VIBRONIC ORIGIN OF THE “SKEWED” ANTICLINE CONFIGURATION OF THE HYDROGEN PEROXIDE MOLECULE
The vibronic origin of instability of the symmetrical forms (D¥ h, C2h and C2v) of the hydrogen peroxide molecule H2O2 was revealed using ab initio calculations of the electronic structure and the adiabatic potential energy curves. The vibronic constants in this approach were estimated by fitting of...
| 發表在: | Chemistry Journal of Moldova: General, Industrial and Ecological Chemistry |
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| Main Authors: | , , |
| 格式: | Article |
| 語言: | 英语 |
| 出版: |
Academy of Sciences of Moldova, Institute of Chemistry
2008-06-01
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| 主題: | |
| 在線閱讀: | http://www.cjm.asm.md/sites/default/files/article_files/Gorinchoy%20Vibronic.pdf |