Entropy Multiparticle Correlation Expansion for a Crystal
Statistical Mechanics
2021-03-18 v1
Abstract
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 given order. By revisiting the combinatorial derivation of the entropy formula, we argue that a similar correlation expansion holds for the entropy of a crystalline system. We discuss how one- and two-body entropies scale with the size of the crystal, and provide fresh numerical data to check the expectation, grounded on theoretical arguments, that both entropies are extensive quantities.
Keywords
Cite
@article{arxiv.2103.09580,
title = {Entropy Multiparticle Correlation Expansion for a Crystal},
author = {Santi Prestipino and Paolo V. Giaquinta},
journal= {arXiv preprint arXiv:2103.09580},
year = {2021}
}
Comments
31 pages, 3 figures