A fully-relativistic full-potential-linearized-augmented-plane-wave study of the (1 1 1) surface of δ-Pu

Surface Science

Volumn 600, Issue 11, 2006, Pages 2231-2241

  Gong, H R ^a   Ray, A K ^a  

^a UNIVERSITY OF TEXAS AT ARLINGTON   (United States)

Author keywords

(1 1 1) Surface; Delta plutonium; Density functional theory; FP LAPW method; Generalized gradient approximation

Indexed keywords

APPROXIMATION THEORY; COMPUTATIONAL COMPLEXITY; ELECTRONIC STRUCTURE; GROUND STATE; MAGNETIC MOMENTS; PROBABILITY DENSITY FUNCTION;

(1 1 1) SURFACES; DELTA-PLUTONIUM; DENSITY FUNCTIONAL THEORY; FP-LAPW METHOD; GENERALIZED GRADIENT APPROXIMATION;

ANTIFERROMAGNETISM;

EID: 33646936328     PISSN: 00396028     EISSN: None     Source Type: Journal    
DOI: 10.1016/j.susc.2006.03.021     Document Type: Article

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