Modified nonequilibrium molecular dynamics for fluid flows with energy conservation

The nonequilibrium molecular dynamics generated by the SLLOD algorithm [so called due to its association with the DOLLS tensor algorithm (D. J. Evans and G. P. Morriss, Statistical Mechanics of Nonequilibrium Liquids (Academic, New York, 1990)] for fluid flow is considered. It is shown that, in the...

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Veröffentlicht in:The Journal of chemical physics 1997-04, Vol.106 (13), p.5615-5621
Hauptverfasser: Tuckerman, Mark E., Mundy, Christopher J., Balasubramanian, Sundaram, Klein, Michael L.
Format: Artikel
Sprache:eng
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