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materials-chemistry

Here are 5 public repositories matching this topic...

aronwalsh / MLforMaterials

Online resource for a practical course in machine learning for materials research at Imperial College London (MATE70026)

machine-learning materials-science materials-informatics materials-chemistry

Updated Aug 14, 2024
Jupyter Notebook

aronwalsh / Crystallography

Online resource for introduction to crystallography at Imperial College London (MATE40004)

crystallography materials-science materials-chemistry

Updated Nov 8, 2022
Jupyter Notebook

darkreactions / ESCALATE_Capture

Data capture and experimental interfacing software for chemistry (part 1 of 2)

chemistry cheminformatics informatics dataset-generation materials-informatics materials-chemistry

Updated Jun 21, 2022
Python

robertcdickson / AutoVaspPy

A Python module to facilitate high-throughput VASP calculations

python3 vasp materials-science materials-chemistry dft-calculations

Updated Aug 10, 2022
Python

tk-randhawa / Calculating-Optimal-Perovskite-Crystal-Structures

Project from Summer 2021 Research Internship @ Stanford

computational-chemistry materials-science materials-chemistry

Updated Dec 5, 2022
Jupyter Notebook

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