Ab initio calculations of structural and electronic properties of Y2Ti2O7 and Cd2Nb2O7

Physica B: Condensed Matter

Volumn 392, Issue 1-2, 2007, Pages 341-347

  Terki, R ^a   Bertrand, G ^a   Aourag, H ^b   Coddet, C ^a  

^a UNIVERSITÉ DE TECHNOLOGIE DE BELFORT MONTBÉLIARD   (France)

^b UNIVERSITY OF TLEMCEN   (Algeria)

Author keywords

Cd2Nb2O7; FP LAPW; Pyrochlore oxides; Y2Ti2O7

Indexed keywords

CADMIUM COMPOUNDS; CHEMICAL BONDS; ELECTRONIC PROPERTIES; ENERGY GAP; GRADIENT METHODS; GROUND STATE; PROBABILITY DENSITY FUNCTION;

CHARGE DENSITY; DENSITY OF STATE; FULL-POTENTIAL LINEARIZED AUGMENTED PLANE WAVE (FP-LAPW); PYROCHLORE OXIDES;

YTTRIUM COMPOUNDS;

EID: 33847311279     PISSN: 09214526     EISSN: None     Source Type: Journal    
DOI: 10.1016/j.physb.2006.11.047     Document Type: Review

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