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Quantum Statistical Mechanics by William C. Schieve
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1From Quantum Mechanics To Classical Statistical Physics: Generalized Rokhsar-Kivelson Hamiltonians And The "Stochastic Matrix Form" Decomposition
By Claudio Castelnovo, Claudio Chamon, Christopher Mudry and Pierre Pujol
Quantum Hamiltonians that are fine-tuned to their so-called Rokhsar-Kivelson (RK) points, first presented in the context of quantum dimer models, are defined by their representations in preferred bases in which their ground state wave functions are intimately related to the partition functions of combinatorial problems of classical statistical physics. We show that all the known examples of quantum Hamiltonians, when fine-tuned to their RK points, belong to a larger class of real, symmetric, and irreducible matrices that admit what we dub a Stochastic Matrix Form (SMF) decomposition. Matrices that are SMF decomposable are shown to be in one-to-one correspondence with stochastic classical systems described by a Master equation of the matrix type, hence their name. It then follows that the equilibrium partition function of the stochastic classical system partly controls the zero-temperature quantum phase diagram, while the relaxation rates of the stochastic classical system coincide with the excitation spectrum of the quantum problem. Given a generic quantum Hamiltonian construed as an abstract operator defined on some Hilbert space, we prove that there exists a continuous manifold of bases in which the representation of the quantum Hamiltonian is SMF decomposable, i.e., there is a (continuous) manifold of distinct stochastic classical systems related to the same quantum problem. Finally, we illustrate with three examples of Hamiltonians fine-tuned to their RK points, the triangular quantum dimer model, the quantum eight-vertex model, and the quantum three-coloring model on the honeycomb lattice, how they can be understood within our framework, and how this allows for immediate generalizations, e.g., by adding non-trivial interactions to these models.
“From Quantum Mechanics To Classical Statistical Physics: Generalized Rokhsar-Kivelson Hamiltonians And The "Stochastic Matrix Form" Decomposition” Metadata:
- Title: ➤ From Quantum Mechanics To Classical Statistical Physics: Generalized Rokhsar-Kivelson Hamiltonians And The "Stochastic Matrix Form" Decomposition
- Authors: Claudio CastelnovoClaudio ChamonChristopher MudryPierre Pujol
- Language: English
Edition Identifiers:
- Internet Archive ID: arxiv-cond-mat0502068
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2Quantum Statistical Mechanics. I. Decoherence, Wave Function Collapse, And The Von Neumann Density Matrix
By Phil Attard
The probability operator is derived from first principles for an equilibrium quantum system. It is also shown that the superposition states collapse into a mixture of states giving the conventional von Neumann trace form for the quantum average. The mechanism for the collapse is found to be quite general: it results from the conservation law for a conserved, exchangeable variable (such as energy) and the entanglement of the total system wave function that necessarily follows. The relevance of the present results to the einselection mechanism for decoherence, to the quantum measurement problem, and to the classical nature of the macroscopic world are discussed.
“Quantum Statistical Mechanics. I. Decoherence, Wave Function Collapse, And The Von Neumann Density Matrix” Metadata:
- Title: ➤ Quantum Statistical Mechanics. I. Decoherence, Wave Function Collapse, And The Von Neumann Density Matrix
- Author: Phil Attard
“Quantum Statistical Mechanics. I. Decoherence, Wave Function Collapse, And The Von Neumann Density Matrix” Subjects and Themes:
- Subjects: Quantum Physics - Statistical Mechanics - Condensed Matter
Edition Identifiers:
- Internet Archive ID: arxiv-1401.1786
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3Quantum Statistical Mechanics, L-series And Anabelian Geometry
By Gunther Cornelissen and Matilde Marcolli
It is known that two number fields with the same Dedekind zeta function are not necessarily isomorphic. The zeta function of a number field can be interpreted as the partition function of an associated quantum statistical mechanical system, which is a C*-algebra with a one parameter group of automorphisms, built from Artin reciprocity. In the first part of this paper, we prove that isomorphism of number fields is the same as isomorphism of these associated systems. Considering the systems as noncommutative analogues of topological spaces, this result can be seen as another version of Grothendieck's "anabelian" program, much like the Neukirch-Uchida theorem characterizes isomorphism of number fields by topological isomorphism of their associated absolute Galois groups. In the second part of the paper, we use these systems to prove the following. If there is an isomorphism of character groups (viz., Pontrjagin duals) of the abelianized Galois groups of the two number fields that induces an equality of all corresponding L-series (not just the zeta function), then the number fields are isomorphic.This is also equivalent to the purely algebraic statement that there exists a topological group isomorphism as a above and a norm-preserving group isomorphism between the ideals of the fields that is compatible with the Artin maps via the other map.
“Quantum Statistical Mechanics, L-series And Anabelian Geometry” Metadata:
- Title: ➤ Quantum Statistical Mechanics, L-series And Anabelian Geometry
- Authors: Gunther CornelissenMatilde Marcolli
- Language: English
Edition Identifiers:
- Internet Archive ID: arxiv-1009.0736
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4Introduction To Non-equilibrium Quantum Statistical Mechanics
By Fujita, Shigeji
It is known that two number fields with the same Dedekind zeta function are not necessarily isomorphic. The zeta function of a number field can be interpreted as the partition function of an associated quantum statistical mechanical system, which is a C*-algebra with a one parameter group of automorphisms, built from Artin reciprocity. In the first part of this paper, we prove that isomorphism of number fields is the same as isomorphism of these associated systems. Considering the systems as noncommutative analogues of topological spaces, this result can be seen as another version of Grothendieck's "anabelian" program, much like the Neukirch-Uchida theorem characterizes isomorphism of number fields by topological isomorphism of their associated absolute Galois groups. In the second part of the paper, we use these systems to prove the following. If there is an isomorphism of character groups (viz., Pontrjagin duals) of the abelianized Galois groups of the two number fields that induces an equality of all corresponding L-series (not just the zeta function), then the number fields are isomorphic.This is also equivalent to the purely algebraic statement that there exists a topological group isomorphism as a above and a norm-preserving group isomorphism between the ideals of the fields that is compatible with the Artin maps via the other map.
“Introduction To Non-equilibrium Quantum Statistical Mechanics” Metadata:
- Title: ➤ Introduction To Non-equilibrium Quantum Statistical Mechanics
- Author: Fujita, Shigeji
- Language: English
“Introduction To Non-equilibrium Quantum Statistical Mechanics” Subjects and Themes:
- Subjects: Quantum theory - Statistical mechanics
Edition Identifiers:
- Internet Archive ID: introductiontono0000fuji
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5On Quantum Statistical Mechanics; A Study Guide
By W. A. Majewski
These notes are intended as an introduction to a study of applications of noncommutative calculus to quantum statistical Physics. Centered on noncommutative calculus we describe the physical concepts and mathematical structures appearing in the analysis of large quantum systems, and their consequences. These include the emergence of algebraic approach and the necessity of employment of infinite dimensional structures. As an illustration, a quantization of stochastic processes, new formalism for statistical mechanics, quantum field theory and quantum correlations are discussed.
“On Quantum Statistical Mechanics; A Study Guide” Metadata:
- Title: ➤ On Quantum Statistical Mechanics; A Study Guide
- Author: W. A. Majewski
“On Quantum Statistical Mechanics; A Study Guide” Subjects and Themes:
- Subjects: Mathematical Physics - Quantum Physics - Mathematics
Edition Identifiers:
- Internet Archive ID: arxiv-1608.06766
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6Extended Statistical Modeling Under Symmetry; The Link Toward Quantum Mechanics
These notes are intended as an introduction to a study of applications of noncommutative calculus to quantum statistical Physics. Centered on noncommutative calculus we describe the physical concepts and mathematical structures appearing in the analysis of large quantum systems, and their consequences. These include the emergence of algebraic approach and the necessity of employment of infinite dimensional structures. As an illustration, a quantization of stochastic processes, new formalism for statistical mechanics, quantum field theory and quantum correlations are discussed.
“Extended Statistical Modeling Under Symmetry; The Link Toward Quantum Mechanics” Metadata:
- Title: ➤ Extended Statistical Modeling Under Symmetry; The Link Toward Quantum Mechanics
- Language: Catalan
Edition Identifiers:
- Internet Archive ID: arxiv-quant-ph0503214
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7Underlining Some Limitations Of The Statistical Formalism In Quantum Mechanics: Reply To The Comment Of Bodor And Diósi
By F. Fratini and A. G. Hayrapetyan
In a paper of us, it is showed that Density Matrices do not provide a complete description of ensembles of states in quantum mechanics, since they lack measurable information concerning the preparation of the ensembles. Bodor and Di\'osi have later posted a comment on that article, which agrees on some points of it but disagrees on some others. This reply is intended to clarify the discussion.
“Underlining Some Limitations Of The Statistical Formalism In Quantum Mechanics: Reply To The Comment Of Bodor And Diósi” Metadata:
- Title: ➤ Underlining Some Limitations Of The Statistical Formalism In Quantum Mechanics: Reply To The Comment Of Bodor And Diósi
- Authors: F. FratiniA. G. Hayrapetyan
- Language: English
Edition Identifiers:
- Internet Archive ID: arxiv-1204.1071
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8Born's Rule From Statistical Mechanics Of Classical Fields: From Hitting Times To Quantum Probabilities
By Andrei Khrennikov
We show that quantum probabilities can be derived from statistical mechanics of classical fields. We consider Brownian motion in the space of fields and show that such a random field interacting with threshold type detectors produces clicks at random moments of time. And the corresponding probability distribution can be approximately described by the formalism of quantum mechanics. Hence, probabilities in quantum mechanics and classical statistical mechanics differ not so much as it is typically claimed. The temporal structure of the "prequantum random field" (which is the $L_2$-valued Wiener process) plays the crucial role. Moments of detector's clicks are mathematically described as hitting times which are actively used in classical theory of stochastic processes. Born's rule appears as an approximate rule. In principle, the difference between the "precise detection probability rule" derived in this paper and the conventional Born's rule can be tested experimentally. In our model the presence of the random gain in detectors playes a crucial role. We also stress the role of the detection threshold. It is not merely a technicality, but the fundamental element of the model.
“Born's Rule From Statistical Mechanics Of Classical Fields: From Hitting Times To Quantum Probabilities” Metadata:
- Title: ➤ Born's Rule From Statistical Mechanics Of Classical Fields: From Hitting Times To Quantum Probabilities
- Author: Andrei Khrennikov
- Language: English
Edition Identifiers:
- Internet Archive ID: arxiv-1212.0756
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9Spectral Triplets, Statistical Mechanics And Emergent Geometry In Non-commutative Quantum Mechanics
We show that quantum probabilities can be derived from statistical mechanics of classical fields. We consider Brownian motion in the space of fields and show that such a random field interacting with threshold type detectors produces clicks at random moments of time. And the corresponding probability distribution can be approximately described by the formalism of quantum mechanics. Hence, probabilities in quantum mechanics and classical statistical mechanics differ not so much as it is typically claimed. The temporal structure of the "prequantum random field" (which is the $L_2$-valued Wiener process) plays the crucial role. Moments of detector's clicks are mathematically described as hitting times which are actively used in classical theory of stochastic processes. Born's rule appears as an approximate rule. In principle, the difference between the "precise detection probability rule" derived in this paper and the conventional Born's rule can be tested experimentally. In our model the presence of the random gain in detectors playes a crucial role. We also stress the role of the detection threshold. It is not merely a technicality, but the fundamental element of the model.
“Spectral Triplets, Statistical Mechanics And Emergent Geometry In Non-commutative Quantum Mechanics” Metadata:
- Title: ➤ Spectral Triplets, Statistical Mechanics And Emergent Geometry In Non-commutative Quantum Mechanics
Edition Identifiers:
- Internet Archive ID: arxiv-1206.5119
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10Quantum Mechanics As An Approximation Of Statistical Mechanics For Classical Fields
By Andrei Khrennikov
We show that, in spite of a rather common opinion, quantum mechanics can be represented as an approximation of classical statistical mechanics. The approximation under consideration is based on the ordinary Taylor expansion of physical variables. The quantum contribution is given by the term of the second order. To escape technical difficulties, we start with the finite dimensional quantum mechanics. In our approach quantum mechanics is an approximative theory. It predicts statistical averages only with some precision. In principle, there might be found deviations of averages calculated within the quantum formalism from experimental averages (which are supposed to be equal to classical averages given by our model).
“Quantum Mechanics As An Approximation Of Statistical Mechanics For Classical Fields” Metadata:
- Title: ➤ Quantum Mechanics As An Approximation Of Statistical Mechanics For Classical Fields
- Author: Andrei Khrennikov
- Language: English
Edition Identifiers:
- Internet Archive ID: arxiv-cond-mat0506077
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11Non-Equilibrium Statistical Mechanics Of Classical And Quantum Systems
By Dimitri Kusnezov, Eric Lutz and Kenichiro Aoki
We study the statistical mechanics of classical and quantum systems in non-equilibrium steady states. Emphasis is placed on systems in strong thermal gradients. Various measures and functional forms of observables are presented. The quantum problem is set up using random matrix techniques, which allows for the construction of the master equation. Special solutions are discussed.
“Non-Equilibrium Statistical Mechanics Of Classical And Quantum Systems” Metadata:
- Title: ➤ Non-Equilibrium Statistical Mechanics Of Classical And Quantum Systems
- Authors: Dimitri KusnezovEric LutzKenichiro Aoki
- Language: English
Edition Identifiers:
- Internet Archive ID: arxiv-nlin0206008
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12Many Body Localization And Thermalization In Quantum Statistical Mechanics
By Rahul Nandkishore and David A. Huse
We review some recent developments in the statistical mechanics of isolated quantum systems. We provide a brief introduction to quantum thermalization, paying particular attention to the `Eigenstate Thermalization Hypothesis' (ETH), and the resulting `single-eigenstate statistical mechanics'. We then focus on a class of systems which fail to quantum thermalize and whose eigenstates violate the ETH: These are the many-body Anderson localized systems; their long-time properties are not captured by the conventional ensembles of quantum statistical mechanics. These systems can locally remember forever information about their local initial conditions, and are thus of interest for possibilities of storing quantum information. We discuss key features of many-body localization (MBL), and review a phenomenology of the MBL phase. Single-eigenstate statistical mechanics within the MBL phase reveals dynamically-stable ordered phases, and phase transitions among them, that are invisible to equilibrium statistical mechanics and can occur at high energy and low spatial dimensionality where equilibrium ordering is forbidden.
“Many Body Localization And Thermalization In Quantum Statistical Mechanics” Metadata:
- Title: ➤ Many Body Localization And Thermalization In Quantum Statistical Mechanics
- Authors: Rahul NandkishoreDavid A. Huse
“Many Body Localization And Thermalization In Quantum Statistical Mechanics” Subjects and Themes:
- Subjects: ➤ Disordered Systems and Neural Networks - High Energy Physics - Theory - Strongly Correlated Electrons - Statistical Mechanics - Condensed Matter
Edition Identifiers:
- Internet Archive ID: arxiv-1404.0686
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13Statistical Mechanics Of Classical And Quantum Computational Complexity
By C. R. Laumann, R. Moessner, A. Scardicchio and S. L. Sondhi
The quest for quantum computers is motivated by their potential for solving problems that defy existing, classical, computers. The theory of computational complexity, one of the crown jewels of computer science, provides a rigorous framework for classifying the hardness of problems according to the computational resources, most notably time, needed to solve them. Its extension to quantum computers allows the relative power of quantum computers to be analyzed. This framework identifies families of problems which are likely hard for classical computers (``NP-complete'') and those which are likely hard for quantum computers (``QMA-complete'') by indirect methods. That is, they identify problems of comparable worst-case difficulty without directly determining the individual hardness of any given instance. Statistical mechanical methods can be used to complement this classification by directly extracting information about particular families of instances---typically those that involve optimization---by studying random ensembles of them. These pose unusual and interesting (quantum) statistical mechanical questions and the results shed light on the difficulty of problems for large classes of algorithms as well as providing a window on the contrast between typical and worst case complexity. In these lecture notes we present an introduction to this set of ideas with older work on classical satisfiability and recent work on quantum satisfiability as primary examples. We also touch on the connection of computational hardness with the physical notion of glassiness.
“Statistical Mechanics Of Classical And Quantum Computational Complexity” Metadata:
- Title: ➤ Statistical Mechanics Of Classical And Quantum Computational Complexity
- Authors: C. R. LaumannR. MoessnerA. ScardicchioS. L. Sondhi
- Language: English
Edition Identifiers:
- Internet Archive ID: arxiv-1009.1635
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14Quantum Statistical Mechanics Results For Argon, Neon, And Helium Using Classical Monte Carlo
By Phil Attard
Quantum corrections to the classical pressure are obtained for Lennard-Jones models of argon, neon, and helium using classical Metropolis algorithm computer simulations. The corrections for non-commutativity are obtained to fourth order in Planck's constant. Compared to the classical virial pressure on all isotherms at liquid-like densities, the quantum correction is found to be ${\cal O}(10^{-2})$ for argon, ${\cal O}(10^{0})$ for neon, and ${\cal O}(10^{3})$ for helium. The first order correction due to wave function symmetrization is also obtained, but this is relatively negligible.
“Quantum Statistical Mechanics Results For Argon, Neon, And Helium Using Classical Monte Carlo” Metadata:
- Title: ➤ Quantum Statistical Mechanics Results For Argon, Neon, And Helium Using Classical Monte Carlo
- Author: Phil Attard
“Quantum Statistical Mechanics Results For Argon, Neon, And Helium Using Classical Monte Carlo” Subjects and Themes:
- Subjects: Physics - Statistical Mechanics - Quantum Physics - Condensed Matter - Chemical Physics
Edition Identifiers:
- Internet Archive ID: arxiv-1702.00096
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15DTIC ADA272809: A Formulation Of Quantum Statistical Mechanics Based On The Feynman Path Centroid Density I. Equilibrium Properties
By Defense Technical Information Center
A formulation of quantum statistical mechanics is presented in which the Feynman path centroid density in Feynman path integration is recast as the central statistical distribution used to average equilibrium and dynamical quantities. In this formulation, the path integral centroid density occupies the same role as the Boltzmann density in classical statistical mechanics. Therefore, the statistical ensemble of imaginary time path centroid configurations provides the distribution which is used to average the appropriately formulated effective operators and imaginary time correlation functions. An accurate renormalized diagrammatic perturbation theory for the centroid density and centroid-constrained imaginary time propagator will also be described with a particular emphasis given to the mathematical advantages arising from the centroid-based formulation. The present paper is concerned with the calculation of equilibrium properties from the centroid perspective, while the companion paper describes a centroid-based formalism for calculating dynamical time correlation functions. Computer Simulation, Molecular Dynamics, Charge Transfer.
“DTIC ADA272809: A Formulation Of Quantum Statistical Mechanics Based On The Feynman Path Centroid Density I. Equilibrium Properties” Metadata:
- Title: ➤ DTIC ADA272809: A Formulation Of Quantum Statistical Mechanics Based On The Feynman Path Centroid Density I. Equilibrium Properties
- Author: ➤ Defense Technical Information Center
- Language: English
“DTIC ADA272809: A Formulation Of Quantum Statistical Mechanics Based On The Feynman Path Centroid Density I. Equilibrium Properties” Subjects and Themes:
- Subjects: ➤ DTIC Archive - PENNSYLVANIA UNIV PHILADELPHIA DEPT OF CHEMISTRY - *EQUILIBRIUM(GENERAL) - *STATISTICAL MECHANICS - DENSITY - COMPUTERS - DYNAMICS - QUANTITY - CORRELATION - CONFIGURATIONS - CHARGE TRANSFER - STATISTICAL DISTRIBUTIONS - PERTURBATION THEORY - INTEGRATION - TIME - FORMULATIONS - INTEGRALS - PATHS
Edition Identifiers:
- Internet Archive ID: DTIC_ADA272809
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16Underlining Some Limitations Of The Statistical Formalism In Quantum Mechanics
By Filippo Fratini and Armen G. Hayrapetyan
We show that two chosen ensembles of spin states, which are differently prepared but are described by the same density matrix in quantum mechanics, do not fully share the same measurable characteristics. One characteristic on which they differ is shown to be the variance of the spin along a given direction. We conclude that the statistical description of an ensemble of states as given by its density matrix, although sufficient in many cases, should be considered incomplete, as it does not fully describe the measurable characteristics of the ensemble. A discussion a posteriori on the problem is provided.
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- Authors: Filippo FratiniArmen G. Hayrapetyan
- Language: English
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- Internet Archive ID: arxiv-1108.6249
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17Monte Carlo Optimization Of Trial Wave Functions In Quantum Mechanics And Statistical Mechanics
By M. P. Nightingale and C. J. Umrigar
This review covers applications of quantum Monte Carlo methods to quantum mechanical problems in the study of electronic and atomic structure, as well as applications to statistical mechanical problems both of static and dynamic nature. The common thread in all these applications is optimization of many-parameter trial states, which is done by minimization of the variance of the local or, more generally for arbitrary eigenvalue problems, minimization of the variance of the configurational eigenvalue.
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- Authors: M. P. NightingaleC. J. Umrigar
- Language: English
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18Interface Of General Relativity, Quantum Physics And Statistical Mechanics: Some Recent Developments
By Abhay Ashtekar
The arena normally used in black holes thermodynamics was recently generalized to incorporate a broad class of physically interesting situations. The key idea is to replace the notion of stationary event horizons by that of `isolated horizons.' Unlike event horizons, isolated horizons can be located in a space-time quasi-locally. Furthermore, they need not be Killing horizons. In particular, a space-time representing a black hole which is itself in equilibrium, but whose exterior contains radiation, admits an isolated horizon. In spite of this generality, the zeroth and first laws of black hole mechanics extend to isolated horizons. Furthermore, by carrying out a systematic, non-perturbative quantization, one can explore the quantum geometry of isolated horizons and account for their entropy from statistical mechanical considerations. After a general introduction to black hole thermodynamics as a whole, these recent developments are briefly summarized.
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- Author: Abhay Ashtekar
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19Statistical Mechanics And The Duality Of Quantum Mechanical Time Evolution
By Tsuguo Mogami
Through the H theorem, Bolzmann attempted to validate the foundations of statistical mechanics. However, it is incompatible with the fundamental laws of mechanics because its deduction requires the introduction of probability. In this paper we attempt a justification of statistical mechanics without deviating from the existing framework of quantum mechanics. We point out that the principle of equal a priori probabilities is easily proven in the dual space. The dual of the space of the quantum states is the space of the observations. We then prove that time evolution of the operators of observations obeys Boltzmann equation. This result implies that the difference of the states from equal probability becomes unobservable as time elapses.
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20Quantum Group Invariant, Nonextensive Quantum Statistical Mechanics
By Marcelo R. Ubriaco
We study the consequences of introducing quantum group invariance in the formalism of nonextensive quantum statistical mechanics. We find that the corresponding thermodynamical system is equivalent to a Bose-Einstein gas in the Boltzmann-Gibbs formalism with a higher critical temperature than the standard Bose-Einstein case.
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- Author: Marcelo R. Ubriaco
- Language: English
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21Non-extensive Statistical Mechanics And Black Hole Entropy From Quantum Geometry
By Abhishek Majhi
We apply non-extensive statistical mechanics, characterized by a free parameter $q$, to calculate black hole entropy from quantum geometry. For a given horizon area, the entropy of the black hole is given by the Bekenstein-Hawking area law for arbitrary real positive values of the Barbero-Immirzi parameter$(\gamma)$. In the process, we find a specific correlation between $\gamma$ and $q$ that explains how the Chern-Simons gauge fields on the horizon is coupled to the bulk geometry exterior to the horizon. It precisely comes out to be such that the microstates of the horizon become more biased away from occurring with equal probability with the increasing strength of the coupling. This leads to a physical interpretation of the $q$-parameter in the context of quantum gravity. In passing, we deduce the non-additive entropy for a system of $N$ number of spins with arbitrary spin quantum numbers which can have applications in other fields related to quantum physics than back holes.
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22DTIC ADA279233: The Formulation Of Quantum Statistical Mechanics Based On The Feynman Path Centroid Density 3. Phase Space Formalism And Analysis Of Centroid Molecular Dynamics
By Defense Technical Information Center
The formulation of quantum statistical mechanics based on the path centroid variable in Feynman path integration is generalized to a phase space perspective, thereby including the momentum as an independent dynamical variable. By virtue of this approach, operator averages and imaginary time correlation functions can be expressed in terms of an averaging over the multidimensional phase space centroid density. The imaginary time centroid- constrained correlation function matrix for the phase space variables is then found to define the effective thermal width of the phase space centroid variable. These developments also make it possible to rigorously analyze the centroid molecular dynamics method for computing quantum dynamical time correlation functions. As a result, the centroid time correlation function as calculated from centroid molecular dynamics is shown to be a well-defined approximation to the exact Kubo transformed position correlation function. This analysis thereby clarifies the underlying role of the equilibrium path centroid variable in the quantum dynamical position correlation function and provides a sound theoretical basis for the centroid molecular dynamics method. Chemical dynamics, Computer simulation, Electrochemistry
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- Author: ➤ Defense Technical Information Center
- Language: English
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- Subjects: ➤ DTIC Archive - Cao, Jianshu - PENNSYLVANIA UNIV PHILADELPHIA DEPT OFCHEMISTRY - *QUANTUM CHEMISTRY - *PHASE TRANSFORMATIONS - *QUANTUM STATISTICS - COMPUTERIZED SIMULATION - QUANTUM THEORY - ELECTROCHEMISTRY - MOLECULAR STRUCTURE - TIME DOMAIN - CORRELATION - FORMULATIONS - FOURIER TRANSFORMATION - TIME DEPENDENCE
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23Algebraic-statistical Approach To Quantum Mechanics
By D. A. Slavnov
It is proposed the scheme of quantum mechanics, in which a Hilbert space and the linear operators are not primary elements of the theory. Instead of it certain variant of the algebraic approach is considered. The elements of noncommutative algebra (observables) and the nonlinear functionals on this algebra (physical states) are used as the primary constituents. The functionals associate with results of a particular measurement. It is suggested to consider certain ensembles of the physical states as quantum states of the standart quantum mechanics. It is shown that in such scheme the mathematical formalism of the standart quantum mechanics can be reproduced completely.
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- Author: D. A. Slavnov
- Language: English
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24Position Eigenstates And The Statistical Axiom Of Quantum Mechanics
By L. Polley
Quantum mechanics postulates the existence of states determined by a particle position at a single time. This very concept, in conjunction with superposition, induces much of the quantum-mechanical structure. In particular, it implies the time evolution to obey the Schroedinger equation, and it can be used to complete a truely basic derivation of the statistical axiom as recently proposed by Deutsch.
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- Author: L. Polley
- Language: English
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25Quantum Mechanics Without Waves: A Generalization Of Classical Statistical Mechanics
By Marcello Cini
We generalize classical statistical mechanics to describe the kinematics and the dynamics of systems whose variables are constrained by a single quantum postulate (discreteness of the spectrum of values of at least one variable of the theory). This is possible provided we adopt Feynman's suggestion of dropping the assumption that the probability for an event must always be a positive number. This approach has the advantage of allowing a reformulation of quantum theory in phase space without introducing the unphysical concept of probability amplitudes, together with all the problems concerning their ambiguous properties.
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- Author: Marcello Cini
- Language: English
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26Comment On ``Quantum Statistical Mechanics Of An Ideal Gas With Fractional Exclusion Statistics In Arbitrary Dimension"
By Wung-Hong Huang
It is mentioned that anyon thermodynamic potential $Q(\alpha, N)$ could not be factorized in terms characteristic of the ideal boson $\alpha =0$ and fermion $\alpha =1$ gases by the relation $Q(\alpha, N) = (1-\alpha) Q(0, N_b)+ \alpha Q(1, N_f)$ in which $N=N_f +N_b$, that claimed in Phys. Rev. Lett. 78, 3233 (1997). Our analyses indicate that the thermodynamic quantities of anyon gas may be factorized as $Q(\alpha) = \alpha Q(1) + (1-\alpha) Q(0)$ only in the two-dimension system.
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- Author: Wung-Hong Huang
- Language: English
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27Entropic Fluctuations In Quantum Statistical Mechanics. An Introduction
By Vojkan Jaksic, Yoshiko Ogata, Yan Pautrat and Claude-Alain Pillet
These lecture notes provide an elementary introduction, within the framework of finite quantum systems, to recent developments in the theory of entropic fluctuations.
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- Authors: Vojkan JaksicYoshiko OgataYan PautratClaude-Alain Pillet
- Language: English
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- Internet Archive ID: arxiv-1106.3786
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28Quantum And Classical Statistical Mechanics Of A Class Of Non-Hermitian Hamiltonians
By H. F. Jones and E. S. Moreira Jr
This paper investigates the thermodynamics of a large class of non-Hermitian, $PT$-symmetric oscillators, whose energy spectrum is entirely real. The spectrum is estimated by second-order WKB approximation, which turns out to be very accurate even for small quantum numbers, and used to generate the quantum partition function. Graphs showing the thermal behavior of the entropy and the specific heat, at all regimes of temperature, are given. To obtain the corresponding classical partition function it turns out to be necessary in general to integrate over a complex "phase space". For the wrong-sign quartic, whose equivalent Hermitian Hamiltonian is known exactly, it is demonstrated explicitly how this formulation arises, starting from the Hermitian case.
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- Title: ➤ Quantum And Classical Statistical Mechanics Of A Class Of Non-Hermitian Hamiltonians
- Authors: H. F. JonesE. S. Moreira Jr
- Language: English
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- Internet Archive ID: arxiv-0905.2879
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29Emergence Of Quantum Mechanics From A Sub-Quantum Statistical Mechanics
By Gerhard Groessing
A research program within the scope of theories on "Emergent Quantum Mechanics" is presented, which has gained some momentum in recent years. Via the modeling of a quantum system as a non-equilibrium steady-state maintained by a permanent throughput of energy from the zero-point vacuum, the quantum is considered as an emergent system. We implement a specific "bouncer-walker" model in the context of an assumed sub-quantum statistical physics, in analogy to the results of experiments by Couder's group on a classical wave-particle duality. We can thus give an explanation of various quantum mechanical features and results on the basis of a "21st century classical physics", such as the appearance of Planck's constant, the Schr\"odinger equation, etc. An essential result is given by the proof that averaged particle trajectories' behaviors correspond to a specific type of anomalous diffusion termed "ballistic" diffusion on a sub-quantum level. It is further demonstrated both analytically and with the aid of computer simulations that our model provides explanations for various quantum effects such as double-slit or n-slit interference. We show the averaged trajectories emerging from our model to be identical to Bohmian trajectories, albeit without the need to invoke complex wave functions or any other quantum mechanical tool. Finally, the model provides new insights into the origins of entanglement, and, in particular, into the phenomenon of a "systemic" nonlocality.
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- Author: Gerhard Groessing
- Language: English
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30Topics In Quantum Statistical Mechanics And Operator Algebras
By David Ruelle
The language of operator algebras is of great help for the formulation of questions and answers in quantum statistical mechanics. In Chapter 1 we present a minimal mathematical introduction to operator algebras, with physical applications in mind. In Chapter 2 we study some questions related to the quantum statistical mechanics of spin systems, with particular attention to the time evolution of infinite systems. The basic reference for these two chapters is Bratteli-Robinson: Operator algebras and quantum statistical mechanics I, II. In Chapter 3 we discuss the nonequilibrium statistical mechanics of quantum spin systems, as it is currently being developped.
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- Author: David Ruelle
- Language: English
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31Statistical Mechanics Of Generally Covariant Quantum Theories: A Boltzmann-like Approach
By Merced Montesinos and Carlo Rovelli
We study the possibility of applying statistical mechanics to generally covariant quantum theories with a vanishing Hamiltonian. We show that (under certain appropiate conditions) this makes sense, in spite of the absence of a notion of energy and external time. We consider a composite system formed by a large number of identical components, and apply Boltzmann's ideas and the fundamental postulates of ordinary statistical physics. The thermodynamical parameters are determined by the properties of the thermalizing interaction. We apply these ideas to a simple example, in which the component system has one physical degree of freedom and mimics the constraint algebra of general relativity.
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- Title: ➤ Statistical Mechanics Of Generally Covariant Quantum Theories: A Boltzmann-like Approach
- Authors: Merced MontesinosCarlo Rovelli
- Language: English
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- Internet Archive ID: arxiv-gr-qc0002024
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32The Connection Between Statistical Mechanics And Quantum Field Theory
By Barry M. McCoy
A four part series of lectures on the connection of statistical mechanics and quantum field theory. The general principles relating statistical mechanics and the path integral formulation of quantum field theory are presented in the first lecture. These principles are then illustrated in lecture 2 by a presentation of the theory of the Ising model for $H=0$, where both the homogeneous and randomly inhomogeneous models are treated and the scaling theory and the relation with Fredholm determinants and Painlev{\'e} equations is presented. In lecture 3 we consider the Ising model with $H\neq 0$, where the relation with gauge theory is used to discuss the phenomenon of confinement. We conclude in the last lecture with a discussion of quantum spin diffusion in one dimensional chains and a presentation of the chiral Potts model which illustrates the physical effects that can occur when the Euclidean and Minkowski regions are not connected by an analytic continuation. (To be published as part of the Proceedings of the Sixth Annual Theoretical Physics Summer School of the Australian National University which was held in Canberra during Jan. 1994.)
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- Title: ➤ The Connection Between Statistical Mechanics And Quantum Field Theory
- Author: Barry M. McCoy
- Language: English
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33Quantum Mechanics As "space-time Statistical Mechanics"?
By Anders Månsson
In this paper we discuss and analyse the idea of trying to see (non-relativistic) quantum mechanics as a ``space-time statistical mechanics'', by using the classical statistical mechanical method on objective microscopic space-time configurations. It is argued that this could perhaps be accomplished by giving up the assumption that the objective ``state'' of a system is independent of a future measurement performed on the system. This idea is then applied in an example of quantum state estimation on a qubit system.
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- Author: Anders Månsson
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34Quantum Mechanics As An Asymptotic Projection Of Statistical Mechanics Of Classical Fields: Derivation Of Schrödinger's, Heisenberg's And Von Neumann's Equations
By Andrei Khrennikov
We show that QM can be represented as a natural projection of a classical statistical model on the phase space $\Omega= H\times H,$ where $H$ is the real Hilbert space. Statistical states are given by Gaussian measures on $\Omega$ having zero mean value and dispersion of very small magnitude $\alpha$ (which is considered as a small parameter of the model). Such statistical states can be interpreted as fluctuations of the background field, cf. with SED and Nelson's mechanics. Physical variables (e.g., energy) are given by maps $f: \Omega \to {\bf R}$ (functions of classical fields). The conventional quantum representation of our prequantum classical statistical model is constructed on the basis of the Taylor expansion (up to the terms of the second order at the vacuum field point $\psi\_{\rm{vacuum}}\equiv 0)$ of variables $f: \Omega \to {\bf R}$ with respect to the small parameter $\sqrt{\alpha}.$ The complex structure of QM is induced by the symplectic structure on the infinite-dimensional phase space $\Omega.$ A Gaussian measure (statistical state) is represented in QM by its covariation operator. Equations of Schr\"{o}dinger, Heisenberg and von Neumann are images of Hamiltonian dynamics on $\Omega.$ The main experimental prediction of our prequantum model is that experimental statistical averages can deviate from ones given by QM.
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- Title: ➤ Quantum Mechanics As An Asymptotic Projection Of Statistical Mechanics Of Classical Fields: Derivation Of Schrödinger's, Heisenberg's And Von Neumann's Equations
- Author: Andrei Khrennikov
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35Two-dimensional Quantum Field Models (with Applications To Statistical Mechanics)
We show that QM can be represented as a natural projection of a classical statistical model on the phase space $\Omega= H\times H,$ where $H$ is the real Hilbert space. Statistical states are given by Gaussian measures on $\Omega$ having zero mean value and dispersion of very small magnitude $\alpha$ (which is considered as a small parameter of the model). Such statistical states can be interpreted as fluctuations of the background field, cf. with SED and Nelson's mechanics. Physical variables (e.g., energy) are given by maps $f: \Omega \to {\bf R}$ (functions of classical fields). The conventional quantum representation of our prequantum classical statistical model is constructed on the basis of the Taylor expansion (up to the terms of the second order at the vacuum field point $\psi\_{\rm{vacuum}}\equiv 0)$ of variables $f: \Omega \to {\bf R}$ with respect to the small parameter $\sqrt{\alpha}.$ The complex structure of QM is induced by the symplectic structure on the infinite-dimensional phase space $\Omega.$ A Gaussian measure (statistical state) is represented in QM by its covariation operator. Equations of Schr\"{o}dinger, Heisenberg and von Neumann are images of Hamiltonian dynamics on $\Omega.$ The main experimental prediction of our prequantum model is that experimental statistical averages can deviate from ones given by QM.
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36Quantum Statistical Mechanics. II. Stochastic Schrodinger Equation
By Phil Attard
The stochastic dissipative Schrodinger equation is derived for an open quantum system consisting of a sub-system able to exchange energy with a thermal reservoir. The resultant evolution of the wave function also gives the evolution of the density matrix, which is an explicit, stochastic form of the Lindblad master equation. A quantum fluctuation-dissipation theorem is also derived. The time correlation function is discussed.
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- Author: Phil Attard
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- Subjects: Quantum Physics - Statistical Mechanics - Condensed Matter
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- Internet Archive ID: arxiv-1401.1787
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37Quantum Statistical Mechanics Of $\mathbb{Q}$-lattices And Noncommutative Geometry
By Vahid Shirbisheh
After recalling some basic notions of quantum statistical mechanics, we explain the Bost-Connes system that relates the structure of the maximal abelian extension of $\mathbb{Q}$ to the space of \kms states of a \cs-dynamical system. Afterwards, we study briefly the Connes-Marcolli $\text{GL}_2$-system as a generalization of the former system.
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- Author: Vahid Shirbisheh
- Language: English
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38Space Temperature Correlations In Quantum Statistical Mechanics
By Kunkin, William
78 p. 28 cm
“Space Temperature Correlations In Quantum Statistical Mechanics” Metadata:
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- Author: Kunkin, William
- Language: English
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39Specification Of Statistical Description In Quantum Mechanics
78 p. 28 cm
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- Language: Catalan
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40Digital Quantum Simulation Of The Statistical Mechanics Of A Frustrated Magnet
By Jingfu Zhang, Man-Hong Yung, Raymond Laflamme, Alán Aspuru-Guzik and Jonathan Baugh
Many interesting problems in physics, chemistry, and computer science are equivalent to problems of interacting spins. However, most of these problems require computational resources that are out of reach by classical computers. A promising solution to overcome this challenge is to exploit the laws of quantum mechanics to perform simulation. Several "analog" quantum simulations of interacting spin systems have been realized experimentally. However, relying on adiabatic techniques, these simulations are limited to preparing ground states only. Here we report the first experimental results on a "digital" quantum simulation on thermal states; we simulated a three-spin frustrated magnet, a building block of spin ice, with an NMR quantum information processor, and we are able to explore the phase diagram of the system at any simulated temperature and external field. These results serve as a guide for identifying the challenges for performing quantum simulation on physical systems at finite temperatures, and pave the way towards large scale experimental simulations of open quantum systems in condensed matter physics and chemistry.
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- Authors: Jingfu ZhangMan-Hong YungRaymond LaflammeAlán Aspuru-GuzikJonathan Baugh
- Language: English
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41Statistical Origin Of Quantum Mechanics
Many interesting problems in physics, chemistry, and computer science are equivalent to problems of interacting spins. However, most of these problems require computational resources that are out of reach by classical computers. A promising solution to overcome this challenge is to exploit the laws of quantum mechanics to perform simulation. Several "analog" quantum simulations of interacting spin systems have been realized experimentally. However, relying on adiabatic techniques, these simulations are limited to preparing ground states only. Here we report the first experimental results on a "digital" quantum simulation on thermal states; we simulated a three-spin frustrated magnet, a building block of spin ice, with an NMR quantum information processor, and we are able to explore the phase diagram of the system at any simulated temperature and external field. These results serve as a guide for identifying the challenges for performing quantum simulation on physical systems at finite temperatures, and pave the way towards large scale experimental simulations of open quantum systems in condensed matter physics and chemistry.
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42Entropic Functionals In Quantum Statistical Mechanics
By V. Jaksic and C. -A. Pillet
We describe quantum entropic functionals and outline a research program dealing with entropic fluctuations in non-equilibrium quantum statistical mechanics.
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- Authors: V. JaksicC. -A. Pillet
- Language: English
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43Quantum Statistical Mechanics
By Meijer, Paul Herman Ernst, 1921-
We describe quantum entropic functionals and outline a research program dealing with entropic fluctuations in non-equilibrium quantum statistical mechanics.
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- Author: ➤ Meijer, Paul Herman Ernst, 1921-
- Language: English
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44Statistical Mechanics Derived From Quantum Mechanics
By Yu-Lei Feng and Yi-Xin Chen
A pedagogical derivation of statistical mechanics from quantum mechanics is provided, by means of open quantum systems. Besides, a new definition of Boltzmann entropy for a quantum closed system is also given to count microstates in a way consistent with the superposition principle. In particular, this new Boltzmann entropy is a constant that depends only on the dimension of the system's relevant Hilbert subspace. Finally, thermodynamics for quantum systems is investigated formally.
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- Authors: Yu-Lei FengYi-Xin Chen
- Language: English
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- Subjects: Quantum Physics - High Energy Physics - Theory
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- Internet Archive ID: arxiv-1501.05402
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45Quantum Statistical Mechanics. IV. Non-Equilibrium Probability Operator And Stochastic, Dissipative Schrodinger Equation
By Phil Attard
The probability operator for a generic non-equilibrium quantum system is derived. The corresponding stochastic, dissipative Schr\"odinger equation is also given. The dissipative and stochastic propagators are linked by the fluctuation-dissipation theorem that is derived from the unitary condition on the time propagator. The dissipative propagator is derived from thermodynamic force and entropy fluctuation operators that are in general non-linear.
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- Title: ➤ Quantum Statistical Mechanics. IV. Non-Equilibrium Probability Operator And Stochastic, Dissipative Schrodinger Equation
- Author: Phil Attard
“Quantum Statistical Mechanics. IV. Non-Equilibrium Probability Operator And Stochastic, Dissipative Schrodinger Equation” Subjects and Themes:
- Subjects: Physics - Chemical Physics - Quantum Physics - Statistical Mechanics - Condensed Matter
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- Internet Archive ID: arxiv-1406.5270
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46The Casimir Problem Of Spherical Dielectrics: A Solution In Terms Of Quantum Statistical Mechanics
By J. S. H\oy e and I. Brevik
The Casimir energy for a compact dielectric sphere is considered in a novel way, using the quantum statistical method introduced by H\oye - Stell and others. Dilute media are assumed. It turns out that this method is a very powerful one: we are actually able to derive an expression for the Casimir energy that contains also the negative part resulting from the attractive van der Waals forces between the molecules. It is precisely this part of the Casimir energy that has turned out to be so difficult to extract from the formalism when using the conventional field theoretical methods for a continuous medium. Assuming a frequency cutoff, our results are in agreement with those recently obtained by Barton [J. Phys. A: Math. Gen. 32(1999)525].
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- Title: ➤ The Casimir Problem Of Spherical Dielectrics: A Solution In Terms Of Quantum Statistical Mechanics
- Authors: J. S. H\oy eI. Brevik
- Language: English
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- Internet Archive ID: arxiv-quant-ph9903086
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47Quantum Chaos, Random Matrix Theory, And Statistical Mechanics In Two Dimensions - A Unified Approach
By Sudhir R. Jain and Daniel Alonso
We present a theory where the statistical mechanics for dilute ideal gases can be derived from random matrix approach. We show the connection of this approach with Srednicki approach which connects Berry conjecture with statistical mechanics. We further establish a link between Berry conjecture and random matrix theory, thus providing a unified edifice for quantum chaos, random matrix theory, and statistical mechanics. In the course of arguing for these connections, we observe sum rules associated with the outstanding counting problem in the theory of braid groups. We are able to show that the presented approach leads to the second law of thermodynamics.
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- Title: ➤ Quantum Chaos, Random Matrix Theory, And Statistical Mechanics In Two Dimensions - A Unified Approach
- Authors: Sudhir R. JainDaniel Alonso
- Language: English
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- Internet Archive ID: arxiv-chao-dyn9609013
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48Statistical Mechanics Of Confined Quantum Particles
By Vishnu M. Bannur and K. M. Udayanandan
We develop statistical mechanics and thermodynamics of Bose and Fermi systems in relativistic harmonic oscillator (RHO) confining potential, which may be applicable in quark gluon plasma (QGP), astrophysics, Bose-Einstein condensation (BEC), condensed matter physics etc. Detailed study of QGP system is carried out and compared with lattice results. Further, as an application, our equation of state (EoS) of QGP is used to study compact stars like quark star.
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- Title: ➤ Statistical Mechanics Of Confined Quantum Particles
- Authors: Vishnu M. BannurK. M. Udayanandan
- Language: English
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- Internet Archive ID: arxiv-hep-ph0602017
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49On The Approximation Of Feynman-Kac Path Integrals For Quantum Statistical Mechanics
By Stephen D. Bond, Brian B. Laird and Benedict J. Leimkuhler
Discretizations of the Feynman-Kac path integral representation of the quantum mechanical density matrix are investigated. Each infinite-dimensional path integral is approximated by a Riemann integral over a finite-dimensional function space, by restricting the integration to a subspace of all admissible paths. Using this process, a wide class of methods can be derived, with each method corresponding to a different choice for the approximating subspace. The traditional ``short-time'' approximation and ``Fourier discretization'' can be recovered from this approach, using linear and spectral basis functions respectively. As an illustration, a novel method is formulated using cubic elements and is shown to have improved convergence properties when applied to a simple model problem.
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- Title: ➤ On The Approximation Of Feynman-Kac Path Integrals For Quantum Statistical Mechanics
- Authors: Stephen D. BondBrian B. LairdBenedict J. Leimkuhler
- Language: English
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- Internet Archive ID: arxiv-cond-mat0007112
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50Statistical Approach To Quantum Mechanics II: Nonrelativistic Spin
By G. H. Goedecke
In this second paper in a series, we show that the the general statistical approach to nonrelativistic quantum mechanics developed in the first paper yields a representation of quantum spin and magnetic moments based on classical nonrelativistic spinning top models, using Euler angle coordinates. The models allow half-odd-integer spin and predict supraluminal speeds only for electrons and other leptons, which must be treated relativistically. The spin operators in the space-fixed frame satisfy the usual commutation rules, while those in the rotating body-fixed frame satisfy "left-handed" rules. The commutation rules are independent of the structure of the top, so all nonrelativistic rigidly rotating objects must have integer or odd-half-integer spin. Physical boundary conditions restrict all mixed spin states to involve only half-odd-integer or only integer spin eigenstates. For spin 1/2, the theory automatically yields a modified Pauli-Schr\"odinger equation. The Hamiltonian operator in this equation contains a rigid rotator term and a term involving the square of the magmetic field, as well as an interaction term having the usual form in spherically symmetric and some cylindrically symmetric models, valid for any magnetogyric ratio.
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- Title: ➤ Statistical Approach To Quantum Mechanics II: Nonrelativistic Spin
- Author: G. H. Goedecke
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- Internet Archive ID: arxiv-1408.1721
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