Radial behavior of gradient expansion approximation to atomic Fukui function and shell structure of atoms

Journal of Computational Chemistry

Volumn 19, Issue 5, 1998, Pages 488-503

  Pacios, L F ^a   Gomez P C ^b  

^a UNIVERSIDAD POLITÉCNICA DE MADRID   (Spain)

^b UNIVERSIDAD COMPLUTENSE DE MADRID   (Spain)

Author keywords

Atomic hardnesses; Density functional theory; Electron density; Fukui function; Shell structure

Indexed keywords

EID: 0038031521     PISSN: 01928651     EISSN: None     Source Type: Journal    
DOI: 10.1002/(SICI)1096-987X(19980415)19:5<488::AID-JCC2>3.0.CO;2-I     Document Type: Article

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