Calculation of infrared transition probabilities for the 1Σ+groundstate of XeH+
- Near equilibrium potential energy and dipole moment functions have been calculated for the electronic ground state of the XeH+ ion from highly correlated SCEP/CEPA electronic wavefunctions. The following spectroscopic constants for 132XeH+ are obtained: Re= 1.611 ± 0.005 Å, ωe = 2313 ± 50cm-1, ωexe = 41 ± 5cm-1 and D0(Xe+ + H) = 3.90 ± 0.1 eV. Infrared transition dipole matrix elements and probability coefficients for 132XeH+ and 132XeD+ are given. The electric dipole moment functions of the protonated rare gas atoms HeH+ to XeH+ are discussed.
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| Author: | Robert Klein, Pavel Rosmus |
|---|---|
| URN: | urn:nbn:de:hebis:30:3-742342 |
| DOI: | https://doi.org/10.1515/zna-1984-0405 |
| ISSN: | 1865-7109 |
| Parent Title (German): | Zeitschrift für Naturforschung, A |
| Publisher: | Verlag der Zeitschrift für Naturforschung |
| Place of publication: | Tübingen |
| Document Type: | Article |
| Language: | English |
| Date of Publication (online): | 2014/06/02 |
| Year of first Publication: | 1984 |
| Publishing Institution: | Universitätsbibliothek Johann Christian Senckenberg |
| Release Date: | 2023/06/26 |
| Volume: | 39 |
| Issue: | 4 |
| Page Number: | 5 |
| First Page: | 349 |
| Last Page: | 353 |
| HeBIS-PPN: | 51076066X |
| Institutes: | Biochemie, Chemie und Pharmazie / Biochemie und Chemie |
| Dewey Decimal Classification: | 5 Naturwissenschaften und Mathematik / 54 Chemie / 540 Chemie und zugeordnete Wissenschaften |
| Sammlungen: | Universitätspublikationen |
| Licence (German): |  Creative Commons - Namensnennung-Nicht kommerziell-Keine Bearbeitung 3.0 |
