DocumentCode
2512012
Title
Assignment of low-frequency vibrational modes of coumarin-3-carboxylic acid
Author
Kambara, Ohki ; Sasaki, Tetsuo ; Tominaga, Keisuke ; Nishizawa, Jun-ichi
Author_Institution
Semicond. Res. Inst., Sophia Univ., Tokyo, Japan
fYear
2012
fDate
23-28 Sept. 2012
Firstpage
1
Lastpage
2
Abstract
Low-frequency spectra of non-isotopic/deuterated coumarin-3-carboxylic acid under 200 cm-1 was obtained by terahertz (THz) spectroscopy and was compared with calculated harmonic frequencies from DFT calculation with periodic systems to reveal mode assignment of the molecule in THz region.
Keywords
density functional theory; organic compounds; terahertz wave spectra; vibrational states; DFT; THz spectra; deuterated coumarin-3-carboxylic acid; low-frequency spectra; low-frequency vibrational modes; nonisotopic coumarin-3-carboxylic acid; periodic systems; terahertz spectroscopy; Atomic clocks; Frequency estimation;
fLanguage
English
Publisher
ieee
Conference_Titel
Infrared, Millimeter, and Terahertz Waves (IRMMW-THz), 2012 37th International Conference on
Conference_Location
Wollongong, NSW
ISSN
2162-2027
Print_ISBN
978-1-4673-1598-2
Electronic_ISBN
2162-2027
Type
conf
DOI
10.1109/IRMMW-THz.2012.6380336
Filename
6380336
Link To Document