Molecular dynamics simulation in the grand canonical ensemble

Journal of Computational Chemistry

Volumn 28, Issue 10, 2007, Pages 1763-1773

  Eslami, Hossein ^a,b   Müller Plathe, Florian ^a  

^a DARMSTADT UNIVERSITY OF TECHNOLOGY   (Germany)

^b PERSIAN GULF UNIVERSITY   (Iran)

Author keywords

Chemical potential; Grand canonical ensemble; Molecular dynamics simulation

Indexed keywords

CHEMICAL POTENTIAL; EQUATIONS OF MOTION; HAMILTONIANS; KINETIC ENERGY; MOLECULAR MODELING; POTENTIAL ENERGY;

GRAND CANONICAL ENSEMBLE; LENNARD-JONES FLUIDS; MOLECULAR DYNAMICS SIMULATION;

MOLECULAR DYNAMICS;

EID: 34547317048     PISSN: 01928651     EISSN: 1096987X     Source Type: Journal    
DOI: 10.1002/jcc.20689     Document Type: Article

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