Learning a reactive potential for silica-water through uncertainty attribution
Abstract The reactivity of silicates in aqueous solution is relevant to various chemistries ranging from silicate minerals in geology, to the C-S-H phase in cement, nanoporous zeolite catalysts, or highly porous precipitated silica. While simulations of chemical reactions can provide insight at the...
| Glavni autori: | , , , , |
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| Format: | Članak |
| Jezik: | English |
| Izdano: |
Nature Portfolio
2024-07-01
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| Serija: | Nature Communications |
| Online pristup: | https://doi.org/10.1038/s41467-024-50407-9 |