DeePTB: A deep learning package for tight-binding approach with ab initio accuracy.
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Updated
Dec 24, 2024 - Python
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slater-koster
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Scientific Python package for solving Slater Koster tight-binding topological hamiltonian
python topology dft physics quantum band-structure tight-binding computational-physics hamiltonian electronic-structure electronic-structure-calculations topological-insulator ase condensed pymatgen slater-koster atomic-simulation-environment topological-insulators
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Sep 19, 2023 - Python
Tight-binding parameter fitting package (TBFIT) for Slater-Koster method
tight-binding fitting quantum-chemistry particle-swarm-optimization conformational-space-annealing levenberg-marquardt-algorithm slater-koster
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Sep 11, 2022 - Fortran
Basic programs for generating Slater-Koster files for the DFTB-method
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Dec 18, 2024 - Fortran
General purpose Slater-Koster tight-binding library for electronic structure calculations
python topology simulation physics band-structure tight-binding disorder solid-state-physics electronic-structure alloys condensed-matter-physics slater-koster dft-fit
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Feb 1, 2024 - Python
DeePTB: A deep learning package for tight-binding approach with ab initio accuracy.
machine-learning dft density-functional-theory tight-binding hamiltonian slater-koster density-matrix
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Updated
Dec 24, 2024 - Python
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