Machine Learning Accurate Exchange–Correlation Potentials for Reducing Delocalization Error in Density Functional Theory

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Bibliographic Details
Main Authors: Yuan Zhuang, Yonghao Gu, Beini Zhang, Jiang Wu, Guanhua Chen
Format: Article
Language:English
Published: American Chemical Society 2025-07-01
Series:JACS Au
Online Access:https://doi.org/10.1021/jacsau.5c00632
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