Rydberg - Valence interactions in monoolefins: Dispersing electronic properties in 1,1′-bicyclohexylidene

ChemPhysChem

Volumn 4, Issue 1, 2003, Pages 97-101

  Rijkenberg, Rolf A ^a   Buma, Wybren J ^a   Van Lenthe, Joop H ^b   Jenneskens, Leonardus W ^b   Schmal, Leonard P ^b  

^a UNIVERSITY OF AMSTERDAM   (Netherlands)

^b UTRECHT UNIVERSITY   (Netherlands)

Author keywords

Ab initio calculations; Alkenes; Electronic spectroscopy; Oligo(cyclohexylidene)s; Rydberg valence coupling

Indexed keywords

ELECTRONIC PROPERTIES; ELECTRONIC STRUCTURE; OLEFINS;

AB INITIO CALCULATIONS; ELECTRONIC COUPLING; ELECTRONIC SPECTROSCOPY; LOW LYING ELECTRONIC STATE; OLIGO(CYCLOHEXYLIDENE)S; RYDBERG; RYDBERG-VALENCE INTERACTION; VALENCE STATE;

CALCULATIONS;

1,1' BICYCLOHEXYLIDENE; ALKENE; UNCLASSIFIED DRUG;

AB INITIO CALCULATION; ARTICLE; ELECTRON TRANSPORT; MOLECULAR DYNAMICS; MOLECULAR INTERACTION; NONLINEAR SYSTEM; OSCILLATION; SPECTROSCOPY;

EID: 0037434215     PISSN: 14394235     EISSN: None     Source Type: Journal    
DOI: 10.1002/cphc.200390016     Document Type: Article

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