Replication Data for: Interactions of palladium with amidet and palladium with odt
They are the data carried out from a study for quantum simulations using current molecular dynamics methods, thanks to Vasp, Gaussian and the Monte Carlo method. The energies of the palladium cell, the surfactants and the interactions with them have been obtained, in the absence of temperature or ot...
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| Format: | Dataset |
| Sprache: | eng |
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| Online-Zugang: | Volltext bestellen |
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| Zusammenfassung: | They are the data carried out from a study for quantum simulations using current molecular dynamics methods, thanks to Vasp, Gaussian and the Monte Carlo method. The energies of the palladium cell, the surfactants and the interactions with them have been obtained, in the absence of temperature or other substances. |
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| DOI: | 10.7910/dvn/ekofhk |