Simulations of imidazolium ionic liquids: When does the cation charge distribution matter?

Journal of Physics Condensed Matter

Volumn 21, Issue 42, 2009, Pages

  Lynden Bell, R M ^a   Youngs, T G A ^b  

^a Department of Chemistry ^*  (United Kingdom)

^b QUEEN'S UNIVERSITY BELFAST   (United Kingdom)

Author keywords

[No Author keywords available]

Indexed keywords

CATION CHARGE; CHARGE SCREENING; CHLORIDE IONS; DYNAMICAL PROPERTIES; EQUILIBRIUM PROPERTIES; FORCE FIELDS; IMIDAZOLIUM IONIC LIQUIDS; INTERMOLECULAR POTENTIALS; LIQUID STRUCTURES; POLARIZABILITIES; SHELL MODELS; SHORT RANGE INTERACTIONS;

CHARGE DISTRIBUTION; CHLORINE COMPOUNDS; COMPUTER SIMULATION; CRYSTAL STRUCTURE; IONIC LIQUIDS; POLARIZATION;

POSITIVE IONS;

EID: 73449103122     PISSN: 09538984     EISSN: 1361648X     Source Type: Journal    
DOI: 10.1088/0953-8984/21/42/424120     Document Type: Article

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