Ab-initio calculation of electronic structure and electric field gradients in HfAl2 and ZrAl2 Laves phases

Computational Materials Science

Volumn 41, Issue 2, 2007, Pages 164-167

  Belosevic Cavor J ^a   Koteski, V ^a   Cekic B ^a   Umicevic A ^a  

^a UNIVERSITY OF BELGRADE   (Serbia)

Author keywords

Augmented plane wave; Electric field gradient; HfAl2; ZrAl2

Indexed keywords

ELECTRIC FIELDS; ELECTRONIC PROPERTIES; HAFNIUM COMPOUNDS; ZIRCONIUM COMPOUNDS;

AUGMENTED PLANE WAVE; ELECTRIC FIELD GRADIENTS (EFG);

ELECTRONIC STRUCTURE;

EID: 35948988090     PISSN: 09270256     EISSN: None     Source Type: Journal    
DOI: 10.1016/j.commatsci.2007.03.009     Document Type: Article

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