Abstract
The high–resolution infrared spectrum of C2H2D2-cis was recorded for the first time and analyzed in the region of 2400–2700 cm−1, where the ν2+ν6 band is located. 1987 transitions were assigned to the ν2+ν6 band and 623 ro–vibrational energies of the (v2=v6=1) vibrational state were determined from the assigned transitions. Parameters of the effective Hamiltonian were determined from the weighted fit, which takes into account the studied (v2=v6=1) vibrational state and six other closely located (but experimentally here not visible) vibrational states of C2H2D2-cis. The obtained “experimental” energy values were used as initial information in the fit. Determined from the fit, a set of 95 parameters reproduces 623 initial energy values of the (v2=v6=1) vibrational state, representing 1987 line positions of the ν2+ν6 band with the drms=3.98×10−3 cm−1.
| Original language | English |
|---|---|
| Pages (from-to) | 99-109 |
| Number of pages | 11 |
| Journal | Journal of Quantitative Spectroscopy and Radiative Transfer |
| Volume | 233 |
| DOIs | |
| Publication status | Published - 1 Aug 2019 |
Fingerprint
Keywords
- High-resolution spectra of CHD-cis
- Ro-vibrational resonance interactions
- Spectroscopic parameters
- ν+ν band of CHD-cis ethylene
ASJC Scopus subject areas
- Radiation
- Atomic and Molecular Physics, and Optics
- Spectroscopy
Cite this
First high-resolution analysis of the ν2+ν6 band of the C2H2D2-cis isotopologue of ethylene. / Ulenikov, O. N.; Gromova, O. V.; Bekhtereva, E. S.; Konova, Yu V.; Sydow, C.; Bauerecker, S.
In: Journal of Quantitative Spectroscopy and Radiative Transfer, Vol. 233, 01.08.2019, p. 99-109.Research output: Contribution to journal › Article
}
TY - JOUR
T1 - First high-resolution analysis of the ν2+ν6 band of the C2H2D2-cis isotopologue of ethylene
AU - Ulenikov, O. N.
AU - Gromova, O. V.
AU - Bekhtereva, E. S.
AU - Konova, Yu V.
AU - Sydow, C.
AU - Bauerecker, S.
PY - 2019/8/1
Y1 - 2019/8/1
N2 - The high–resolution infrared spectrum of C2H2D2-cis was recorded for the first time and analyzed in the region of 2400–2700 cm−1, where the ν2+ν6 band is located. 1987 transitions were assigned to the ν2+ν6 band and 623 ro–vibrational energies of the (v2=v6=1) vibrational state were determined from the assigned transitions. Parameters of the effective Hamiltonian were determined from the weighted fit, which takes into account the studied (v2=v6=1) vibrational state and six other closely located (but experimentally here not visible) vibrational states of C2H2D2-cis. The obtained “experimental” energy values were used as initial information in the fit. Determined from the fit, a set of 95 parameters reproduces 623 initial energy values of the (v2=v6=1) vibrational state, representing 1987 line positions of the ν2+ν6 band with the drms=3.98×10−3 cm−1.
AB - The high–resolution infrared spectrum of C2H2D2-cis was recorded for the first time and analyzed in the region of 2400–2700 cm−1, where the ν2+ν6 band is located. 1987 transitions were assigned to the ν2+ν6 band and 623 ro–vibrational energies of the (v2=v6=1) vibrational state were determined from the assigned transitions. Parameters of the effective Hamiltonian were determined from the weighted fit, which takes into account the studied (v2=v6=1) vibrational state and six other closely located (but experimentally here not visible) vibrational states of C2H2D2-cis. The obtained “experimental” energy values were used as initial information in the fit. Determined from the fit, a set of 95 parameters reproduces 623 initial energy values of the (v2=v6=1) vibrational state, representing 1987 line positions of the ν2+ν6 band with the drms=3.98×10−3 cm−1.
KW - High-resolution spectra of CHD-cis
KW - Ro-vibrational resonance interactions
KW - Spectroscopic parameters
KW - ν+ν band of CHD-cis ethylene
UR - http://www.scopus.com/inward/record.url?scp=85066084820&partnerID=8YFLogxK
UR - http://www.scopus.com/inward/citedby.url?scp=85066084820&partnerID=8YFLogxK
U2 - 10.1016/j.jqsrt.2019.05.019
DO - 10.1016/j.jqsrt.2019.05.019
M3 - Article
VL - 233
SP - 99
EP - 109
JO - Journal of Quantitative Spectroscopy and Radiative Transfer
JF - Journal of Quantitative Spectroscopy and Radiative Transfer
SN - 0022-4073
ER -