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Postgrad in Materials Science & Code Develop
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solar-cell-LLM-database
solar-cell-LLM-database Public🌱 Open-source database for perovskite solar cell simulations 📊 Contains computational physics parameters: - Carrier transport models - Energy band diagrams - Layer-specific material properties 📂 Co…
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nebmake-mol
nebmake-mol PublicGenerate VASP NEB starting structures for molecular reorientation in hybrid perovskites using rigid-molecule rotation and framework interpolation.
Python 1
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