Ab initio calculation of electronic structure and electric field gradient in Pu3Sn and PuSn3

Physica B: Condensed Matter

Volumn 358, Issue 1-4, 2005, Pages 247-255

  Baizaee, S M ^a   Pourghazi, A ^a  

^a UNIVERSITY OF ISFAHAN   (Iran)

Author keywords

Electric field gradient; Electronic structure; Full potential linearized augmented plane wave method; Generalized gradient approximation; Spin orbit coupling

Indexed keywords

ANISOTROPY; APPROXIMATION THEORY; CHEMICAL BONDS; ELECTRIC FIELD EFFECTS; ELECTRONIC DENSITY OF STATES; ELECTRONIC STRUCTURE; FERMI LEVEL; HAMILTONIANS; LATTICE CONSTANTS; MATRIX ALGEBRA; SUPERCONDUCTIVITY;

ELECTRIC FIELD GRADIENT (EFG); FULL POTENTIAL LINEARIZED AUGMENTED PLANE WAVE METHOD; GENERALIZED GRADIENT APPROXIMATION (GGA); SPIN-ORBIT COUPLING (SOC);

PLUTONIUM COMPOUNDS;

EID: 15344339495     PISSN: 09214526     EISSN: None     Source Type: Journal    
DOI: 10.1016/j.physb.2005.01.413     Document Type: Article

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