Molecular dynamics and DFT studies of intermolecular hydrogen bonds between bifunctional heteroazaaromatic molecules and hydroxylic solvents.
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| Title: | Molecular dynamics and DFT studies of intermolecular hydrogen bonds between bifunctional heteroazaaromatic molecules and hydroxylic solvents. |
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| Authors: | Kyrychenko, A., Stepanenko, Y., Waluk, J. |
| Source: | Journal of Physical Chemistry A; October 26 2000, Vol. 104 Issue 42, p9542-9555, 14p |
| Database: | Applied Science & Technology Source |
| ISSN: | 10895639 |
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| DOI: | 10.1021/jp000921w |
