First-principles study of lattice dynamics of LiFePO4

Physics Letters, Section A: General, Atomic and Solid State Physics

Volumn 373, Issue 44, 2009, Pages 4096-4100

  Shi, Siqi ^a,b   Zhang, Hua ^a   Ke, Xuezhi ^c   Ouyang, Chuying ^d   Lei, Minsheng ^d   Chen, Liquan ^b  

^a ZHEJIANG SCI TECH UNIVERSITY   (China)

^b INSTITUTE OF GEOLOGY AND GEOPHYSICS   (China)

^c EAST CHINA NORMAL UNIVERSITY   (China)

^d JIANGXI NORMAL UNIVERSITY   (China)

Author keywords

First principles calculations; Lattice dynamics; Lithium iron phosphate

Indexed keywords

CALCULATIONS; DYNAMICS; IRON COMPOUNDS; LATTICE VIBRATIONS; LITHIUM COMPOUNDS; PHONONS; SILICATE MINERALS; TENSORS;

BORN EFFECTIVE CHARGE; BRILLOUIN ZONES; FIRST-PRINCIPLES CALCULATION; FIRST-PRINCIPLES STUDY; LITHIUM IRON PHOSPHATES; PHONON DISPERSION CURVES; PHONON FREQUENCIES; THEORETICAL CALCULATIONS;

PHOSPHORUS COMPOUNDS;

EID: 74249100413     PISSN: 03759601     EISSN: None     Source Type: Journal    
DOI: 10.1016/j.physleta.2009.09.014     Document Type: Article

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