WEKO3
アイテム
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Calculation of non-adiabatic coupling matrix elements in the molecular orbital expansion method
http://hdl.handle.net/10083/857
http://hdl.handle.net/10083/85775b887ed-f148-41c3-ac61-8917dc4d4ee9
名前 / ファイル | ライセンス | アクション |
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KJ00004470896.pdf (868.5 kB)
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Item type | 紀要論文 / Departmental Bulletin Paper(1) | |||||
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公開日 | 2007-04-23 | |||||
タイトル | ||||||
タイトル | Calculation of non-adiabatic coupling matrix elements in the molecular orbital expansion method | |||||
言語 | ||||||
言語 | eng | |||||
資源タイプ | ||||||
資源 | http://purl.org/coar/resource_type/c_6501 | |||||
タイプ | departmental bulletin paper | |||||
著者 |
Watanabe, Ayako
× Watanabe, Ayako× Suzuki, Reiko× Sato, Hiroshi× Kimura, Mineo |
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著者(ヨミ) | ||||||
識別子 | 70647 | |||||
識別子Scheme | WEKO | |||||
姓名 | ワタナベ, アヤコ | |||||
著者(ヨミ) | ||||||
識別子 | 70648 | |||||
識別子Scheme | WEKO | |||||
姓名 | スズキ, レイコ | |||||
著者(ヨミ) | ||||||
識別子 | 70649 | |||||
識別子Scheme | WEKO | |||||
姓名 | サトウ, ヒロシ | |||||
著者(ヨミ) | ||||||
識別子 | 70650 | |||||
識別子Scheme | WEKO | |||||
姓名 | キムラ, ミネオ | |||||
内容記述 | ||||||
内容記述タイプ | Other | |||||
内容記述 | Calculation of adiabatic potentials and corresponding non-adiabatic coupling matrix elements has been carried out rigorously for HLi^+ system by using the ALCHEMY. The adiabatic potentials and some of the coupling matrix elements are compared with those previously obtained, and are found to be in good agreement. For some states, however, the present results are found to be more in the high precision. We have carried out the preliminary study of collision dynamics by solving the coupled equation derived, and some tentative results are included. | |||||
書誌情報 |
お茶の水女子大學自然科學報告 巻 49, 号 2, p. 33-50, 発行日 1998-12-30 |
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ISSN | ||||||
収録物識別子タイプ | ISSN | |||||
収録物識別子 | 00298190 | |||||
書誌レコードID | ||||||
収録物識別子タイプ | NCID | |||||
収録物識別子 | AN00033958 | |||||
フォーマット | ||||||
内容記述タイプ | Other | |||||
内容記述 | application/pdf | |||||
形態 | ||||||
868491 bytes | ||||||
日本十進分類法 | ||||||
主題Scheme | NDC | |||||
主題 | 400 | |||||
出版者 | ||||||
出版者 | お茶の水女子大学 | |||||
資源タイプ | ||||||
内容記述タイプ | Other | |||||
内容記述 | 紀要論文 | |||||
資源タイプ・ローカル | ||||||
紀要論文 | ||||||
資源タイプ・NII | ||||||
Departmental Bulletin Paper | ||||||
資源タイプ・DCMI | ||||||
text | ||||||
資源タイプ・ローカル表示コード | ||||||
03 | ||||||
所属 | ||||||
Department of Information Sciences, Ochanomizu University | ||||||
所属 | ||||||
Computer Center, Hitotsubashi University | ||||||
所属 | ||||||
Graduate School of Humanities and Sciences, Ochanomizu University | ||||||
所属 | ||||||
School of Allied Health Sciences, Yamaguchi University |