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Computational Materials Science

Volumn 8, Issue 1-2, 1997, Pages 142-152

Calculation of total energies in multicomponent oxides

(2) Kohan, A F a Ceder, G a

a Massachusetts Institute of Technology (United States)

Author keywords

[No Author keywords available]

Indexed keywords

BINDING ENERGY; COMPUTATIONAL METHODS; ENTHALPY; INTERPOLATION; MATHEMATICAL MODELS; QUANTUM THEORY;

FULL POTENTIAL LINEARIZED AUGMENTED PLANE WAVE METHOD; LINEAR MUFFIN TIN ORBITAL METHOD;

OXIDES;

EID: 0031142998 PISSN: 09270256 EISSN: None Source Type: Journal
DOI: 10.1016/S0927-0256(97)00027-X Document Type: Article

Times cited : (13)

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