Integrated study of first principles calculations and experimental measurements for Li-ionic conductivity in Al-doped solid-state LiGe2(PO4)3 electrolyte

Journal of Power Sources

Volumn 293, Issue , 2015, Pages 11-16

  Kang, Joonhee ^a   Chung, Habin ^b   Doh, Chilhoon ^c   Kang, Byoungwoo ^b   Han, Byungchan ^a  

^a Daegu Gyeongbuk Institute of Science and Technology   (South Korea)

^b Pohang University of Science and Technology (POSTECH)   (South Korea)

^c Korea Electrotechnology Research Institute (KERI)   (South Korea)

Author keywords

Diffusion mechanism; First principles; Ionic conductivity; Li ion batteries; Solid state electrolyte

Indexed keywords

ACTIVATION ENERGY; ALUMINUM COMPOUNDS; ATOMS; CALCULATIONS; DENSITY FUNCTIONAL THEORY; GERMANIUM COMPOUNDS; IONIC CONDUCTION IN SOLIDS; IONIC CONDUCTIVITY; LITHIUM-ION BATTERIES; MOLECULAR DYNAMICS; SOLID ELECTROLYTES;

AB INITIO MOLECULAR DYNAMICS; DIFFUSION MECHANISMS; ELECTROSTATIC ENVIRONMENTS; FIRST PRINCIPLES; FIRST PRINCIPLES DENSITY FUNCTIONAL THEORY (DFT) CALCULATIONS; FIRST-PRINCIPLES CALCULATION; NUDGED ELASTIC BAND METHODS; SOLID-STATE ELECTROLYTE;

LITHIUM COMPOUNDS;

EID: 84929628215     PISSN: 03787753     EISSN: None     Source Type: Journal    
DOI: 10.1016/j.jpowsour.2015.05.060     Document Type: Article

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