A Refined All-Atom Potential for Imidazolium-Based Room Temperature Ionic Liquids: Acetate, Dicyanamide, and Thiocyanate Anions

Journal of Physical Chemistry B

Volumn 119, Issue 34, 2015, Pages 11041-11051

  Mondal, Anirban ^a   Balasubramanian, Sundaram ^a  

^a JAWAHARLAL NEHRU CENTRE FOR ADVANCED SCIENTIFIC RESEARCH   (India)

Author keywords

[No Author keywords available]

Indexed keywords

DENSITY FUNCTIONAL THEORY; DENSITY OF LIQUIDS; IONS; LIQUIDS;

DICYANAMIDE; FORCE FIELDS; IMIDAZOLIUM-BASED; INTERMOLECULAR STRUCTURES; PERIODIC DENSITY FUNCTIONAL THEORY CALCULATIONS; POTENTIAL PARAMETERS; ROOM TEMPERATURE IONIC LIQUIDS; SITE CHARGES;

IONIC LIQUIDS;

EID: 84940544673     PISSN: 15206106     EISSN: 15205207     Source Type: Journal    
DOI: 10.1021/acs.jpcb.5b02272     Document Type: Article

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