Absorption spectra of benzoic acid in the 5-15 THz range

J. Horvat; L. M. Lepodise; R. A. Lewis

doi:10.1109/IRMMW-THz.2014.6956357

Absorption spectra of benzoic acid in the 5-15 THz range

J. Horvat, L. M. Lepodise, R. A. Lewis

Physics & Astronomy

Research output: Chapter in Book/Report/Conference proceeding › Conference contribution

Abstract

Absorption spectra of benzoic acid were measured between 5 and 15 THz. Hybrid DFT modeling does not reproduce the most intense absorption band at 8.61 THz. The same modeling on benzoic acid dimer reveals that the absorption bands at 8.61 and 12.7 THz occur because of inter-molecular inplane and out-of-plane vibrations of the dimer, respectively. The hydrogen bond length in dimer changes for these modes.

Original language	English
Title of host publication	2014 39th International Conference on Infrared, Millimeter, and Terahertz Waves, IRMMW-THz 2014
Publisher	IEEE Computer Society
ISBN (Electronic)	9781479938773
DOIs	https://doi.org/10.1109/IRMMW-THz.2014.6956357
Publication status	Published - Nov 13 2014
Event	39th International Conference on Infrared, Millimeter and Terahertz Waves, IRMMW-THz 2014 - Tucson, United States Duration: Sept 14 2014 → Sept 19 2014

Publication series

Name	International Conference on Infrared, Millimeter, and Terahertz Waves, IRMMW-THz
ISSN (Print)	2162-2027
ISSN (Electronic)	2162-2035

Other

Other	39th International Conference on Infrared, Millimeter and Terahertz Waves, IRMMW-THz 2014
Country/Territory	United States
City	Tucson
Period	9/14/14 → 9/19/14

All Science Journal Classification (ASJC) codes

Energy Engineering and Power Technology
Electrical and Electronic Engineering

Access to Document

10.1109/IRMMW-THz.2014.6956357

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Horvat, J., Lepodise, L. M., & Lewis, R. A. (2014). Absorption spectra of benzoic acid in the 5-15 THz range. In 2014 39th International Conference on Infrared, Millimeter, and Terahertz Waves, IRMMW-THz 2014 Article 6956357 (International Conference on Infrared, Millimeter, and Terahertz Waves, IRMMW-THz). IEEE Computer Society. https://doi.org/10.1109/IRMMW-THz.2014.6956357

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title = "Absorption spectra of benzoic acid in the 5-15 THz range",

abstract = "Absorption spectra of benzoic acid were measured between 5 and 15 THz. Hybrid DFT modeling does not reproduce the most intense absorption band at 8.61 THz. The same modeling on benzoic acid dimer reveals that the absorption bands at 8.61 and 12.7 THz occur because of inter-molecular inplane and out-of-plane vibrations of the dimer, respectively. The hydrogen bond length in dimer changes for these modes.",

author = "J. Horvat and Lepodise, {L. M.} and Lewis, {R. A.}",

note = "Publisher Copyright: {\textcopyright} 2014 IEEE.; 39th International Conference on Infrared, Millimeter and Terahertz Waves, IRMMW-THz 2014 ; Conference date: 14-09-2014 Through 19-09-2014",

year = "2014",

month = nov,

day = "13",

doi = "10.1109/IRMMW-THz.2014.6956357",

language = "English",

series = "International Conference on Infrared, Millimeter, and Terahertz Waves, IRMMW-THz",

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address = "United States",

}

Horvat, J, Lepodise, LM & Lewis, RA 2014, Absorption spectra of benzoic acid in the 5-15 THz range. in 2014 39th International Conference on Infrared, Millimeter, and Terahertz Waves, IRMMW-THz 2014., 6956357, International Conference on Infrared, Millimeter, and Terahertz Waves, IRMMW-THz, IEEE Computer Society, 39th International Conference on Infrared, Millimeter and Terahertz Waves, IRMMW-THz 2014, Tucson, United States, 9/14/14. https://doi.org/10.1109/IRMMW-THz.2014.6956357

Absorption spectra of benzoic acid in the 5-15 THz range. / Horvat, J.; Lepodise, L. M.; Lewis, R. A.
2014 39th International Conference on Infrared, Millimeter, and Terahertz Waves, IRMMW-THz 2014. IEEE Computer Society, 2014. 6956357 (International Conference on Infrared, Millimeter, and Terahertz Waves, IRMMW-THz).

Research output: Chapter in Book/Report/Conference proceeding › Conference contribution

TY - GEN

T1 - Absorption spectra of benzoic acid in the 5-15 THz range

AU - Horvat, J.

AU - Lepodise, L. M.

AU - Lewis, R. A.

PY - 2014/11/13

Y1 - 2014/11/13

N2 - Absorption spectra of benzoic acid were measured between 5 and 15 THz. Hybrid DFT modeling does not reproduce the most intense absorption band at 8.61 THz. The same modeling on benzoic acid dimer reveals that the absorption bands at 8.61 and 12.7 THz occur because of inter-molecular inplane and out-of-plane vibrations of the dimer, respectively. The hydrogen bond length in dimer changes for these modes.

AB - Absorption spectra of benzoic acid were measured between 5 and 15 THz. Hybrid DFT modeling does not reproduce the most intense absorption band at 8.61 THz. The same modeling on benzoic acid dimer reveals that the absorption bands at 8.61 and 12.7 THz occur because of inter-molecular inplane and out-of-plane vibrations of the dimer, respectively. The hydrogen bond length in dimer changes for these modes.

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U2 - 10.1109/IRMMW-THz.2014.6956357

DO - 10.1109/IRMMW-THz.2014.6956357

M3 - Conference contribution

AN - SCOPUS:84911950621

T3 - International Conference on Infrared, Millimeter, and Terahertz Waves, IRMMW-THz

BT - 2014 39th International Conference on Infrared, Millimeter, and Terahertz Waves, IRMMW-THz 2014

PB - IEEE Computer Society

T2 - 39th International Conference on Infrared, Millimeter and Terahertz Waves, IRMMW-THz 2014

Y2 - 14 September 2014 through 19 September 2014

ER -

Absorption spectra of benzoic acid in the 5-15 THz range

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