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lgpl-3.0

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

dft hamiltonian slater-koster tight-binding machine-learning

Created 2023-07-11

771 commits to main branch, last one 7 days ago

gpl-3.0

Scientific Python package for solving Slater Koster tight-binding topological hamiltonian

ase dft python physics quantum pymatgen topology condensed hamiltonian slater-koster tight-binding band-structure electronic-structure computational-physics topological-insulator topological-insulators atomic-simulation-environment electronic-structure-calculations

Created 2020-04-12

91 commits to master branch, last one about a year ago