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  1. ChemDASH ChemDASH Public

    Forked from lrcfmd/ChemDASH

    Chemically Directed Atom Swap Hopping -- Crystal structure prediction by swapping atoms in unfavourable chemical environments

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    Chemically Directed Atom Swap Hopping -- Crystal structure prediction by swapping atoms in unfavourable chemical environments with variable composition functionality

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    Forked from skelton-group/Phonopy-Spectroscopy

    A collection of tools for simulating vibrational spectra, which interfaces with the Phonopy package.

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