We hindcast the energy-optimal paths from among exact time-optimal paths for the period 28 August 2006 to 9 September 2006. To do so, we first obtain a data-assimilative multiscale reanalysis, combining ocean observations with implicit two-way nested multiresolution primitive-equation simulations of the tidal-to-mesoscale dynamics in the region. Second, we solve the reduced-order stochastic DO level-set partial differential equations (PDEs) to compute the joint probability of minimum arrival time, vehicle-speed time series, and total energy utilized. Third, for each arrival time, we select the vehicle-speed time series that minimize the total energy utilization from the marginal probability of vehicle-speed and total energy. The corresponding energy-optimal path and headings are obtained through the exact particle-backtracking equation. Theoretically, the present methodology is PDE-based and provides fundamental energy-optimal predictions without heuristics. Computationally, it is 3-4 orders of magnitude faster than direct Monte Carlo methods. For the missions considered, we analyze the effects of the regional tidal currents, strong wind events, coastal jets, shelfbreak front, and other local circulations on the energy-optimal paths. Results showcase the opportunities for vehicles that intelligently utilize the ocean environment to minimize energy usage, rigorously integrating ocean forecasting with optimal control of autonomous vehicles.

  10. Pathfinder: Visual Analysis of Paths in Graphs

    Science.gov (United States)

    Partl, C.; Gratzl, S.; Streit, M.; Wassermann, A. M.; Pfister, H.; Schmalstieg, D.; Lex, A.

    2016-01-01

    The analysis of paths in graphs is highly relevant in many domains. Typically, path-related tasks are performed in node-link layouts. Unfortunately, graph layouts often do not scale to the size of many real world networks. Also, many networks are multivariate, i.e., contain rich attribute sets associated with the nodes and edges. These attributes are often critical in judging paths, but directly visualizing attributes in a graph layout exacerbates the scalability problem. In this paper, we present visual analysis solutions dedicated to path-related tasks in large and highly multivariate graphs. We show that by focusing on paths, we can address the scalability problem of multivariate graph visualization, equipping analysts with a powerful tool to explore large graphs. We introduce Pathfinder (Figure 1), a technique that provides visual methods to query paths, while considering various constraints. The resulting set of paths is visualized in both a ranked list and as a node-link diagram. For the paths in the list, we display rich attribute data associated with nodes and edges, and the node-link diagram provides topological context. The paths can be ranked based on topological properties, such as path length or average node degree, and scores derived from attribute data. Pathfinder is designed to scale to graphs with tens of thousands of nodes and edges by employing strategies such as incremental query results. We demonstrate Pathfinder's fitness for use in scenarios with data from a coauthor network and biological pathways. PMID:27942090

  11. Pathfinder: Visual Analysis of Paths in Graphs.

    Science.gov (United States)

    Partl, C; Gratzl, S; Streit, M; Wassermann, A M; Pfister, H; Schmalstieg, D; Lex, A

    2016-06-01

    The analysis of paths in graphs is highly relevant in many domains. Typically, path-related tasks are performed in node-link layouts. Unfortunately, graph layouts often do not scale to the size of many real world networks. Also, many networks are multivariate, i.e., contain rich attribute sets associated with the nodes and edges. These attributes are often critical in judging paths, but directly visualizing attributes in a graph layout exacerbates the scalability problem. In this paper, we present visual analysis solutions dedicated to path-related tasks in large and highly multivariate graphs. We show that by focusing on paths, we can address the scalability problem of multivariate graph visualization, equipping analysts with a powerful tool to explore large graphs. We introduce Pathfinder (Figure 1), a technique that provides visual methods to query paths, while considering various constraints. The resulting set of paths is visualized in both a ranked list and as a node-link diagram. For the paths in the list, we display rich attribute data associated with nodes and edges, and the node-link diagram provides topological context. The paths can be ranked based on topological properties, such as path length or average node degree, and scores derived from attribute data. Pathfinder is designed to scale to graphs with tens of thousands of nodes and edges by employing strategies such as incremental query results. We demonstrate Pathfinder's fitness for use in scenarios with data from a coauthor network and biological pathways.

  12. Hierarchical path planning and control of a small fixed-wing UAV: Theory and experimental validation

    Science.gov (United States)

    Jung, Dongwon

    2007-12-01

    problem is formulated by setting up geometric linear constraints as well as boundary conditions. Subsequently, we construct B-spline path templates by solving a set of distinct optimization problems. For application in UAV motion planning, the path templates are incorporated to replace parts of the entire path by the smooth B-spline paths. Each path segment is stitched together while preserving continuity to obtain a final smooth reference path to be used for path following control. The path following control for a small fixed-wing UAV to track the prescribed smooth reference path is also addressed. Assuming the UAV is equipped with an autopilot for low level control, we adopt a kinematic error model with respect to the moving Serret-Frenet frame attached to a path for tracking controller design. A kinematic path following control law that commands heading rate is presented. Backstepping is applied to derive the roll angle command by taking into account the approximate closed-loop roll dynamics. A parameter adaptation technique is employed to account for the inaccurate time constant of the closed-loop roll dynamics during actual implementation. Finally, we implement the proposed hierarchical path control of a small UAV on the actual hardware platform, which is based on an 1/5 scale R/C model airframe (Decathlon) and the autopilot hardware and software. Based on the hardware-in-the-loop (HIL) simulation environment, the proposed hierarchical path control algorithm has been validated through on-line, real-time implementation on a small micro-controller. By a seamless integration of the control algorithms for path planning, path smoothing, and path following, it has been demonstrated that the UAV equipped with a small autopilot having limited computational resources manages to accomplish the path control objective to reach the goal while avoiding obstacles with minimal human intervention.

  13. Link fermions and dynamically correlated paths for lattice gauge theory

    Energy Technology Data Exchange (ETDEWEB)

    Brower, R.C. (Harvard Univ., Cambridge, MA (USA). Lyman Lab. of Physics); Giles, R.C. (Massachusetts Inst. of Tech., Cambridge (USA). Lab. for Nuclear Science); Kessler, D.A. (Los Alamos National Lab., NM (USA). Theoretical Div.); Maturana, G. (California Univ., Santa Cruz (USA). Physics Dept.)

    1983-07-07

    The calculation of fermion bound states in lattice QCD is discussed from the point of view of the Feynman path integral and the corresponding lattice 'path sum' representation of the fermion propagator. Path sum methods which correlate the trajectories of valence fermion and antifermion constituents of a meson bound state are presented. The resultant Monte Carlo algorithm for the meson propagator samples predominantly those configurations which are expected to be most important for a tightly bound system. Relative to other techniques, this procedure anticipates cancellations due to gauge field averaging, and in addition, allows a more detailed examination of the bound state wavefunction. Inspired by the fermionic path representation of the 2D Ising model, we also introduce a new class of lattice fermion actions with nearest neighbor interactions between Grassman variables associated with links. These link fermions are a simple generalization of Wilson's fermions. They have an additional corner weight parameter which can be adjusted to obtain a much improved dispersion relation for moderate and parge lattice momenta.

  14. enviPath – The environmental contaminant biotransformation pathway resource

    Science.gov (United States)

    Wicker, Jörg; Lorsbach, Tim; Gütlein, Martin; Schmid, Emanuel; Latino, Diogo; Kramer, Stefan; Fenner, Kathrin

    2016-01-01

    The University of Minnesota Biocatalysis/Biodegradation Database and Pathway Prediction System (UM-BBD/PPS) has been a unique resource covering microbial biotransformation pathways of primarily xenobiotic chemicals for over 15 years. This paper introduces the successor system, enviPath (The Environmental Contaminant Biotransformation Pathway Resource), which is a complete redesign and reimplementation of UM-BBD/PPS. enviPath uses the database from the UM-BBD/PPS as a basis, extends the use of this database, and allows users to include their own data to support multiple use cases. Relative reasoning is supported for the refinement of predictions and to allow its extensions in terms of previously published, but not implemented machine learning models. User access is simplified by providing a REST API that simplifies the inclusion of enviPath into existing workflows. An RDF database is used to enable simple integration with other databases. enviPath is publicly available at https://envipath.org with free and open access to its core data. PMID:26582924

  15. enviPath--The environmental contaminant biotransformation pathway resource.

    Science.gov (United States)

    Wicker, Jörg; Lorsbach, Tim; Gütlein, Martin; Schmid, Emanuel; Latino, Diogo; Kramer, Stefan; Fenner, Kathrin

    2016-01-04

    The University of Minnesota Biocatalysis/Biodegradation Database and Pathway Prediction System (UM-BBD/PPS) has been a unique resource covering microbial biotransformation pathways of primarily xenobiotic chemicals for over 15 years. This paper introduces the successor system, enviPath (The Environmental Contaminant Biotransformation Pathway Resource), which is a complete redesign and reimplementation of UM-BBD/PPS. enviPath uses the database from the UM-BBD/PPS as a basis, extends the use of this database, and allows users to include their own data to support multiple use cases. Relative reasoning is supported for the refinement of predictions and to allow its extensions in terms of previously published, but not implemented machine learning models. User access is simplified by providing a REST API that simplifies the inclusion of enviPath into existing workflows. An RDF database is used to enable simple integration with other databases. enviPath is publicly available at https://envipath.org with free and open access to its core data. © The Author(s) 2015. Published by Oxford University Press on behalf of Nucleic Acids Research.

  16. The Chinese path to individualization.

    Science.gov (United States)

    Yan, Yunxiang

    2010-09-01

    This article explores the rise of the individual and the consequential individualization of society which should be viewed as a reflexive part of China's state-sponsored quest for modernity. It traces the origin of the individualization process to the Maoist era, arguing that some collectivist programmes of social engineering and the socialist path of modernization under Maoism ironically resulted in a partial individualization of Chinese society. Examining profound social changes during the three decades of the post-Mao reforms, the article reveals a number of similarities with the individualization process in Western Europe but also demonstrates some important differences. In the last section, the theoretical implications of the Chinese case in light of Ulrich Beck's theory of individualization and second modernity are discussed. © London School of Economics and Political Science 2010.

  17. Counting paths with Schur transitions

    Energy Technology Data Exchange (ETDEWEB)

    Díaz, Pablo [Department of Physics and Astronomy, University of Lethbridge, Lethbridge, Alberta, T1K 3M4 (Canada); Kemp, Garreth [Department of Physics, University of Johannesburg, P.O. Box 524, Auckland Park 2006 (South Africa); Véliz-Osorio, Alvaro, E-mail: aveliz@gmail.com [Mandelstam Institute for Theoretical Physics, University of the Witwatersrand, WITS 2050, Johannesburg (South Africa); School of Physics and Astronomy, Queen Mary, University of London, Mile End Road, London E1 4NS (United Kingdom)

    2016-10-15

    In this work we explore the structure of the branching graph of the unitary group using Schur transitions. We find that these transitions suggest a new combinatorial expression for counting paths in the branching graph. This formula, which is valid for any rank of the unitary group, reproduces known asymptotic results. We proceed to establish the general validity of this expression by a formal proof. The form of this equation strongly hints towards a quantum generalization. Thus, we introduce a notion of quantum relative dimension and subject it to the appropriate consistency tests. This new quantity finds its natural environment in the context of RCFTs and fractional statistics; where the already established notion of quantum dimension has proven to be of great physical importance.

  18. Strategic Team AI Path Plans: Probabilistic Pathfinding

    Directory of Open Access Journals (Sweden)

    Tng C. H. John

    2008-01-01

    Full Text Available This paper proposes a novel method to generate strategic team AI pathfinding plans for computer games and simulations using probabilistic pathfinding. This method is inspired by genetic algorithms (Russell and Norvig, 2002, in that, a fitness function is used to test the quality of the path plans. The method generates high-quality path plans by eliminating the low-quality ones. The path plans are generated by probabilistic pathfinding, and the elimination is done by a fitness test of the path plans. This path plan generation method has the ability to generate variation or different high-quality paths, which is desired for games to increase replay values. This work is an extension of our earlier work on team AI: probabilistic pathfinding (John et al., 2006. We explore ways to combine probabilistic pathfinding and genetic algorithm to create a new method to generate strategic team AI pathfinding plans.

  19. Crack path morphology in dual phase steel

    International Nuclear Information System (INIS)

    Sarwar, M.

    1995-01-01

    The crack path morphology in low carbon, low alloy dual phase steel has been investigated. Thermomechanical processing and inter critical heat treatments were used to vary proportion, morphology, and distribution of the ferrite and martensite phases. The tortuous morphology of crack path was observed in unrolled material at high delta K. In thermo mechanically processed material, the crack tended to cross martensite frequently and crack path become less circuitous. (author)

  20. Design of Active N-path Filters

    NARCIS (Netherlands)

    Darvishi, M.; van der Zee, Ronan A.R.; Nauta, Bram

    2013-01-01

    A design methodology for synthesis of active N-path bandpass filters is introduced. Based on this methodology, a 0.1-to-1.2 GHz tunable 6th-order N-path channel-select filter in 65 nm LP CMOS is introduced. It is based on coupling N-path filters with gyrators, achieving a “flat‿ passband shape and

  1. Symbolic PathFinder v7

    DEFF Research Database (Denmark)

    Luckow, Kasper Søe; Păsăreanu, Corina

    2014-01-01

    We describe Symbolic PathFinder v7 in terms of its updated design addressing the changes of Java PathFinder v7 and of its new optimization when computing path conditions. Furthermore, we describe the Symbolic Execution Tree Extension; a newly added feature that allows for outputting the symbolic...... execution tree that characterizes the execution paths covered during symbolic execution. The new extension can be tailored to the needs of subsequent analyses/processing facilities, and we demonstrate this by presenting SPF-Visualizer, which is a tool for customizable visualization of the symbolic execution...

  2. Integrated magnetic transformer assembly

    DEFF Research Database (Denmark)

    2014-01-01

    The present invention relates to an integrated magnetics transformer assembly comprising a first magnetically permeable core forming a first substantially closed magnetic flux path and a second magnetically permeable core forming a second substantially closed magnetic flux path. A first input...... inductor winding is wound around a first predetermined segment of the first magnetically permeable core and a second input inductor winding is wound around a first predetermined segment of the second magnetically permeable core. The integrated magnetics transformer assembly further comprises a first output......-winding of the first output inductor winding and the first half-winding of the second output inductor winding are configured to produce aligned, i.e. in the same direction, magnetic fluxes through the first substantially closed magnetic flux path. The integrated magnetics transformer assembly is well- suited for use...

  3. Theory of hot and rotating nuclei within the static path approximation

    International Nuclear Information System (INIS)

    Ansari, A.

    1995-01-01

    For the description of hot and rotating nuclei the static path approximation to the path integral representation of the partition function is at present the best practicable approach incorporating rigorously the statistical fluctuations in nuclear shape degrees of freedom. The paper briefly discusses the method and present a few of the recent results on level densities and GDR (giant dipole resonance) γ-absorption cross sections. (author). 22 refs., 2 figs

  4. Machine Learning from Garden Path Sentences: The Application of Computational Linguistics

    Directory of Open Access Journals (Sweden)

    Jiali Du

    2014-12-01

    Full Text Available This paper discusses the application of computational linguistics in the machine learning (ML system for the processing of garden path sentences. ML is closely related to artificial intelligence and linguistic cognition. The rapid and efficient processing of the complex structures is an effective method to test the system. By means of parsing the garden path sentence, we draw a conclusion that the integration of theoretical and statistical methods is helpful for the development of ML system.

  5. Hybrid waveguide-bulk multi-path interferometer with switchable amplitude and phase

    Directory of Open Access Journals (Sweden)

    Robert Keil

    2016-11-01

    Full Text Available We design and realise a hybrid interferometer consisting of three paths based on integrated as well as on bulk optical components. This hybrid construction offers a good compromise between stability and footprint on one side and means of intervention on the other. As experimentally verified by the absence of higher-order interferences, amplitude and phase can be manipulated in all paths independently. In conjunction with single photons, the setup can, therefore, be applied for fundamental investigations on quantum mechanics.

  6. Poisson processes on groups and Feynman path integrals

    International Nuclear Information System (INIS)

    Combe, P.; Rodriguez, R.; Sirugue-Collin, M.; Centre National de la Recherche Scientifique, 13 - Marseille; Sirugue, M.

    1979-09-01

    An expression is given for the perturbed evolution of a free evolution by gentle, possibly velocity dependent, potential, in terms of the expectation with respect to a Poisson process on a group. Various applications are given in particular to usual quantum mechanics but also to Fermi and spin systems

  7. Path Integral Molecular Dynamics Simulations of High Pressure Hydrogen

    Science.gov (United States)

    Biermann, Silke; Hohl, Detlef; Marx, Dominik

    We study nuclear quantum effects on the structural properties of hydrogen at 50 K and beyond 150 GPa by a method that takes into account the quantum nature of both electrons and protons 1. The structure of solid hydrogen at such high compression is found to be unexpectedly diffuse, sharing characteristics with the high-T fluid or plasma-like phases. This suggests the concept of a "quantum fluxional solid" which cannot be understood in terms of a single underlying classical structure.

  8. A path integral derivation of χy-genus

    International Nuclear Information System (INIS)

    Meng, Guowu

    2003-01-01

    The formula for the Hirzebruch χ y -genus of complex manifolds is a consequence of the Hirzebruch-Riemann-Roch formula. The classical index formulae for Todd genus, Euler number and signature correspond to the case when the complex variable y=0, -1 and 1 respectively. Here we give a direct derivation of this nice formula based on supersymmetric quantum mechanics

  9. On the path integral quantization of chiral bosons

    International Nuclear Information System (INIS)

    Schaposnik, F.A.; Schaposnik, F.A.; Solomin, J.E.

    1989-01-01

    The authors show that, in the covariant Lagrangian formalism, a proper treatment of the gauge degree of freedom in a model of chiral bosons proposed by Siegel uncovers the presence of a Jacobian (a Wess-Zumino action): the group of gauge transformations gets quantized and the anomaly is absorbed

  10. M-Learning--On Path to Integration with Organisation Systems

    Science.gov (United States)

    Srivastava, Shilpa; Gulati, Ved Prakash

    2014-01-01

    Learning is essential in organizations for them to survive. However, given the changing environment owing to global inter-connectedness, mobile workforce, global unpredictability and complexities, the learning approach must also change. Today the Learning and Development unit must be able to facilitate collaborative work, develop learning…

  11. Data Integration: Charting a Path Forward to 2035

    Science.gov (United States)

    2011-02-14

    www.gartner.com/technology/media- products/reprints/sas/vol7/article4/article4.html, (accessed 28 Nov 2010). Friedman, Thomas. The Lexus and the...Thomas Friedman‘s The Lexus and the Olive Tree definition of a superempowered individual and asserts that Julian Assange may be the ―first truly

  12. The path-integral formulation of supersymmetric string theory

    International Nuclear Information System (INIS)

    Verlinde, H.L.

    1988-01-01

    The loop corrections to superstring scattering amplitudes are studied. An explicit construction of the partition and correlation functions of all the string fields on an arbitrary ordinary Riemann surface is given in terms of theta-functions. The amplitudes of the space-time supersymmetry current are studied. These are shown to contain unphysical singularities. 94 refs.; 4 figs

  13. Feynman path integral in area tensor Regge calculus and positivity

    International Nuclear Information System (INIS)

    Khatsymovsky, V.M.

    2004-01-01

    The versions of quantum measure in the area tensor Regge calculus constructed in the previous paper are studied on the simplest configurations of the system. These are found to be positively defined in the Euclidean case on physical surface corresponding to the ordinary Regge calculus (but not outside this surface), that is, adopt probabilistic interpretation. (Since Euclidean measure is defined via analytical continuation, positivity is not evident property.) An argument for positivity on physical surface on general configurations of area tensor Regge calculus is given

  14. AM-CW Integrated Path Differential Absorption Lidar Project

    Data.gov (United States)

    National Aeronautics and Space Administration — This proposal addresses NASA's science objectives with innovative lidar architecture for atmospheric CO2 measurements. Specifically, the proposed work can support...

  15. Low convergence path to fusion II: An integrated NIF design

    Science.gov (United States)

    Schmitt, Mark J.; Molvig, K.; McCall, G. H.; Edgel, D. H.; Myatt, J. E.; Betti, R.; Froula, D. H.; Campbell, E. M.

    2016-10-01

    We report on the Revolver design methodology for achieving ignition using large diameter (6mm) Be shells to efficiently ( 10%) convert laser energy from a short, 5 ns, 320TW laser pulse on the National Ignition Facility (NIF) into a dynamic pressure source for inertial confinement fusion. It is shown that this source can be used to kinetically drive two nested internal shells to achieve ignition conditions inside a central liquid DT core. Using principles recently elucidated [K. Molvig, et al., Phys. Rev. Lett. 116, 255003, 2016], we formulate a robust optimization of a triple shell target that mitigates long-standing issues with conventional ignition schemes including drive non-uniformities, laser plasma instabilities (including the hot electrons they produce), non-local heat conduction and deceleration Rayleigh-Taylor (RT) mix. Rad-hydro simulations predict ignition initiating at 2.5keV with 90% of the maximum inner shell velocity remaining (before deceleration RT can cause significant mix in the compressed DT fuel). Simulations in 2D show that the short pulse design produces a spatially uniform kinetic drive that is tolerant to random 5% variations in laser cone power. Moreover, it will be shown that intra-shell parameters can be adjusted to mitigate convergence growth of capsule spatial non-uniformities. This research supported by the US DOE/NNSA, performed in part at LANL, operated by LANS LLC under contract DE-AC52-06NA25396.

  16. Lectures on relativistic quantum mechanics and path integration

    International Nuclear Information System (INIS)

    Gunn, J.M.F.

    1989-02-01

    The question posed is why bother with relativistic quantum mechanics? Three reasons are given: First that there are many experimental phenomena which cannot be explained in non-relativistic terms. Secondly it would be unsatisfactory if relativity and quantum mechanics could not be united. Thirdly, there are theoretical reasons why new effects can be expected at relativistic velocities. The objectives of the course are to set up relativistic analogues of the Schroedinger equation and to understand their consequences. In doing so there are some questions which are raised and discussed such as can a first order equation be used to describe spin 0 particles and a second order equation be used to describe spin 1/ 2 (author)

  17. Detection of deregulated modules using deregulatory linked path.

    Directory of Open Access Journals (Sweden)

    Yuxuan Hu

    Full Text Available The identification of deregulated modules (such as induced by oncogenes is a crucial step for exploring the pathogenic process of complex diseases. Most of the existing methods focus on deregulation of genes rather than the links of the path among them. In this study, we emphasize on the detection of deregulated links, and develop a novel and effective regulatory path-based approach in finding deregulated modules. Observing that a regulatory pathway between two genes might involve in multiple rather than a single path, we identify condition-specific core regulatory path (CCRP to detect the significant deregulation of regulatory links. Using time-series gene expression, we define the regulatory strength within each gene pair based on statistical dependence analysis. The CCRPs in regulatory networks can then be identified using the shortest path algorithm. Finally, we derive the deregulated modules by integrating the differential edges (as deregulated links of the CCRPs between the case and the control group. To demonstrate the effectiveness of our approach, we apply the method to expression data associated with different states of Human Epidermal Growth Factor Receptor 2 (HER2. The experimental results show that the genes as well as the links in the deregulated modules are significantly enriched in multiple KEGG pathways and GO biological processes, most of which can be validated to suffer from impact of this oncogene based on previous studies. Additionally, we find the regulatory mechanism associated with the crucial gene SNAI1 significantly deregulated resulting from the activation of HER2. Hence, our method provides not only a strategy for detecting the deregulated links in regulatory networks, but also a way to identify concerning deregulated modules, thus contributing to the target selection of edgetic drugs.

  18. A path-following driver/vehicle model with optimized lateral dynamic controller

    Directory of Open Access Journals (Sweden)

    Behrooz Mashadi

    Full Text Available Reduction in traffic congestion and overall number of accidents, especially within the last decade, can be attributed to the enormous progress in active safety. Vehicle path following control with the presence of driver commands can be regarded as one of the important issues in vehicle active safety systems development and more realistic explanation of vehicle path tracking problem. In this paper, an integrated driver/DYC control system is presented that regulates the steering angle and yaw moment, considering driver previewed path. Thus, the driver previewed distance, the heading error and the lateral deviation between the vehicle and desired path are used as inputs. Then, the controller determines and applies a corrective steering angle and a direct yaw moment to make the vehicle follow the desired path. A PID controller with optimized gains is used for the control of integrated driver/DYC system. Genetic Algorithm as an intelligent optimization method is utilized to adapt PID controller gains for various working situations. Proposed integrated driver/DYC controller is examined on lane change manuvers andthe sensitivity of the control system is investigated through the changes in the driver model and vehicle parameters. Simulation results show the pronounced effectiveness of the controller in vehicle path following and stability.

  19. Gerbertian paths for the Jubilee

    Science.gov (United States)

    Sigismondi, Costantino

    2015-04-01

    Gerbert before becoming Pope Sylvester II came several times in Rome, as reported in his Letters and in the biography of Richerus. Eight places in Rome can be connected with Gerbertian memories. 1. The Cathedral of St. John in the Lateran where the gravestone of his tumb is still preserved near the Holy Door; 2. the “Basilica Hierusalem” (Santa Croce) where Gerbert had the stroke on May 3rd 1003 which lead him to death on May 12th; 3. the Aventine hill, with the church of the Knights of Malta in the place where the palace of the Ottonian Emperors was located; 4. the church of St. Bartholomew in the Tiber Island built in 997 under Otto III; 5. the Obelisk of Augustus in Montecitorio to remember the relationship between Gerbert, Astronomy and numbers which led the birth of the legends on Gerbert magician; 6. St. Mary Major end of the procession of August 15, 1000; 7. St. Paul outside the walls with the iconography of the Popes and 8. St. Peter's tumb end of all Romaei pilgrimages. This Gerbertian path in Rome suggests one way to accomplish the pilgrimage suggested by Pope Francis in the Bulla Misericordiae Vultus (14) of indiction of the new Jubilee.

  20. Inked Careers: Tattooing Professional Paths

    Directory of Open Access Journals (Sweden)

    Gabriela DeLuca

    2016-12-01

    Full Text Available The concept of career has an interdisciplinary and historical constitution, which includes persons, groups, organizations and society. Given that, we aim to deepen the interactionist notion of career from the understanding of a deviant path, supported by a theory and a method appropriated to the cited call for interdisciplinary approaches. Dilemmas (Hughes, 1958 and conflicts (Hughes, 1937 emerged as important analytical categories. Although necessary, these two concepts were not sufficient to contemplate analyses in their entirety. For this reason we conceptualized a third possibility of controversy during a career: the inquiries. The study followed the Narrative method to analyze objective and subjective changes during a tattoo artist’s career through interviews and informal conversations carried out over 22 months. The discussion presents three main contributions. Theoretically, a new understanding of the concept of careers, linking past, present and future and the idea of non-linearity of experienced and envisioned careers. Methodologically, suggesting orientations for future career studies such as the use of turning points as a methodological tool and the investigation of deviant fields. Finally, our defense of the interactionist perspective as suitable for career studies, since it allows the investigation of deviant elements.