Erroneous behaviour of the widely used MP2(full)/aug-cc-pVXZ (X = D,T) level of theory for evaluating the BSSE in ion–π complexes
| Autor: | Estarellas, Carolina, Lucas, Xavier, Frontera, Antonio, Quiñonero, David, Deyà, Pere M. |
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| Zdroj: | In Chemical Physics Letters 2010 489(4):254-258 |
| Databáze: | ScienceDirect |
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