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IISER Bhopal
Highlights
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Quantum-ESPRESSO-scripts
Quantum-ESPRESSO-scripts PublicPython scripts to postprocess Quantum Espresso calclations.
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ASEAtoms.jl
ASEAtoms.jl PublicWrapper around ASE Atoms object following the AtomsBase interface
Julia
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AtomsParsers.jl
AtomsParsers.jl PublicParsers for various molecular or crystal structure formats
Julia 1
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