Molecular Dynamics Simulation of Transport and Structural Properties of CO2 Using Different Molecular Models

Journal of Chemical and Engineering Data

Volumn 60, Issue 8, 2015, Pages 2188-2196

  Zhong, Haimin ^a   Lai, Shuhui ^a   Wang, Jinyang ^a   Qiu, Wenda ^a   Lüdemann, Hans Dietrich ^b   Chen, Liuping ^a  

^a SUN YAT SEN UNIVERSITY   (China)

^b UNIVERSITY OF REGENSBURG   (Germany)

Author keywords

[No Author keywords available]

Indexed keywords

CARBON DIOXIDE; CLUSTERING ALGORITHMS; DISTRIBUTION FUNCTIONS; STRUCTURAL PROPERTIES;

AVERAGE ABSOLUTE RELATIVE DEVIATIONS; FLEXIBLE MODEL; LOW TEMPERATURES; MOLECULAR DYNAMICS SIMULATIONS; RADIAL DISTRIBUTION FUNCTIONS; SOLVATION SHELL; TEMPERATURE RANGE; THERMODYNAMIC STATE;

MOLECULAR DYNAMICS;

EID: 84939200733     PISSN: 00219568     EISSN: 15205134     Source Type: Journal    
DOI: 10.1021/je5009526     Document Type: Article

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