Data from "Many-Body Effects in the X-ray Absorption Spectra of Liquid Water"
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https://figshare.com/articles/dataset/Data_from_Many-Body_Effects_in_the_X-ray_Absorption_Spectra_of_Liquid_Water_/17140172/4
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资源简介：
This dataset contains all data related to the publication "Many-Body Effects in the X-ray Absorption Spectra of Liquid Water", by F. Tang et al., 2021. In this work, we used deepmd to generate snapshots of H<sub>2</sub>O, D<sub>2</sub>O at different temperatures. Then we used these snapshots to compute the GW-BSE XAS spectra and the related analysis reported in the paper. This dataset contains links to all software used, all data generated as part of this work, as well as scripts to generate and analyze all data and generate the plots reported in the publication.
提供机构：
figshare
创建时间：
2021-12-10
