All-electron mixed-basis calculation with conjugated gradient method to optimize structure of copper clusters

Materials Transactions, JIM

Volumn 40, Issue 11, 1999, Pages 1205-1208

  Bae, Y C ^a   Ohno, Kaoru ^a   Kawazoe, Yoshiyuki ^a  

^a TOHOKU UNIVERSITY   (Japan)

Author keywords

[No Author keywords available]

Indexed keywords

COMPUTATIONAL METHODS; ELECTRON ENERGY LEVELS; ELECTRONIC STRUCTURE; OPTIMIZATION;

CONJUGATE GRADIENT METHOD;

COPPER;

EID: 0033354838     PISSN: 09161821     EISSN: None     Source Type: Journal    
DOI: 10.2320/matertrans1989.40.1205     Document Type: Article

References (18)