First-principles prediction of voltages of lithiated oxides for lithium-ion batteries

Solid State Ionics

Volumn 112, Issue 3-4, 1998, Pages 255-259

  Benco, L'Ubomír ^a,c   Barras, Jean Luc ^a   Atanasov, Michail ^a,d   Daul, Claude A ^a   Deiss, Erich ^b  

^a UNIVERSITY OF FRIBOURG   (Switzerland)

^b PAUL SCHERRER INSTITUTE   (Switzerland)

^c INSTITUTE OF CHEMISTRY   (Slovakia)

^d INSTITUTE OF GENERAL AND INORGANIC CHEMISTRY   (Bulgaria)

Author keywords

Average voltage; Enthalpies of formation; First principles calculations; Intercalation compounds; Li ion batteries

Indexed keywords

BINDING ENERGY; ENTHALPY; INTERCALATION COMPOUNDS; OXIDES;

FIRST-PRINCIPLE PREDICTIONS; LITHIATED OXIDES; LITHIUM-ION BATTERIES;

LITHIUM BATTERIES;

EID: 0032182656     PISSN: 01672738     EISSN: None     Source Type: Journal    
DOI: 10.1016/s0167-2738(98)00232-x     Document Type: Article

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