Competitive nuclear quantum effect and H/D isotope effect on torsional motion of H2O2: An ab initio path integral molecular dynamics study
| العنوان: | Competitive nuclear quantum effect and H/D isotope effect on torsional motion of H2O2: An ab initio path integral molecular dynamics study |
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| المؤلفون: | Taro Udagawa, Kazuaki Kuwahata, Masanori Tachikawa |
| المصدر: | Computational and Theoretical Chemistry. 1208:113542 |
| بيانات النشر: | Elsevier B.V., 2022. |
| سنة النشر: | 2022 |
| مصطلحات موضوعية: | Physical and Theoretical Chemistry, Condensed Matter Physics, Biochemistry |
| اللغة: | English |
| تدمد: | 2210-271X |
| الوصول الحر: | https://explore.openaire.eu/search/publication?articleId=doi_dedup___::45dfb678db56c447680cf4ad0ccd54f0Test http://hdl.handle.net/20.500.12099/88992Test |
| حقوق: | CLOSED |
| رقم الانضمام: | edsair.doi.dedup.....45dfb678db56c447680cf4ad0ccd54f0 |
| قاعدة البيانات: | OpenAIRE |
| تدمد: | 2210271X |
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