Fluctuations in a small hard-disk system: Implicit finite size effects

Citation
Fl. Roman et al., Fluctuations in a small hard-disk system: Implicit finite size effects, J CHEM PHYS, 110(20), 1999, pp. 9821-9824
Citations number
17
Categorie Soggetti
Physical Chemistry/Chemical Physics
Journal title
JOURNAL OF CHEMICAL PHYSICS
ISSN journal
00219606 → ACNP
Volume
110
Issue
20
Year of publication
1999
Pages
9821 - 9824
Database
ISI
SICI code
0021-9606(19990522)110:20<9821:FIASHS>2.0.ZU;2-A
Abstract
The influence of implicit finite size effects on the fluctuation in the num ber of particles in a subvolume is studied for a small system of hard disks with a fixed number of particles. The implicit (or anomalous) finite size effects-that arise from the use of periodic boundary conditions-are taken i nto account by including the periodicity of the total system into a model p air correlation function. Two pair correlation functions are considered; th e accurate Percus-Yevick result and an approximation proposed by Baus and C olot that yields an excellent isothermal compressibility. Although very goo d agreement with canonical ensemble Monte Carlo results is obtained in both cases, it appears that the theoretical expression obtained for the fluctua tion in the number of particles is rather sensitive to the thermodynamic an d structural information conveyed by the pair correlation function. (C) 199 9 American Institute of Physics. [S0021-9606(99)50720-4].