Calculation of the surface tension of cyclic and aromatic hydrocarbons from Monte Carlo simulations using an anisotropic united atom model (AUA)

Physical Chemistry Chemical Physics

Volumn 11, Issue 29, 2009, Pages 6132-6147

  Biscay, F ^a,b   Ghoufi, A ^b,c   Lachet, V ^b   Malfreyt, P ^a  

^a UNIVERSITÉ CLERMONT AUVERGNE   (France)

^b IFP ENERGIES NOUVELLES   (France)

^c UNIVERSITÉ DE RENNES 1   (France)

Author keywords

[No Author keywords available]

Indexed keywords

BENZENE; CYCLOHEXANE; CYCLOHEXANE DERIVATIVE; CYCLOPENTANE DERIVATIVE; HYDROCARBON; TOLUENE;

ARTICLE; CHEMICAL MODEL; CHEMICAL STRUCTURE; CHEMISTRY; COMPUTER SIMULATION; CONFORMATION; MONTE CARLO METHOD; SURFACE TENSION;

BENZENE; COMPUTER SIMULATION; CYCLOHEXANES; CYCLOPENTANES; HYDROCARBONS, CYCLIC; MODELS, CHEMICAL; MODELS, MOLECULAR; MOLECULAR CONFORMATION; MONTE CARLO METHOD; SURFACE TENSION; TOLUENE;

EID: 70349252251     PISSN: 14639076     EISSN: None     Source Type: Journal    
DOI: 10.1039/b823295d     Document Type: Article

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