Calculation of solvation free energies of Li+ and O2- ions and neutral lithium-oxygen compounds in acetonitrile using mixed cluster/continuum models

Theoretical Chemistry Accounts

Volumn 131, Issue 7, 2012, Pages 1-11

  Bryantsev, Vyacheslav S ^a  

^a Liox Power Inc   (United States)

Author keywords

Acetonitrile solvent; Continuum and mixed cluster continuum solvent models; Lithium ion; Lithium oxygen compounds; Solvation free energy; Superoxide ion

Indexed keywords

EID: 84862981679     PISSN: 1432881X     EISSN: None     Source Type: Journal    
DOI: 10.1007/s00214-012-1250-7     Document Type: Article

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