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Qiangqiang Gu's Projects

deeptb icon deeptb

DeePTB: A deep learning package for tight-binding approach with ab initio accuracy.

dftio icon dftio

dftio is to assist machine learning communities to transcript DFT output into a format that is easy to read or used by machine learning models.

skext2pythtb icon skext2pythtb

Extension to PythTB enabling to define TB models with Slater-Koster parameters

tbfit icon tbfit

Tight-binding parameter fitting package (TBFIT) for Slater-Koster method

tbplas icon tbplas

Repository of TBPLaS (tight-binding package for large-scale simulation)

tbsoc icon tbsoc

Calculate ab initio spin-orbital coupling strength for Wannier tight-binding models.

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