Elongation cutoff technique at Kohn-Sham level of theory

International Journal of Quantum Chemistry

Volumn 110, Issue 12, 2010, Pages 2130-2139

  Korchowiec, Jacek ^a   De Silva, Piotr ^a   Makowski, Marcin ^a   Gu, Feng Long ^b   Aoki, Yuriko ^c,d  

^a JAGIELLONIAN UNIVERSITY   (Poland)

^b SOUTH CHINA NORMAL UNIVERSITY   (China)

^c KYUSHU UNIVERSITY   (Japan)

^d JAPAN SCIENCE AND TECHNOLOGY AGENCY   (Japan)

Author keywords

Cutoff technique; Elongation method; Fragmentation methods; Linear scaling methods

Indexed keywords

CENTRAL PROCESSING UNITS; COMPUTATIONAL SCHEMES; CURRENT ANALYSIS; CUTOFF TECHNIQUE; ELONGATION METHOD; EXCHANGE-CORRELATIONS; KOHN-SHAM LEVELS; LINEAR SCALING METHOD; LOCALIZED MOLECULAR ORBITALS; MATRIX; MODEL SYSTEM;

ELONGATION; MOLECULAR ORBITALS; PROGRAM PROCESSORS;

DENSITY FUNCTIONAL THEORY;

EID: 77955142153     PISSN: 00207608     EISSN: 1097461X     Source Type: Journal    
DOI: 10.1002/qua.22562     Document Type: Article

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