Constant-pressure equations of motion
Physical review. A, General physicsPublished 1 September 1986
William G. Hoover
Citations1,000
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TL;DR
Some of the differences among several alternative formulations of constant-pressure molecular dynamics are described, which all agree in the large-system limit, but differ for small systems.
Abstract
Some of the differences among several alternative formulations of constant-pressure molecular dynamics are described. The formulations all agree in the large-system limit, but differ for small systems.
Keywords
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