Acceleration of self-consistent electronic-structure calculations: Storage-saving and multiple-secant implementation of the Broyden method

Materials Transactions, JIM

Volumn 40, Issue 11, 1999, Pages 1186-1192

  Sawamura, Akitaka ^a   Kohyama, Masanori ^a   Keishi, Tomohiro ^a   Kaji, Mikio ^a  

^a SUMITOMO ELECTRIC INDUSTRIES LTD   (Japan)

Author keywords

[No Author keywords available]

Indexed keywords

COMPUTATIONAL METHODS; CRYSTAL ORIENTATION; ELECTRONIC STRUCTURE; MATHEMATICAL MODELS; MATRIX ALGEBRA; NONLINEAR EQUATIONS;

BROYDEN METHOD; PSEUDOPOTENTIAL METHOD; QUASI-NEWTON MATRIX;

SILICON WAFERS;

EID: 0033357625     PISSN: 09161821     EISSN: None     Source Type: Journal    
DOI: 10.2320/matertrans1989.40.1186     Document Type: Article

References (43)