Extended analysis of the FTIR high-resolution spectrum of D232S in the region of the ν2 band; Journal of Quantitative Spectroscopy and Radiative Transfer; Vol. 224
| Parent link: | Journal of Quantitative Spectroscopy and Radiative Transfer Vol. 224.— 2019.— [P. 460-473] |
|---|---|
| Coauteur: | |
| Andere auteurs: | , , , , , , |
| Samenvatting: | Title screen The high resolution infrared spectra of dideuterated hydrogen sulfide D2S were recorded with a Bruker IFS 125HR Fourier transform infrared spectrometer (Zürich prototype ZP2001) and analyzed in the ν2 fundamental band region, 750-1200 cm−1. The 1742 transitions (which is more than two times more than in the preceding analogous studies) were assigned in the experimental spectra to the ν2 band (the maximum values of the quantum numbers are Jmax=30 and Kamax=21). The subsequent weighted fit of experimentally assigned transitions was made with the Watson Hamiltonian, resulting in a set of 34 parameters which reproduces the initial 535 infrared ro-vibrational energy values from 1742 experimental line positions with a root mean square deviation drms=1.31×10−4 cm−1. An analysis of 280 experimental ro-vibrational line intensities (324 transitions) of the ν2 band was made using the Hartmann-Tran profile of individual lines, and the results were applied then in the fit of parameters of the effective dipole moment operator. Isotopic relations for the dipole moment parameters were derived and used for the fit procedure. The obtained “model dependent” parameters reproduce the initial line strengths with the drms=2.5%. A list of 1742 experimental transitions of D2S is generated together with the presentation of their individual line strengths calculated on the basis of the obtained effective dipole moment parameters. Режим доступа: по договору с организацией-держателем ресурса |
| Taal: | Engels |
| Gepubliceerd in: |
2019
|
| Onderwerpen: | |
| Online toegang: | https://doi.org/10.1016/j.jqsrt.2018.12.007 |
| Formaat: | Elektronisch Hoofdstuk |
| KOHA link: | https://koha.lib.tpu.ru/cgi-bin/koha/opac-detail.pl?biblionumber=660071 |
MARC
| LEADER | 00000naa0a2200000 4500 | ||
|---|---|---|---|
| 001 | 660071 | ||
| 005 | 20250328160544.0 | ||
| 035 | |a (RuTPU)RU\TPU\network\28993 | ||
| 090 | |a 660071 | ||
| 100 | |a 20190422d2019 k||y0rusy50 ba | ||
| 101 | 0 | |a eng | |
| 102 | |a NL | ||
| 135 | |a drcn ---uucaa | ||
| 181 | 0 | |a i | |
| 182 | 0 | |a b | |
| 200 | 1 | |a Extended analysis of the FTIR high-resolution spectrum of D232S in the region of the ν2 band |f C. Sydow, O. N. Ulenekov (Ulenikov), E. S. Bekhtereva [et al.] | |
| 203 | |a Text |c electronic | ||
| 300 | |a Title screen | ||
| 320 | |a [References: 91 tit.] | ||
| 330 | |a The high resolution infrared spectra of dideuterated hydrogen sulfide D2S were recorded with a Bruker IFS 125HR Fourier transform infrared spectrometer (Zürich prototype ZP2001) and analyzed in the ν2 fundamental band region, 750-1200 cm−1. The 1742 transitions (which is more than two times more than in the preceding analogous studies) were assigned in the experimental spectra to the ν2 band (the maximum values of the quantum numbers are Jmax=30 and Kamax=21). The subsequent weighted fit of experimentally assigned transitions was made with the Watson Hamiltonian, resulting in a set of 34 parameters which reproduces the initial 535 infrared ro-vibrational energy values from 1742 experimental line positions with a root mean square deviation drms=1.31×10−4 cm−1. An analysis of 280 experimental ro-vibrational line intensities (324 transitions) of the ν2 band was made using the Hartmann-Tran profile of individual lines, and the results were applied then in the fit of parameters of the effective dipole moment operator. Isotopic relations for the dipole moment parameters were derived and used for the fit procedure. The obtained “model dependent” parameters reproduce the initial line strengths with the drms=2.5%. A list of 1742 experimental transitions of D2S is generated together with the presentation of their individual line strengths calculated on the basis of the obtained effective dipole moment parameters. | ||
| 333 | |a Режим доступа: по договору с организацией-держателем ресурса | ||
| 461 | |t Journal of Quantitative Spectroscopy and Radiative Transfer | ||
| 463 | |t Vol. 224 |v [P. 460-473] |d 2019 | ||
| 610 | 1 | |a электронный ресурс | |
| 610 | 1 | |a труды учёных ТПУ | |
| 610 | 1 | |a D2S high resolution spectra | |
| 610 | 1 | |a v2 band: line positions and strengths | |
| 610 | 1 | |a spectroscopic parameters | |
| 610 | 1 | |a спектры высокого разрешения | |
| 610 | 1 | |a спектроскопические параметры | |
| 701 | 1 | |a Sydow |b C. |g Christian | |
| 701 | 1 | |a Ulenekov (Ulenikov) |b O. N. |c physicist |c Professor of Tomsk Polytechnic University, Doctor of physical and mathematical sciences |f 1949- |g Oleg Nikolaevich |3 (RuTPU)RU\TPU\pers\34331 |9 17837 | |
| 701 | 1 | |a Bekhtereva |b E. S. |c physicist |c Professor of Tomsk Polytechnic University, Doctor of physical and mathematical sciences |f 1974- |g Elena Sergeevna |3 (RuTPU)RU\TPU\pers\34450 |9 17851 | |
| 701 | 1 | |a Gromova |b O. V. |c physicist |c Professor of Tomsk Polytechnic University, Candidate of physical and mathematical sciences |f 1982- |g Olga Vasilievna |3 (RuTPU)RU\TPU\pers\34333 |9 17839 | |
| 701 | 1 | |a Glushkov |b P. A. |c physicist |c technician of Tomsk Polytechnic University |f 1998- |g Petr Alekseevich |3 (RuTPU)RU\TPU\pers\46750 | |
| 701 | 1 | |a Maul |b C. |g Christof | |
| 701 | 1 | |a Bauerecker |b S. |g Sigurd | |
| 712 | 0 | 2 | |a Национальный исследовательский Томский политехнический университет |b Исследовательская школа физики высокоэнергетических процессов |c (2017- ) |3 (RuTPU)RU\TPU\col\23551 |
| 801 | 2 | |a RU |b 63413507 |c 20210205 |g RCR | |
| 856 | 4 | |u https://doi.org/10.1016/j.jqsrt.2018.12.007 | |
| 942 | |c CF | ||