Investigation of charge transfer and structural distortions during photo-inducted excitation of cuprous bis-2,9-dimethyl-1,10-phenanthroline complex by density functional theory

Journal of Organometallic Chemistry

Volumn 691, Issue 4, 2006, Pages 551-556

  Wang, Xiaojing ^a   Lv, Chen ^b   Koyama, Michihisa ^b   Kubo, Momoji ^b,c   Miyamoto, Akira ^b  

^a INNER MONGOLIA UNIVERSITY   (China)

^b TOHOKU UNIVERSITY   (Japan)

^c JAPAN SCIENCE AND TECHNOLOGY AGENCY   (Japan)

Author keywords

Cuprous(I) bis 2,9 dimethyl 1,10 phenanthroline; Density functional theory; Excited state; MLCT excitation; Structural distortion

Indexed keywords

CHARGE TRANSFER; COPPER COMPOUNDS; ELECTRONIC PROPERTIES; IRRADIATION; OXIDATION; PHOTOACOUSTIC EFFECT; PROBABILITY DENSITY FUNCTION; RADIATION EFFECTS;

CUPROUS(I) BIS-2,9-DIMETHYL-1,10-PHENANTHROLINE; DENSITY FUNCTIONAL THEORY; EXCITED STATE; MLCT EXCITATION; STRUCTURAL DISTORTION;

ORGANOMETALLICS;

EID: 30844449407     PISSN: 0022328X     EISSN: None     Source Type: Journal    
DOI: 10.1016/j.jorganchem.2005.09.035     Document Type: Article

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