Analysis of interactions between 1-butyl-3-methylimidazolium cation and halide anions (Cl-, Br- and I-) by ab initio calculations: Anion size effects on preferential locations of anions

Molecular Physics

Volumn 106, Issue 12-13, 2008, Pages 1621-1629

  Tsuzuki, Seiji ^a   Katoh, Ryuzi ^a   Mikami, Masuhiro ^a  

^a NATIONAL INSTITUTE OF ADVANCED INDUSTRIAL SCIENCE AND TECHNOLOGY AIST   (Japan)

Author keywords

Ab initio calculations; Crystal structure; Intermolecular interaction; Ionic liquids; Orientation dependence

Indexed keywords

FLOW INTERACTIONS; NEGATIVE IONS;

AB INITIO CALCULATIONS; CRYSTAL STRUCTURE; HALIDE ANIONS; INTERMOLECULAR INTERACTION; INTERMOLECULAR INTERACTION ENERGIES; IONIC LIQUIDS; ORIENTATION DEPENDENCE;

CHLORINE COMPOUNDS;

EID: 52149118034     PISSN: 00268976     EISSN: 13623028     Source Type: Journal    
DOI: 10.1080/00268970802258575     Document Type: Article

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