Periodic molecular dynamics with many-body potential under external stress

Details Periodic molecular dynamics with many-body potential under external stress Periodic molecular dynamics with many-body potential under external stress

2005-05-10

arxiv.org/abs/cond-mat/0505251v1

Physics

Condensed Matter

Materials Science

6 pages, 0 figure

Scientific paper

The dynamical equations for periodic systems under constant external stress
(cond-mat/0209372) have been extended to many-body potential case. Rather than
introducing Lagrangian dynamics, Newtonian dynamics was employed directly. The
kinetic energy term of stress and the imagined force only due to particles'
passing through geometric planes or boundaries were also discussed.

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