New force fields for nitrous oxide and oxygen and their application to phase equilibria simulations

Fluid Phase Equilibria

Volumn 259, Issue 2, 2007, Pages 180-188

  Hansen, Niels ^a   Agbor, Felix A B ^a   Keil, Frerich J ^a  

^a HAMBURG UNIVERSITY OF TECHNOLOGY   (Germany)

Author keywords

Molecular simulation; Nitrous oxide; Oxygen; Point charge model; Vapor liquid equilibria

Indexed keywords

BINARY MIXTURES; COMPUTER SIMULATION; OXYGEN; PARAMETERIZATION;

FORCE FIELDS; NITROUS OXIDE; POINT-CHARGE MODEL; TERNARY MIXTURE;

PHASE EQUILIBRIA;

BINARY MIXTURES; COMPUTER SIMULATION; OXYGEN; PARAMETERIZATION; PHASE EQUILIBRIA;

EID: 34548029736     PISSN: 03783812     EISSN: None     Source Type: Journal    
DOI: 10.1016/j.fluid.2007.07.014     Document Type: Article

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