Phase diagrams of alkali halides using two interaction models: A molecular dynamics and free energy study

Journal of Chemical Physics

Volumn 126, Issue 2, 2007, Pages

  Rodrigues, Pedro C R ^a   Silva Fernandes, Fernando M S ^a  

^a UNIVERSITY OF LISBON   (Portugal)

Author keywords

[No Author keywords available]

Indexed keywords

COMPUTER SIMULATION; FREE ENERGY; MATHEMATICAL MODELS; PHASE DIAGRAMS; PHASE EQUILIBRIA; POTASSIUM; SODIUM CHLORIDE;

ALKALI HALIDES; BORN-MAYER-HUGGINS (BMH) MODELS; COEXISTENT LIQUIDS; MICHIELSEN-WOERLEE-GRAAF (MWG) EFFECTIVE PAIR POTENTIALS; SOLID-GAS EQUILIBRIA;

MOLECULAR DYNAMICS;

EID: 33846246709     PISSN: 00219606     EISSN: None     Source Type: Journal    
DOI: 10.1063/1.2423030     Document Type: Article

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