Chemical potential perturbation: A method to predict chemical potentials in periodic molecular simulations

Journal of Chemical Physics

Volumn 134, Issue 11, 2011, Pages

  Moore, Stan G ^a   Wheeler, Dean R ^a  

^a Brigham Young University   (United States)

Author keywords

[No Author keywords available]

Indexed keywords

DENSE FLUID; DENSITY GRADIENT THEORIES; EQUATION OF STATE; EXTERNAL FORCE FIELD; FREE ENERGY DENSITY; HELMHOLTZ FREE ENERGY; INHOMOGENEITIES; LENNARD JONES FLUID; LOCAL PRESSURE TENSORS; MOLECULAR SIMULATIONS; REFERENCE STATE; SPINODALS; SUPERCRITICAL CONDITION; TWO PHASE FLUID; VAN DER WAALS;

CHEMICAL POTENTIAL; CHEMICALS; EQUATIONS OF STATE; FLUIDS; FREE ENERGY; MOLECULAR STRUCTURE; SURFACE TENSION; VAN DER WAALS FORCES;

PERTURBATION TECHNIQUES;

EID: 79953210075     PISSN: 00219606     EISSN: None     Source Type: Journal    
DOI: 10.1063/1.3561865     Document Type: Article

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