Ionic dissociations of chlorosulfonic acid in microsolvated clusters: A density functional theory and ab initio MO study

Science in China, Series B: Chemistry

Volumn 51, Issue 4, 2008, Pages 305-315

  Li, ShuJin ^a   Tao, FuMing ^b   Gu, RenAo ^a  

^a SOOCHOW UNIVERSITY   (China)

^b CALIFORNIA STATE UNIVERSITY   (United States)

Author keywords

Ab initio method; Chlorosulfonic acid; Density functional theory; Molecular cluster

Indexed keywords

BINDING ENERGY; DENSITY FUNCTIONAL THEORY; GIBBS FREE ENERGY; SULFURIC ACID; THERMODYNAMICS;

CHLOROSULFONIC ACID; MOLECULAR CLUSTERS; RELATIVE ENTHALPY;

MOLECULAR DYNAMICS;

EID: 43349089729     PISSN: 10069291     EISSN: None     Source Type: Journal    
DOI: 10.1007/s11426-007-0106-9     Document Type: Article

References (26)

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