Квантово-хімічне моделювання кластерної структури у рідкому N-гептанолі
Different molecular aggregations formed in liquid heptanol due to the hydrogen bonding are investigated. Using the methods of quantum-chemical simulation, the preference of the aggregations involving more than 5 molecules isshown. The correctness of the conclusions is established by the comparison o...
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| Date: | 2012 |
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| Main Authors: | , , |
| Format: | Article |
| Language: | English |
| Published: |
Publishing house "Academperiodika"
2012
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| Subjects: | |
| Online Access: | https://ujp.bitp.kiev.ua/index.php/ujp/article/view/2021328 |
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| Journal Title: | Ukrainian Journal of Physics |