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DeePTB Public
Forked from deepmodeling/DeePTBDeePTB: A deep learning package for tight-binding approach with ab initio accuracy.
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dftio Public
Forked from deepmodeling/dftiodftio is to assist machine learning communities to transcript DFT output into a format that is easy to read or used by machine learning models.
Jupyter Notebook MIT License UpdatedSep 13, 2024 -
tbplas Public
Forked from deepmodeling/tbplasRepository of TBPLaS (tight-binding package for large-scale simulation)
Other UpdatedMar 12, 2024 -
TBSOC Public
Calculate ab initio spin-orbital coupling strength for Wannier tight-binding models.
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abacus-test Public
Forked from pxlxingliang/abacus-testdo the performance test of ABACUS
Python UpdatedOct 31, 2023 -
AlgorithmEngineering Public
Introductions to engineer algorithms for DPLC.
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TBFIT Public
Forked from Infant83/TBFITTight-binding parameter fitting package (TBFIT) for Slater-Koster method
Fortran GNU General Public License v3.0 UpdatedSep 11, 2022 -
SKext2PythTB Public
Forked from TomushT/SKext2PythTBExtension to PythTB enabling to define TB models with Slater-Koster parameters
Python UpdatedJun 21, 2021