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Molecular Dynamics Simulations of Nitrate/MgO Interfaces and Understanding Metastability of Thermochemical Materials
[Image: see text] We explore the role of molten nitrate interfaces on MgO surface treatment for improving the reversibility of thermochemical energy storage via sorption and desorption of water or CO(2). Our molecular dynamics simulations focus on melts of LiNO(3), NaNO(3), KNO(3), and the triple eu...
| Autores principales: | , , |
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| Formato: | Online Artículo Texto |
| Lenguaje: | English |
| Publicado: |
American Chemical Society
2022
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| Acceso en línea: | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC9118408/ https://www.ncbi.nlm.nih.gov/pubmed/35601303 http://dx.doi.org/10.1021/acsomega.2c00095 |