Calculation of the IR spectrum and the molecular structure of β-carotene

Journal of Applied Spectroscopy

Volumn 72, Issue 2, 2005, Pages 164-171

  Berezin, K V ^a   Nechaev, V V ^a  

^a SARATOV STATE UNIVERSITY   (Russian Federation)

Author keywords

carotene; B3LYP; IR spectrum; Quantum mechanical calculation; Structure

Indexed keywords

BETA CAROTENE; CAROTENOID; METHYL GROUP;

AB INITIO CALCULATION; ARTICLE; CHEMICAL STRUCTURE; CIS ISOMER; ENERGY TRANSFER; INFRARED SPECTROSCOPY; QUANTUM MECHANICS; STRUCTURE ANALYSIS;

EID: 21744456390     PISSN: 00219037     EISSN: None     Source Type: Journal    
DOI: 10.1007/s10812-005-0049-x     Document Type: Article

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