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Simulating the ghost: quantum dynamics of the solvated electron
The nature of the bulk hydrated electron has been a challenge for both experiment and theory due to its short lifetime and high reactivity, and the need for a high-level of electronic structure theory to achieve predictive accuracy. The lack of a classical atomistic structural formula makes it excee...
Autores principales: | Lan, Jingang, Kapil, Venkat, Gasparotto, Piero, Ceriotti, Michele, Iannuzzi, Marcella, Rybkin, Vladimir V. |
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Formato: | Online Artículo Texto |
Lenguaje: | English |
Publicado: |
Nature Publishing Group UK
2021
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Materias: | |
Acceso en línea: | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC7859219/ https://www.ncbi.nlm.nih.gov/pubmed/33536410 http://dx.doi.org/10.1038/s41467-021-20914-0 |
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