Maximal probability domains in linear molecules

Journal of Computational Chemistry

Volumn 26, Issue 5, 2005, Pages 455-460

  Gallegos, A ^a   Carbo Dorca R ^a   Lodier, F ^b   Cances E ^b   Savin, A ^c  

^a UNIVERSITY OF GIRONA   (Spain)

^b UNIVERSITÉ PARIS EST   (France)

^c LABORATOIRE DE CHIMIE THÉORIQUE   (France)

Author keywords

Linear molecules; electron localization function (ELF); Maximal probability domains

Indexed keywords

ALGORITHMS; FUNCTIONS; OPTIMIZATION; PERTURBATION TECHNIQUES; PROBABILITY DISTRIBUTIONS; QUANTUM THEORY; SET THEORY;

ELECTRON LOCALIZATION FUNCTIONS (ELF); LINEAR MOLECULES; MAXIMAL PROBABILITY DOMAINS; WAVE FUNCTIONS;

ELECTRONIC STRUCTURE;

EID: 16244382024     PISSN: 01928651     EISSN: None     Source Type: Journal    
DOI: 10.1002/jcc.20180     Document Type: Article

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