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"Overcoming the barrier of orbital-free density functional theory for ..."

He Zhang et al. (2024)

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DOI: 10.1038/S43588-024-00605-8

access: closed

type: Journal Article

metadata version: 2024-04-15

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  - https://dblp.org/rec/journals/ncs/ZhangLY0ZL00S24
He Zhang, Siyuan Liu, Jiacheng You, Chang Liu, Shuxin Zheng, Ziheng Lu, Tong Wang, Nanning Zheng, Bin Shao:
Overcoming the barrier of orbital-free density functional theory for molecular systems using deep learning. Nat. Comput. Sci. 4(3): 210-223 (2024)

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