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Volumn 106, Issue 3, 2012, Pages 645-653

Elastic, electronic and thermodynamic properties of fluoro-perovskite KZnF 3 via first-principles calculations

Author keywords

[No Author keywords available]

Indexed keywords

BONDING PROPERTY; DENSITY OF STATE; ELECTRON CHARGE DENSITY; ELECTRONIC BAND STRUCTURE CALCULATION; EXCHANGE-CORRELATION POTENTIAL; FIRST-PRINCIPLES CALCULATION; FP-LAPW; FULL-POTENTIAL LINEARIZED AUGMENTED PLANE WAVES; GENERALIZED GRADIENT APPROXIMATIONS; PERDEW-BURKE-ERNZERHOF; POISSON'S RATIO; POLYCRYSTALLINE; PRESSURE AND TEMPERATURE; QUASI-HARMONIC DEBYE MODEL; TOTAL ENERGY; YOUNG'S MODULUS;

EID: 84858792039     PISSN: 09478396     EISSN: 14320630     Source Type: Journal    
DOI: 10.1007/s00339-011-6643-2     Document Type: Article
Times cited : (53)

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* 이 정보는 Elsevier사의 SCOPUS DB에서 KISTI가 분석하여 추출한 것입니다.