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We investigated the nematic to smectic transition undergone by parallel hard spherocylinders in the framework provided by the residual multi-particle entropy (RMPE) formalism. The RMPE is defined as the sum of all contributions to the…

Soft Condensed Matter · Physics 2011-10-26 D. Costa , F. Saija , P. V. Giaquinta

Hard spherocylinders (cylinders of length $L$ and diameter $D$ capped at both ends with two hemispheres) provide a suitable model for investigating entropy-driven, mesophase formations in real colloidal fluids that are composed of rigid…

Statistical Mechanics · Physics 2011-10-26 D. Costa , F. Micali , F. Saija , P. V. Giaquinta

In this paper we establish a connection between the onset temperature of glassy dynamics with the change in the entropy for a wide range of model systems. We identify the crossing temperature of pair and excess entropies as the onset…

Soft Condensed Matter · Physics 2017-08-02 Atreyee Banerjee , Manoj Kumar Nandi , Srikanth Sastry , Sarika Maitra Bhattacharyya

The excess entropy, Se, defined as the difference between the entropies of the liquid and the ideal gas under identical density and temperature conditions, is shown to be the critical quantity connecting the structural, diffusional and…

Soft Condensed Matter · Physics 2009-11-11 Ruchi Sharma , Somendra Nath Chakraborty , Charusita Chakravarty

Diffusion-a measure of dynamics, and entropy-a measure of disorder in the system, are found to be intimately correlated in many systems, and the correlation is often strongly non-linear. We explore the origin of this complex dependence by…

Soft Condensed Matter · Physics 2015-12-09 Kazuhiko Seki , Biman Bagchi

As first shown by H. S. Green in 1952, the entropy of a classical fluid of identical particles can be written as a sum of many-particle contributions, each of them being a distinctive functional of all spatial distribution functions up to a…

Statistical Mechanics · Physics 2021-03-18 Santi Prestipino , Paolo V. Giaquinta

This work investigates the link between residual entropy and viscosity based on wide-ranging, highly accurate experimental and simulation data. This link was originally postulated by Rosenfeld in 1977, and it is shown that this scaling…

Chemical Physics · Physics 2022-06-08 Ian H. Bell

We describe an approach to improving model fitting and model generalization that considers the entropy of distributions of modelling residuals. We use simple simulations to demonstrate the observational signatures of overfitting on ordered…

Methodology · Statistics 2019-08-05 Barnaby Rowe

A recently explored interesting quantity in AdS/CFT, dubbed 'residual entropy', characterizes the amount of collective ignorance associated with either boundary observers restricted to finite time duration, or bulk observers who lack access…

High Energy Physics - Theory · Physics 2015-06-22 Veronika E. Hubeny

It is shown that the residual entropy (entropy minus that of the ideal gas at the same temperature and density) is mostly synonymous with the independent variable of density scaling, identifying a direct link between these two approaches.…

Chemical Physics · Physics 2024-06-19 Ian Bell , Robin Fingerhut , Jadran Vrabec , Lorenzo Costigliola

Anomalous behaviour of the excess entropy ($S_e$) and the associated scaling relationship with diffusivity are compared in liquids with very different underlying interactions but similar water-like anomalies: water (SPC/E and TIP3P models),…

Soft Condensed Matter · Physics 2010-05-04 Manish Agarwal , Murari Singh , Ruchi Sharma , Mohammad Parvez Alam , Charusita Chakravarty

The length-scale dependence of the dynamic entropy is studied in a molecular dynamics simulation of a binary Lennard-Jones liquid above the mode-coupling critical temperature $T_c$. A number of methods exist for estimating the entropy of…

Soft Condensed Matter · Physics 2009-10-31 Paolo Allegrini , Jack F. Douglas , Sharon C. Glotzer

A model-independent lower bound on the entropy S of the multiparticle system produced in high energy collisions, provided by the Renyi entropy H_2, is shown to be very effective. Estimates show that the ratio H_2/S remains close to one half…

High Energy Physics - Phenomenology · Physics 2009-01-07 A. Bialas , W. Czyz , K. Zalewski

Molecular dynamics simulations of water, liquid beryllium fluoride and silica melt are used to study the accuracy with which the entropy of ionic and molecular liquids can be estimated from atom-atom radial distribution function data. All…

Soft Condensed Matter · Physics 2009-11-13 Ruchi Sharma , Manish Agarwal , Charusita Chakravarty

Entropically driven fluid-solid transitions in monodisperse, purely repulsive hard spheres (MPRHS) are well established in theory, simulation, and experiment for atomic and colloidal systems. For MPRHS, however, coexistence is usually…

Soft Condensed Matter · Physics 2025-12-22 J. Galen Wang , Umesh Dhumal , Monica E. A. Zakhari , Roseanna N. Zia

We derive the multiparticle-correlation expansion of the excess entropy of classical particles in the canonical ensemble using a new approach that elucidates the rationale behind each term in the expansion. This formula provides the…

Statistical Mechanics · Physics 2011-10-25 S. Prestipino , P. V. Giaquinta

Liquid-state theory, computer simulation, and numerical optimization are used to investigate the extent to which positional correlations of a hard-sphere fluid--as characterized by the radial distribution function and the two-particle…

Soft Condensed Matter · Physics 2016-03-23 Ryan B. Jadrich , Beth A. Lindquist , Jonathan A. Bollinger , Thomas M. Truskett

A unified formulation of the density functional theory is constructed on the foundations of entropic inference in both the classical and the quantum regimes. The theory is introduced as an application of entropic inference for inhomogeneous…

Statistical Mechanics · Physics 2021-12-20 Ahmad Yousefi

Run-and-tumble particles (RTPs) have emerged as a paradigmatic example for studying nonequilibrium phenomena in statistical mechanics. The invariant measure of a wide class of RTPs subjected to a potential possesses a density that is…

Statistical Mechanics · Physics 2025-11-24 Leo Hahn

Through the consideration of spherically symmetric gravitating systems consisting of perfect fluids with linear equation of state constrained to be in a finite volume, an account is given of the properties of entropy at conditions in which…

General Relativity and Quantum Cosmology · Physics 2008-11-26 Alessandro Pesci
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