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Volumn 2, Issue 28, 2012, Pages 10667-10672
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DFT-study of the energetics of perovskite-type oxides LaMO3 (M = Sc-Cu)
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Author keywords
[No Author keywords available]
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Indexed keywords
ENTHALPY;
PEROVSKITE;
SYSTEMATIC ERRORS;
ENTHALPIES OF FORMATION;
FORMATION ENTHALPY;
GENERALIZED GRADIENT APPROXIMATIONS;
GEOMETRICAL RELAXATION;
OXYGEN MOLECULE;
PEROVSKITE TYPE OXIDES;
REACTION PATHWAYS;
SELF-INTERACTIONS;
DENSITY FUNCTIONAL THEORY;
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EID: 84867497560
PISSN: None
EISSN: 20462069
Source Type: Journal
DOI: 10.1039/c2ra21139d Document Type: Article |
Times cited : (8)
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References (38)
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