An investigation of the structure of free-base porphycene by time-resolved electron nuclear double resonance and density functional theory on the photoexcited triplet state

Molecular Physics

Volumn 99, Issue 16, 2001, Pages 1413-1420

  Kay, C W M ^a   Gromadecki, U ^a   Torring J T ^a   Weber, S ^a  

^a FREIE UNIVERSITÄT BERLIN   (Germany)

Author keywords

[No Author keywords available]

Indexed keywords

ELECTRON ENERGY LEVELS; ELECTRON RESONANCE; GROUND STATE; ISOMERS; MOLECULAR STRUCTURE; NUCLEAR MAGNETIC RESONANCE SPECTROSCOPY;

BASIS SET; COMPOSITE EXCHANGE CORRELATION FUNCTIONAL; DENSITY FUNCTIONAL; EXCITED TRIPLET STATE; HYPERFINE COUPLINGS; PHOTOEXCITED TRIPLET STATE; PORPHYCENE; TIME RESOLVED ELECTRON NUCLEAR DOUBLE RESONANCE; TRANSCONFORMATION;

MOLECULAR PHYSICS;

EID: 0035921516     PISSN: 00268976     EISSN: None     Source Type: Journal    
DOI: 10.1080/00268970110054520     Document Type: Article

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