Spectroscopy and Spectral Analysis, Volume. 41, Issue 1, 127(2021)
Assignments on Raman Peaks of Red Coral Based on Experimental Raman Spectroscopy and Density Functional Theory Calculation
Figures & Tables(5)
Fig. 4. Theoretical Raman spectrum of canthaxanthin calculated by DFT
Table 1. Comparison of Raman peaks of red corals with theoretical Raman peaks of canthaxanthin
View tableView in ArticleTable 1. Comparison of Raman peaks of red corals with theoretical Raman peaks of canthaxanthin
Experimental Raman peaks
of red coral/cm-1Theoretical Raman peaks
of canthaxanthin/cm-1Difference Difference
rate/%Assignments 1 514 1 512 2 0.13 C=C stretching 1 295 1 269 26 2.00 C—H rocking 1 177 1 189 -12 1.02 C—C stretching 1 125 1 159 -34 3.02 C—C stretching 1 016 999 17 1.67 methyl rocking
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Chao-yang CHEN, Wei-zhi HUANG, Qiang GAO, Lu-wei FAN, Hsitien Shen Andy. Assignments on Raman Peaks of Red Coral Based on Experimental Raman Spectroscopy and Density Functional Theory Calculation[J]. Spectroscopy and Spectral Analysis, 2021, 41(1): 127
Paper Information
Category: Research Articles
Received: Dec. 16, 2019
Accepted: --
Published Online: Apr. 8, 2021
The Author Email: Chao-yang CHEN (377651868@qq.com)
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