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Understanding high pressure molecular hydrogen with a hierarchical machine-learned potential
The hydrogen phase diagram has several unusual features which are well reproduced by density functional calculations. Unfortunately, these calculations do not provide good physical insights into why those features occur. Here, we present a fast interatomic potential, which reproduces the molecular h...
| Autores principales: | , , |
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| Formato: | Online Artículo Texto |
| Lenguaje: | English |
| Publicado: |
Nature Publishing Group UK
2020
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| Materias: | |
| Acceso en línea: | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC7538439/ https://www.ncbi.nlm.nih.gov/pubmed/33024105 http://dx.doi.org/10.1038/s41467-020-18788-9 |