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  1. Coordinates-of-intermediates-and-transtion-states Coordinates-of-intermediates-and-transtion-states Public

  2. icet-manish icet-manish Public

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  3. deftpy deftpy Public

    Forked from wexlergroup/deftpy

    Forked to prepare a working version of DeftPy. Planning to improve the oxidation state guess for metal oxides with multiple metal oxidation states. Also, working on the coordination number of vacan…

    Python