Published June 17, 2015
| Version v1
Dataset
Open
How many water molecules does it take to dissociate HCl?
Creators
- 1. Imperial College London
- 2. Departamento de Física Aplicada, Centro de Investigación y de Estudios Avanzados, Unidad Mérida
Description
The potential energy surface of HCl/water clusters with two water molecules, with molecular geometry and vibrational frequencies obtained at the CCSD(T) level using a Def2-TZVP basis.
Files
Files
(59.4 MB)
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8.8 MB | Download |
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