このアイテムのアクセス数: 37
このアイテムのファイル:
| ファイル | 記述 | サイズ | フォーマット | |
|---|---|---|---|---|
| j.jqsrt.2022.108229.pdf | 1.35 MB | Adobe PDF | 見る/開く |
完全メタデータレコード
| DCフィールド | 値 | 言語 |
|---|---|---|
| dc.contributor.author | Sunaga, Ayaki | en |
| dc.contributor.author | Fleig, Timo | en |
| dc.contributor.alternative | 砂賀, 彩光 | ja |
| dc.date.accessioned | 2022-05-31T05:47:47Z | - |
| dc.date.available | 2022-05-31T05:47:47Z | - |
| dc.date.issued | 2022-09 | - |
| dc.identifier.uri | http://hdl.handle.net/2433/274132 | - |
| dc.description.abstract | The TaO⁺ cation is an attractive molecular species to search for parity- and time-reversal-violating interactions, in particular of hadronic origin. For the spectroscopic detection and preparation of TaO⁺ cation in a desired state detailed knowledge of spectroscopic and electric properties in excited states is essential information. In this work we present spectroscopy constants for TaO⁺ in the electronic ground and 29 excited states calculated with relativistic configuration interaction theory. The equilibrium bond lengths (We), harmonic vibrational frequencies (Re), transition dipole moments (TDM), vertical excitation energies and static molecular dipole moments (PDM) are summarized. We include a detailed characterization of all electronic states in terms of their spinor occupations. This work supports the realization of experiments using TaO⁺ ions to search for new physics beyond the standard model of elementary particles. | en |
| dc.language.iso | eng | - |
| dc.publisher | Elsevier BV | en |
| dc.rights | © 2022. This manuscript version is made available under the CC-BY-NC-ND 4.0 license https://creativecommons.org/licenses/by-nc-nd/4.0/ | en |
| dc.rights | The full-text file will be made open to the public on 1 September 2024 in accordance with publisher's 'Terms and Conditions for Self-Archiving'. | en |
| dc.rights | This is not the published version. Please cite only the published version. この論文は出版社版でありません。引用の際には出版社版をご確認ご利用ください。 | en |
| dc.rights.uri | https://creativecommons.org/licenses/by-nc-nd/4.0/ | - |
| dc.subject | Relativistic correlated calculation | en |
| dc.subject | Molecular spectroscopy | en |
| dc.subject | Heavy diatomic molecule | en |
| dc.subject | Large-scale investigation of excited states | en |
| dc.subject | BSM Physics | en |
| dc.title | Spectroscopic and Electric Properties of the TaO⁺ Molecule Ion for the Search of New Physics: A Platform for Identification and State Control | en |
| dc.type | journal article | - |
| dc.type.niitype | Journal Article | - |
| dc.identifier.jtitle | Journal of Quantitative Spectroscopy and Radiative Transfer | en |
| dc.identifier.volume | 288 | - |
| dc.relation.doi | 10.1016/j.jqsrt.2022.108229 | - |
| dc.textversion | author | - |
| dc.identifier.artnum | 108229 | - |
| dcterms.accessRights | embargoed access | - |
| datacite.date.available | 2024-09-01 | - |
| datacite.awardNumber | 17J02767 | - |
| datacite.awardNumber | 20K22553 | - |
| datacite.awardNumber | 21K14643 | - |
| datacite.awardNumber.uri | https://kaken.nii.ac.jp/ja/grant/KAKENHI-PROJECT-17J02767/ | - |
| datacite.awardNumber.uri | https://kaken.nii.ac.jp/ja/grant/KAKENHI-PROJECT-20K22553/ | - |
| datacite.awardNumber.uri | https://kaken.nii.ac.jp/ja/grant/KAKENHI-PROJECT-21K14643/ | - |
| dc.identifier.pissn | 0022-4073 | - |
| jpcoar.funderName | 日本学術振興会 | ja |
| jpcoar.funderName | 日本学術振興会 | ja |
| jpcoar.funderName | 日本学術振興会 | ja |
| jpcoar.awardTitle | QED効果を考慮した高精度電子状態理論の開発 --新規素粒子理論構築を目指して-- | ja |
| jpcoar.awardTitle | 相対論的量子化学を用いたアクチノイド化合物の化学結合解析 | ja |
| jpcoar.awardTitle | 金属錯体の配位子場分裂における相対論効果 : 重元素化学における理論基盤の創生 | ja |
| 出現コレクション: | 学術雑誌掲載論文等 | |
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