Generation of basis sets with high degree of fulfillment of the hellmann-feynman theorem

Journal of Computational Chemistry

Volumn 28, Issue 4, 2007, Pages 748-758

  Rico, J Fernández ^a   Lopez R ^a   Ema, I ^a   Ramirez G ^a  

^a UNIVERSIDAD AUTÓNOMA DE MADRID   (Spain)

Author keywords

Electrostatic theorem; Hellmann feynman theorem; Slater basis sets

Indexed keywords

DERIVATIVES; ELECTROSTATICS; FUNCTION EVALUATION; SET THEORY;

ELECTROSTATIC THEOREM; HELLMANN-FEYNMAN THEOREM; SLATER BASIS SETS;

THEOREM PROVING;

EID: 33847753900     PISSN: 01928651     EISSN: 1096987X     Source Type: Journal    
DOI: 10.1002/jcc.20601     Document Type: Article

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