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  1. polymorph polymorph Public

    Generate complex structure files of polymer heterojunctions

    Python 1

  2. kmcTE kmcTE Public

    Calclate thermoelectric transport coeffcients basing on hopping model using kinetic Monte Carlo method

    Python

  3. bloch-electron-transport-pytools bloch-electron-transport-pytools Public

    Small codes to treat CP2K outputs for transport calculations using AMSET

    Python