Electron affinity of liquid water

The electron affinity of liquid water is a fundamental property which has not yet been accurately measured. Here, the authors predict this property by coupling path-integral molecular dynamics with ab initio potentials and electronic structure calculations, revisiting several estimates used in the l...

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Auteurs principaux: Alex P. Gaiduk, Tuan Anh Pham, Marco Govoni, Francesco Paesani, Giulia Galli
Format: article
Langue:EN
Publié: Nature Portfolio 2018
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Accès en ligne:https://doaj.org/article/65e0cd93841845a88d3fa1af5868f5b5
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