Density functional theory calculation of vibrational spectroscopy of trans-1,2-bis(4-pyridyl)-ethylene

Vibrational Spectroscopy

Volumn 43, Issue 2, 2007, Pages 306-312

  Zhuang, Zhiping ^a,b   Cheng, Jianbo ^c   Jia, Huiying ^a   Zeng, Jianbo ^a   Han, Xiaoxia ^a   Zhao, Bing ^a   Zhang, Hongxing ^d   Zhang, Gang ^d   Zhao, Wei ^b  

^a JILIN UNIVERSITY   (China)

^b MUDANJIANG NORMAL UNIVERSITY   (China)

^c YANTAI UNIVERSITY   (China)

^d State Key Laboratory of Theoretical and Computational Chemistry   (China)

Author keywords

DFT; FTIR and FT Raman spectra; t BPE; Vibrational assignment

Indexed keywords

ELECTROMAGNETISM; FOURIER TRANSFORM INFRARED SPECTROSCOPY; GROUND STATE; PROBABILITY DENSITY FUNCTION; RAMAN SCATTERING; SILVER;

FT-RAMAN SPECTRA; T-BPE; VIBRATIONAL ASSIGNMENT;

ETHYLENE;

EID: 33846853951     PISSN: 09242031     EISSN: None     Source Type: Journal    
DOI: 10.1016/j.vibspec.2006.03.009     Document Type: Article

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