Using the locality of the small-component density in molecular Dirac-Hartree-Fock calculations

Theoretical Chemistry Accounts

Volumn 107, Issue 5, 2002, Pages 304-308

  De Jong, G Theodoor ^b   Visscher, Lucas ^a  

^a VU UNIVERSITY AMSTERDAM   (Netherlands)

^b NONE

Author keywords

Four component calculations; Linear scaling; Relativistic quantum chemistry

Indexed keywords

ACCURACY; ARTICLE; CALCULATION; MATHEMATICAL COMPUTING; METHODOLOGY; QUANTUM CHEMISTRY; THEORETICAL MODEL;

EID: 0036279562     PISSN: 1432881X     EISSN: None     Source Type: Journal    
DOI: 10.1007/s00214-002-0335-0     Document Type: Article

References (9)

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