First-principles study of EMIM-FAFSA molecule adsorption on a Li(100) surface as a model for Li-ion battery electrodes

Journal of Physical Chemistry C

Volumn 116, Issue 15, 2012, Pages 8493-8509

  Valencia, Hubert ^a   Kohyama, Masanori ^a   Tanaka, Shingo ^a   Matsumoto, Hajime ^a  

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

Author keywords

[No Author keywords available]

Indexed keywords

BOND FORMATION; ELECTRIC TRANSPORT PROPERTIES; FIRST-PRINCIPLES STUDY; IMIDAZOLIUM; ION-PAIR ADSORPTION; LI ATOMS; LI-ION BATTERIES; PERIODIC DENSITY FUNCTIONAL THEORY CALCULATIONS; RING STRUCTURES; ROOM TEMPERATURE; SUBSTANTIAL REDUCTION; SYSTEMATIC VARIATION; THEORETICAL RESULT; VALENCE ELECTRON;

ADSORPTION; AMIDES; ATOMS; CALCULATIONS; ELECTRIC PROPERTIES; ELECTRONIC STRUCTURE; MOLECULES; NEGATIVE IONS; SULFUR DIOXIDE; TRANSPORT PROPERTIES;

ELECTROCHEMICAL CELLS;

EID: 84860140895     PISSN: 19327447     EISSN: 19327455     Source Type: Journal    
DOI: 10.1021/jp2109797     Document Type: Article

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