Molecular dynamics in the isothermal-isobaric ensemble: The requirement of a "shell" molecule. II. Simulation results

Journal of Chemical Physics

Volumn 123, Issue 16, 2005, Pages

  Uline, Mark J ^a   Corti, David S ^a  

^a PURDUE UNIVERSITY   (United States)

Author keywords

[No Author keywords available]

Indexed keywords

INTERNAL PRESSURE; MULTICOMPONENT SYSTEMS; PERIODIC BOUNDARY CONDITIONS; TIME SCALES;

ALGORITHMS; BOUNDARY CONDITIONS; COMPUTER SIMULATION; EQUATIONS OF MOTION; ISOTHERMS; MONTE CARLO METHODS; PRESSURE EFFECTS; THERMAL EFFECTS;

MOLECULAR DYNAMICS;

EID: 27344434153     PISSN: 00219606     EISSN: None     Source Type: Journal    
DOI: 10.1063/1.2064547     Document Type: Article

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