Fast Quantum Approach for Evaluating the Energy of Non-Covalent Interactions in Molecular Crystals: The Case Study of Intermolecular H-Bonds in Crystalline Peroxosolvates.
| Autor: | Medvedev, Alexander G.1 (AUTHOR) mag@igic.ras.ru, Churakov, Andrei V.1 (AUTHOR) churakov@igic.ras.ru, Navasardyan, Mger A.1 (AUTHOR) navasardyan@igic.ras.ru, Prikhodchenko, Petr V.1 (AUTHOR) prikhman@gmail.com, Lev, Ovadia2 (AUTHOR) ovadia@mail.huji.ac.il, Vener, Mikhail V.1 (AUTHOR) vener@igic.ras.ru |
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| Zdroj: | Molecules. Jul2022, Vol. 27 Issue 13, p4082-N.PAG. 17p. |
| Databáze: | Academic Search Ultimate |
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