Differential solubility of ethylene and acetylene in room-temperature ionic liquids: A theoretical study

Journal of Physical Chemistry B

Volumn 116, Issue 13, 2012, Pages 3944-3953

  Zhao, Xu ^a   Xing, Huabin ^a   Yang, Qiwei ^a   Li, Rulong ^a   Su, Baogen ^a   Bao, Zongbi ^a   Yang, Yiwen ^a   Ren, Qilong ^a  

^a ZHEJIANG UNIVERSITY   (China)

Author keywords

[No Author keywords available]

Indexed keywords

ACETYLENE; GASES; HYDROGEN BONDS; IONIC LIQUIDS; LIGHTING; MOLECULAR DYNAMICS; MOLECULAR MECHANICS; NEGATIVE IONS; POSITIVE IONS; QUANTUM CHEMISTRY; SOLUBILITY;

ATOMS IN MOLECULES; BOND CRITICAL POINTS; DOMINANT FACTOR; ENVIRONMENTAL POLLUTIONS; EXPERIMENTAL DATA; GAS MOLECULES; GAS SEPARATIONS; HYDROGEN BONDING INTERACTIONS; IMIDAZOLIUM CATION; INTERACTION ENERGIES; INTERACTION MECHANISMS; ION PAIRS; MOLECULAR DYNAMICS SIMULATIONS; NATURAL BOND ORBITAL; OPTIMIZED GEOMETRIES; QUANTUM CHEMICAL CALCULATIONS; REGULAR SOLUTION THEORY; ROOM TEMPERATURE IONIC LIQUIDS; SECOND ORDERS; SOLUTION CONDITIONS; SOLVENT LOSS; STABILIZATION ENERGY; THEORETICAL STUDY; [BMIM][BF; [BMIM][TF;

ETHYLENE;

EID: 84859579292     PISSN: 15206106     EISSN: 15205207     Source Type: Journal    
DOI: 10.1021/jp211095y     Document Type: Article

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