Improved Theory of the Effective Dipole Moments and Absolute Line Strengths of the XY2 Asymmetric Top Molecules in the X2B1 Doublet Electronic States; International Journal of Molecular Sciences; Vol. 24, iss. 16
| Parent link: | International Journal of Molecular Sciences.— .— Basel: MDPI AG Vol. 24, iss. 16.— 2023.— Article number 12734, 19 p. |
|---|---|
| Další autoři: | , , , , , |
| Shrnutí: | Title screen A new effective dipole moment model for the XY2 (𝐶2𝑣C2v−symmetry) molecule in a doublet electronic state is derived that includes (as special cases) all currently known models of effective dipole moments for such types of molecules, and allows us to take into account the influence of spin–rotation interactions on the effective dipole moment operator that were not considered in the preceding studies. Necessary for the analysis of absolute line strengths, the matrix elements of this dipole moment operator are derived. A comparison with the previous analog models is made and discussed. The efficiency of the obtained results is illustrated, which have been applied to a set of the “forbidden” Δ𝐾𝑎=2ΔKa=2 transitions of the 𝜈3ν3 band of the OClO free radical molecule Текстовый файл |
| Jazyk: | angličtina |
| Vydáno: |
2023
|
| Témata: | |
| On-line přístup: | http://earchive.tpu.ru/handle/11683/132518 https://doi.org/10.3390/ijms241612734 |
| Médium: | Elektronický zdroj Kapitola |
| KOHA link: | https://koha.lib.tpu.ru/cgi-bin/koha/opac-detail.pl?biblionumber=680446 |
MARC
| LEADER | 00000naa0a2200000 4500 | ||
|---|---|---|---|
| 001 | 680446 | ||
| 005 | 20250917143531.0 | ||
| 090 | |a 680446 | ||
| 100 | |a 20250603d2023 k||y0rusy50 ba | ||
| 101 | 0 | |a eng | |
| 102 | |a CH | ||
| 135 | |a drcn ---uucaa | ||
| 181 | 0 | |a i |b e | |
| 182 | 0 | |a b | |
| 183 | 0 | |a cr |2 RDAcarrier | |
| 200 | 1 | |a Improved Theory of the Effective Dipole Moments and Absolute Line Strengths of the XY2 Asymmetric Top Molecules in the X2B1 Doublet Electronic States |f Oleg Ulenikov, Elena Bekhtereva, Olga Gromova [et al.] | |
| 203 | |a Текст |b визуальный |c электронный | ||
| 283 | |a online_resource |2 RDAcarrier | ||
| 300 | |a Title screen | ||
| 320 | |a References: 44 tit | ||
| 330 | |a A new effective dipole moment model for the XY2 (2C2v−symmetry) molecule in a doublet electronic state is derived that includes (as special cases) all currently known models of effective dipole moments for such types of molecules, and allows us to take into account the influence of spin–rotation interactions on the effective dipole moment operator that were not considered in the preceding studies. Necessary for the analysis of absolute line strengths, the matrix elements of this dipole moment operator are derived. A comparison with the previous analog models is made and discussed. The efficiency of the obtained results is illustrated, which have been applied to a set of the “forbidden” Δ=2ΔKa=2 transitions of the 3ν3 band of the OClO free radical molecule | ||
| 336 | |a Текстовый файл | ||
| 461 | 1 | |t International Journal of Molecular Sciences |c Basel |n MDPI AG | |
| 463 | 1 | |t Vol. 24, iss. 16 |v Article number 12734, 19 p. |d 2023 | |
| 610 | 1 | |a asymmetric top molecules in non-singlet electronic states | |
| 610 | 1 | |a spin–rotation interactions | |
| 610 | 1 | |a absolute line strengths | |
| 610 | 1 | |a effective dipole moment operator | |
| 610 | 1 | |a электронный ресурс | |
| 610 | 1 | |a труды учёных ТПУ | |
| 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 |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 |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 |9 17839 | |
| 701 | 1 | |a Kakaulin |b A. N. |c physicist |c Technician of Tomsk Polytechnic University |f 1998- |g Aleksey Nikolaevich |9 22804 | |
| 701 | 1 | |a Sydow |b Ch. |g Christian | |
| 701 | 1 | |a Bauerecker (Bauerekker) |b Z. (S.) H. |c physicist |c Junior researcher at Tomsk Polytechnic University |f 1960- |g Zigurd (Sigurd) Hermann |9 20429 | |
| 801 | 0 | |a RU |b 63413507 |c 20250603 | |
| 850 | |a 63413507 | ||
| 856 | 4 | |u http://earchive.tpu.ru/handle/11683/132518 |z http://earchive.tpu.ru/handle/11683/132518 | |
| 856 | 4 | |u https://doi.org/10.3390/ijms241612734 |z https://doi.org/10.3390/ijms241612734 | |
| 942 | |c CF | ||