Back to Search Start Over

Calculation of interfacial tension from density of states.

Authors :
Jain, Tushar S.
de Pablo, Juan J.
Source :
Journal of Chemical Physics; 3/1/2003, Vol. 118 Issue 9, p4226, 4p, 5 Graphs
Publication Year :
2003

Abstract

A density of states Monte Carlo formalism is used to calculate the interfacial tension of a simple fluid (3D Ising model) and of free-standing polymer films on a lattice. Good agreement is found between the results of these calculations and literature values. The proposed approach is efficient and provides the surface tension over a wide range of temperature from a single simulation. It has the additional advantage of being equally applicable to systems interacting through continuous potential energy functions, discontinuous functions, and systems on a lattice. © 2003 American Institute of Physics. [ABSTRACT FROM AUTHOR]

Subjects

Subjects :
POLYMERS
MONTE Carlo method

Details

Language :
English
ISSN :
00219606
Volume :
118
Issue :
9
Database :
Complementary Index
Journal :
Journal of Chemical Physics
Publication Type :
Academic Journal
Accession number :
9095988
Full Text :
https://doi.org/10.1063/1.1540613