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shengbte
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🔧 Python package for 3rd/4th-order force constant calculation via finite displacement method, with ML potential support & thermal disorder generation.
phonopy phonon mlp mace dp nep shengbte ase hiphive thirdorder fourthorder forceconstants fourthphonon
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Oct 14, 2026 - Python
Commands to run VASP jobs automatically. Pre-processing or post-processing
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Jan 8, 2024 - Python
Anisotropic in-plane thermal conductivity observed in multilayer silicene
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Jan 15, 2018 - TeX
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