DefectDB — open-source, ML-accelerated defect thermodynamics platform for II-VI (Cd/Zn-S/Se/Te) semiconductors: DFT defect dataset, MLFFs, and an interactive nanoHUB tool
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Updated
Aug 19, 2026 - Jupyter Notebook
DefectDB — open-source, ML-accelerated defect thermodynamics platform for II-VI (Cd/Zn-S/Se/Te) semiconductors: DFT defect dataset, MLFFs, and an interactive nanoHUB tool
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