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We extend the recently introduced phaseless auxiliary-field quantum Monte Carlo (QMC) approach to any single-particle basis, and apply it to molecular systems with Gaussian basis sets. QMC methods in general scale favorably with system…

Computational Physics · Physics 2007-05-23 W. A. Al-Saidi , Shiwei Zhang , Henry Krakauer

We exploit a prescription to observe directly the physical properties of the thermodynamic limit under continuously applied field in one-dimensional quantum finite lattice systems. By systematically scaling down the energy of the…

Strongly Correlated Electrons · Physics 2015-06-16 Chisa Hotta , Naokazu Shibata

It is shown that for quantum ensembles consisting of equal particles, the collective micro-causality does not contradict the quantum theory. The amplitudes of the states of such an ensemble can be divided into small portions, for each of…

General Physics · Physics 2018-05-10 Yuri I. Ozhigov

The problem of sampling outputs of quantum circuits has been proposed as a candidate for demonstrating a quantum computational advantage (sometimes referred to as quantum "supremacy"). In this work, we investigate whether quantum advantage…

Quantum Physics · Physics 2021-06-09 Leonardo Novo , Juani Bermejo-Vega , Raúl García-Patrón

We develop a method using a coarse graining of the energy fluctuations of an equilibrium quantum system which produces simple parameterizations for the behaviour of the system. As an application, we use these methods to gain more…

Statistical Mechanics · Physics 2007-05-23 Jani Lukkarinen

We derive a lattice approximation for a class of equilibrium quantum statistics describing the behaviour of any combination and number of bosonic and fermionic particles with any sufficiently binding potential. We then develop an intuitive…

Statistical Mechanics · Physics 2008-11-26 Jani Lukkarinen

I present a theoretical model of a quantum statistical ensemble for which, unlike in conventional physics, the total number of particles is extremely small. The thermodynamical quantities are calculated by taking a small $N$ by virtue of…

Quantum Physics · Physics 2010-01-15 Enrico Prati

It is common knowledge that the microcanonical, canonical, and grand-canonical ensembles are equivalent in thermodynamically large systems. Here, we study finite-size effects in the latter two ensembles. We show that contrary to naive…

Statistical Mechanics · Physics 2017-09-04 Deepak Iyer , Mark Srednicki , Marcos Rigol

Measurement-based quantum computation (MBQC) is a framework for quantum information processing in which a computational task is carried out through one-qubit measurements on a highly entangled resource state. Due to the indeterminacy of the…

Quantum Physics · Physics 2026-04-14 Arunava Majumder , Hendrik Poulsen Nautrup , Hans J. Briegel

Quantum systems are invariably open, evolving under surrounding influences rather than in isolation. Standard open quantum system methods eliminate all information on the environmental state to yield a tractable description of the system…

Quantum Physics · Physics 2014-09-26 Jake Iles-Smith , Neill Lambert , Ahsan Nazir

In this didactical note I review in depth the rationale for using generalised canonical distributions in quantum statistics. Particular attention is paid to the proper definitions of quantum entropy and quantum relative entropy, as well as…

Quantum Physics · Physics 2008-06-03 Jochen Rau

We consider a system weakly interacting with a bath as a thermodynamic setting to establish a quantum foundation of statistical physics. It is shown that even if the composite system is initially in an arbitrary nonequilibrium pure quantum…

Quantum Physics · Physics 2010-04-28 Jaeyoon Cho , M. S. Kim

Using trial wavefunctions prepared on quantum devices to reduce the bias of auxiliary-field quantum Monte Carlo (QC-AFQMC) has established itself as a promising hybrid approach to the simulation of strongly correlated many body systems.…

Quantum Physics · Physics 2024-09-16 Matthew Kiser , Matthias Beuerle , Fedor Simkovic

In this paper we introduce a simple procedure for computing the macroscopic quantum behaviour of periodic quantum systems in the high energy regime. The macroscopic quantum coherence is ascribed to a one-particle state, not to a condensate…

Quantum Physics · Physics 2015-06-17 A. Martín-Ruiz , J. Bernal , Adrián Carbajal-Domínguez

We introduce a nonequilibrium grand-canonical ensemble defined by considering the stationary state of a driven system of particles put in contact with a nonequilibrium particle reservoir. At odds with its equilibrium counterpart, or with…

Statistical Mechanics · Physics 2021-02-10 Jules Guioth , Éric Bertin

The particle number and energy fluctuations in the system of charged particles are studied in the canonical ensemble for non-zero net values of the conserved charge. In the thermodynamic limit the fluctuations in the canonical ensemble are…

Nuclear Theory · Physics 2011-07-19 V. V. Begun , M. I. Gorenstein , O. S. Zozulya

We illustrate a novel characterization of nonequivalent statistical mechanical ensembles using the mean-field Blume-Emery-Griffiths (BEG) model as a test model. The novel characterization takes effect at the level of the microcanonical and…

Statistical Mechanics · Physics 2007-05-23 Richard S. Ellis , Hugo Touchette , Bruce Turkington

A heuristic generalization of the Boltzmann-Gibbs microcanonical entropy is proposed, able to describe meta-equilibrium features and evolution of macroscopic systems. Despite its simple-minded derivation, such a function of "collective…

Statistical Mechanics · Physics 2007-05-23 Piero Cipriani

Finite temperature auxiliary field-based Quantum Monte Carlo methods, including Determinant Quantum Monte Carlo (DQMC) and Auxiliary Field Quantum Monte Carlo (AFQMC), have historically assumed pivotal roles in the investigation of the…

Quantum Physics · Physics 2021-02-03 Tong Shen , Yuan Liu , Yang Yu , Brenda Rubenstein

An intricate quantum statistical effect guides us to a deterministic, non-causal quantum universe with given fixed initial and final state density matrix. A concept is developed on how and where something like macroscopic physics can…

Quantum Physics · Physics 2021-02-23 Fritz W. Bopp
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