Simultaneous application of the gradient theory and Monte Carlo molecular simulation for the investigation of methane/water interfacial properties

Journal of Physical Chemistry B

Volumn 115, Issue 31, 2011, Pages 9618-9625

  Miqueu, Christelle ^a   Míguez, José M ^b   Piñeiro, Manuel M ^b   Lafitte, Thomas ^a   Mendiboure, Bruno ^a  

^a UNIVERSITÉ DE PAU ET DES PAYS DE L'ADOUR   (France)

^b UNIVERSITY OF VIGO   (Spain)

Author keywords

[No Author keywords available]

Indexed keywords

ADSORPTION; EQUATIONS OF STATE; FLUIDITY; INVESTMENTS; MOLECULAR STRUCTURE; MONTE CARLO METHODS;

BIPHASIC; CONSTANT PRESSURES; DENSITY PROFILE; EQUATION OF STATE; FLUID INTERFACE; GRADIENT THEORY; HIGH PRESSURE; INTERFACIAL BEHAVIORS; INTERFACIAL PROPERTY; INTERFACIAL THICKNESS; MC SIMULATION; MICROSCOPIC PROPERTIES; MOLECULAR MODELS; MOLECULAR SIMULATIONS; MONTE CARLO; MONTE CARLO SIMULATION; PREWETTING TRANSITIONS; SATURATION CONDITIONS; SIMULATION BOXES; THERMODYNAMIC CONDITIONS; UNITED ATOMS;

COMPUTER SIMULATION;

EID: 79961216895     PISSN: 15206106     EISSN: 15205207     Source Type: Journal    
DOI: 10.1021/jp202276k     Document Type: Article

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