Predicting fluid phase equilibrium via histogram reweighting with Gibbs ensemble Monte Carlo simulations

Journal of Supercritical Fluids

Volumn 55, Issue 2, 2010, Pages 503-509

  Boulougouris, Georgios C ^a,b   Peristeras, Loukas D ^c   Economou, Ioannis G ^a,d   Theodorou, Doros N ^e  

^a INSTITUTE OF NANOSCIENCE AND NANOTECHNOLOGY   (Greece)

^b UNIVERSITY OF PATRAS   (Greece)

^c Scienomics GmbH   (France)

^d KHALIFA UNIVERSITY   (United Arab Emirates)

^e NATIONAL TECHNICAL UNIVERSITY OF ATHENS   (Greece)

Author keywords

CO2; Gibbs ensemble; Mote Carlo; Phase equilibria; Statistical mechanics multiple histogram

Indexed keywords

CO2; CRITICAL POINTS; FLUID-PHASE EQUILIBRIUM; GIBBS ENSEMBLE; GIBBS ENSEMBLE MONTE CARLO SIMULATIONS; HISTOGRAM METHOD; MOLECULAR SIMULATIONS; MOTE CARLO; PHYSICAL REVIEW;

COMPUTER SIMULATION; FLUIDS; FORECASTING; GIBBS FREE ENERGY; GRAPHIC METHODS; MONTE CARLO METHODS; STATISTICAL MECHANICS;

PHASE EQUILIBRIA;

EID: 78649766258     PISSN: 08968446     EISSN: None     Source Type: Journal    
DOI: 10.1016/j.supflu.2010.09.024     Document Type: Article

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