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Fermi Lab
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CALPHAD-data-analysis
CALPHAD-data-analysis PublicThis repository contains all the necessary codes and script used for running CALPHAD and also post processing huge amount of data generated.
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DOS_plots
DOS_plots PublicContains codes for making DOS plots from files generated using different packages such as VASPKIT, Pymatgen and plotting DOS manually from VASP generated files.
Python
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Stacking-fault-energy-codes
Stacking-fault-energy-codes PublicContains all the necessary code for making files, running simulations, post-processing results, etc for the stacking fault energy.
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Thermal_properties_using_phono3py_VASP
Thermal_properties_using_phono3py_VASP PublicThis repository contains codes which can be used to extract thermal properties of materials using phono3py. All the documents included are written based on various resources taken from the internet…
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Machine-learning-potentials-MLIP-code
Machine-learning-potentials-MLIP-code PublicAll the updates and information required for building machine learning potentials using MLIP code are shared in the repository.
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General-codes-and-scripts
General-codes-and-scripts PublicThis repository contains all codes and scripts for general use.
Jupyter Notebook
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