Structures and spectroscopic properties of bis(phthalocyaninato) yttrium and lanthanum complexes: Theoretical study based on density functional theory calculations

Journal of Physical Chemistry A

Volumn 111, Issue 2, 2007, Pages 392-400

  Zhang, Yuexing ^a   Cai, Xue ^a,b   Zhou, Yang ^a   Zhang, Xianxi ^a,c   Xu, Hui ^a   Liu, Zhongqiang ^a   Li, Xiyou ^a   Jiang, Jianzhuang ^a  

^a SHANDONG UNIVERSITY   (China)

^b MUDANJIANG NORMAL UNIVERSITY   (China)

^c LIAOCHENG UNIVERSITY   (China)

Author keywords

[No Author keywords available]

Indexed keywords

ABSORPTION SPECTROSCOPY; COMPLEXATION; LANTHANUM COMPOUNDS; MOLECULAR STRUCTURE; PROBABILITY DENSITY FUNCTION; RAMAN SCATTERING; RARE EARTH COMPOUNDS;

CHARGE DISTRIBUTION; DENSITY FUNCTIONAL THEORY (DFT); INTER-RING DISTANCE; MOLECULAR ORBITALS;

YTTRIUM COMPOUNDS;

EID: 33847120916     PISSN: 10895639     EISSN: None     Source Type: Journal    
DOI: 10.1021/jp066157g     Document Type: Article

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