Ab initio study on the Li deintercalation in ternary lithium nitridocuprate Li2.5Cu0.5N

Electrochimica Acta

Volumn 53, Issue 27, 2008, Pages 7915-7920

  Wu, S Q ^a   Cai, N L ^a   Zhu, Z Z ^a   Yang, Y ^b  

^a XIAMEN UNIVERSITY   (China)

^b XIAMEN UNIVERSITY   (China)

Author keywords

Ab initio calculation; Anode; Li deinteraclation; Lithium copper nitride

Indexed keywords

DENSITY FUNCTIONAL THEORY; LITHIUM COMPOUNDS; METALS; NITRIDES; PROBABILITY DENSITY FUNCTION; TRANSITION METALS;

AB INITIO CALCULATION; AB INITIO STUDIES; ANODE; DE-INTERCALATION; FIRST-PRINCIPLES METHODS; GENERALIZED GRADIENT APPROXIMATION; LI DEINTERACLATION; LITHIUM COPPER NITRIDE; LITHIUM DEINTERCALATION;

LITHIUM;

EID: 50049126094     PISSN: 00134686     EISSN: None     Source Type: Journal    
DOI: 10.1016/j.electacta.2008.05.073     Document Type: Article

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