PhD Candidate @ CMT group Tsinghua Univ.
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Tsinghua University
- Beijing, China
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DeepH-hybrid Public
Additional code for carrying out neural network modeling of hybrid DFT Hamiltonians (arxiv.org/abs/2302.08221)
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DeepH-pack Public
Forked from mzjb/DeepH-packDeep neural networks for density functional theory Hamiltonian. Branch created by Tang ZC @ Tsinghua Univ.
Python GNU Lesser General Public License v3.0 UpdatedMay 6, 2024 -
AiM3G Public
Forked from kYangLi/AiM3GAiM3G: An ultra-efficient, compact, and powerful AIRSS+M3GNet atomic structure searching tool!
Python GNU General Public License v2.0 UpdatedMar 27, 2023 -
QC-DMET Public
Forked from SebWouters/QC-DMETQC-DMET: a python implementation of density matrix embedding theory for ab initio quantum chemistry
Python Other UpdatedOct 2, 2020 -