Insights into electrochemical performance of Li2FeSiO 4 from first-principles calculations

Electrochimica Acta

Volumn 111, Issue , 2013, Pages 172-178

  Zhang, P ^a   Zheng, Y ^a   Yu, S ^a   Wu, S Q ^a   Wen, Y H ^a   Zhu, Z Z ^a,b   Yang, Y ^c  

^a XIAMEN UNIVERSITY   (China)

^b Fujian Provincial Key Laboratory of Theoretical and Computational Chemistry   (China)

^c XIAMEN UNIVERSITY   (China)

Author keywords

Charge discharge mechanism; First principles; Li ion battery

Indexed keywords

CALCULATIONS; IONS; LITHIUM-ION BATTERIES; REDOX REACTIONS;

CHARGE BALANCES; CHARGE-DISCHARGE BEHAVIOR; CHARGE-DISCHARGE MECHANISM; CHARGE-DISCHARGE PROCESS; ELECTROCHEMICAL PERFORMANCE; FIRST PRINCIPLES; FIRST-PRINCIPLES CALCULATION; STRUCTURAL TRANSFORMATION;

LITHIUM;

EID: 84884560447     PISSN: 00134686     EISSN: None     Source Type: Journal    
DOI: 10.1016/j.electacta.2013.07.190     Document Type: Article

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