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Interatomic Potentials Transferability for Molecular Simulations: A Comparative Study for Platinum, Gold and Silver
A perfectly transferable interatomic potential that works for different materials and systems of interest is lacking. This work considers the transferability of several existing interatomic potentials by evaluating their capability at various temperatures, to determine the range of accuracy of these...
| Autores principales: | , |
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| Formato: | Online Artículo Texto |
| Lenguaje: | English |
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Nature Publishing Group UK
2018
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| Acceso en línea: | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC5799210/ https://www.ncbi.nlm.nih.gov/pubmed/29402962 http://dx.doi.org/10.1038/s41598-018-20375-4 |