Abstract
Abstract
Molecular dynamics (MD) methods suitable for treating anisotropic fluctuations in condensed matter are discussed. Barostats with two anisotropic factors to control the simulation cell dynamics are introduced in three MD simulation methods; constant pressure, constant surface tension, and canonical hydrostatic. To demonstrate the possibilities of these methods, calculations of two systems, one consisting of anisotropic particles and other consisting of isotropic particles, are presented.
Subject
General Physics and Astronomy
Cited by
4 articles.
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