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A novel approach designed to directly estimate microcanonical quantities from energy histograms is proposed, which enables the immediate systematic identification and classification of phase transitions in physical systems of any size by…

统计力学 · 物理学 2025-09-25 Michael Bachmann

When studying the thermodynamic properties of mesoscopic systems the most appropriate microcanonical entropy is the volume entropy, i.e. the logarithm of the volume of phase space enclosed by the hypersurface of constant energy. For systems…

统计力学 · 物理学 2007-09-10 Michele Campisi

By combining different ideas, a general and efficient protocol to deal with discontinuous phase transitions at low temperatures is proposed. For small $T$'s, it is possible to derive a generic analytic expression for appropriate order…

统计力学 · 物理学 2015-06-03 C. E. Fiore , M. G. E. da Luz

Microcanonical thermodynamics (MCTh) is contrasted to canonical thermodynamics (CTh). At phase transitions of 1.order the two ensembles are NOT equivalent even in the thermodynamic limit . Energy fluctuations do not vanish and phase…

统计力学 · 物理学 2007-05-23 D. H. E. Gross

We compare phase transition(-like) phenomena in small model systems for both microcanonical and canonical ensembles. The model systems correspond to a few classical (non-quantum) point particles confined in a one-dimensional box and…

统计力学 · 物理学 2007-05-23 Jörn Dunkel , Stefan Hilbert

Conventional thermo-statistics address infinite homogeneous systems within the canonical ensemble. However, some 150 years ago the original motivation of thermodynamics was the description of steam engines, i.e. boiling water. Its essential…

统计力学 · 物理学 2009-11-10 D. H. E. Gross

Within the micro-canonical ensemble phase transitions of first order can be identified without invoking the thermodynamic limit. We show for the liquid-gas transition of sodium, potassium, and iron at normal pressure that the transition…

凝聚态物理 · 物理学 2008-02-03 D. H. E. Gross , M. E. Madjet

The thermodynamic behaviour of self-gravitating $N$-body systems has been worked out by borrowing a standard method from Molecular Dynamics: the time averages of suitable quantities are numerically computed along the dynamical trajectories…

天体物理学 · 物理学 2009-11-06 Monica Cerruti-Sola , Piero Cipriani , Marco Pettini

Phase transitions are one of the most interesting natural phenomena. For finite systems, one of the concerns in the topic is how to classify a specific transition as being of first, second, or even of a higher order, according to the…

统计力学 · 物理学 2024-10-18 J. C. S. Rocha , B. V. Costa

We present a detailed account of a first-order localization transition in the Discrete Nonlinear Schr\"odinger Equation, where the localized phase is associated to the high energy region in parameter space. We show that, due to ensemble…

统计力学 · 物理学 2021-02-08 Giacomo Gradenigo , Stefano Iubini , Roberto Livi , Satya N. Majumdar

Equilibrium statistics of finite Hamiltonian systems is fundamentally described by the microcanonical ensemble (ME). Canonical, or grand-canonical partition functions are deduced from this by Laplace transform. Only in the thermodynamic…

核理论 · 物理学 2008-11-26 D. H. E. Gross

A framework is presented for carrying out simulations of equilibrium systems in the microcanonical ensemble using annealing in an energy ceiling. The framework encompasses an equilibrium version of simulated annealing, population annealing…

统计力学 · 物理学 2019-12-18 Nathan Rose , Jonathan Machta

In contrast to the canonical ensemble where thermodynamic functions are smooth for all finite system sizes, the microcanonical entropy can show nonanalytic points also for finite systems, even if the Hamiltonian is smooth. The relation…

统计力学 · 物理学 2007-05-23 Lapo Casetti , Michael Kastner

The thermodynamic entropy of coarse-grained (CG) models stands as one of the most important properties for quantifying the missing information during the CG process and for establishing transferable (or extendible) CG interactions. However,…

化学物理 · 物理学 2024-04-10 Jaehyeok Jin , David R. Reichman

Boltzmann's microcanonical entropy is the link between statistical physics and thermodynamics, forasmuch as the behavior of any thermodynamic quantity is directly related to the number of microscopic configurations. Accordingly, in this…

统计力学 · 物理学 2022-11-24 L. S. Ferreira , L. N. Jorge , C. J. DaSilva , A. A. Caparica

The importance-sampling Monte Carlo algorithm appears to be the universally optimal solution to the problem of sampling the state space of statistical mechanical systems according to the relative importance of configurations for the…

统计力学 · 物理学 2010-06-22 Martin Weigel

Microcanonical thermodynamics (MT) is analysed for phase transitions of first and second order in finite systems. The transiton temperature, the latent heat and the surface tension of first order transitions can easily be determined by MT…

核理论 · 物理学 2007-05-23 D. H. E. Gross

Using numerical and analytical methods implemented for different models we conduct a systematic study of thermodynamic properties of pairing correlation in mesoscopic nuclear systems. Various quantities are calculated and analyzed using the…

核理论 · 物理学 2008-11-26 Tony Sumaryada , Alexander Volya

Two examples of Microcanonical Potts models, 2-dimensional nearest neighbor and mean field, are considered via exact enumeration of states and analytical asymptotic methods. In the interval of energies corresponding to a first order phase…

统计力学 · 物理学 2009-11-07 I. Ispolatov , E. G. D. Cohen

Using Monte Carlo histogram methods, the microcanonical caloric curve is computed for the Ising model in two and three dimensions with fixed magnetization. Whereas the signatures of a first order phase transition are clearly visible for…

凝聚态物理 · 物理学 2015-06-24 Michel Pleimling , Alfred Hueller