Development of many-body polarizable force fields for Li-battery components: 1. Ether, alkane, and carbonate-based solvents

Journal of Physical Chemistry B

Volumn 110, Issue 12, 2006, Pages 6279-6292

  Borodin, Oleg ^a   Smith, Grant D ^a,b  

^a UNIVERSITY OF UTAH   (United States)

^b Department of Electrical and Computer Engineering   (United States)

Author keywords

[No Author keywords available]

Indexed keywords

CARBONATES; DIMERS; ETHERS; MOLECULAR DYNAMICS; PARAFFINS; POLARIZATION;

BINDING ENERGIES; CYCLIC CARBONATES; POLARIZABLE FORCE FIELDS; THERMODYNAMIC LIQUID-STATE PROPERTIES;

LITHIUM BATTERIES;

EID: 33645807135     PISSN: 15206106     EISSN: None     Source Type: Journal    
DOI: 10.1021/jp055079e     Document Type: Article

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