Prediction of critical properties for Naphthacene, Triphenylene and Chrysene by Wang-Landau simulations

Fluid Phase Equilibria

Volumn 322-323, Issue , 2012, Pages 92-96

  Desgranges, C ^a   Ngale, K Ndumbe ^a   Delhommelle, J ^a  

^a UNIVERSITY OF NORTH DAKOTA   (United States)

Author keywords

Critical properties; Hybrid Monte Carlo simulations; Polycyclic aromatic hydrocarbons; Vapor liquid equilibria; Wang Landau sampling

Indexed keywords

ATMOSPHERIC POLLUTANTS; CHRYSENE; CRITICAL POINTS; CRITICAL PROPERTIES; EXPERIMENTAL DATA; FUSED RING; HYBRID MONTE CARLO; ISOBARIC-ISOTHERMAL ENSEMBLE; NAPHTHACENE; POLYCYCLIC AROMATIC HYDROCARBONS(PAHS); TRIPHENYLENES; VAPOR-LIQUID EQUILIBRIUM; WANG-LANDAU SAMPLING;

MONTE CARLO METHODS; POLYCYCLIC AROMATIC HYDROCARBONS;

VAPORS;

EID: 84859968961     PISSN: 03783812     EISSN: None     Source Type: Journal    
DOI: 10.1016/j.fluid.2012.03.012     Document Type: Article

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