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@Materials-Computation-Data-Science-MCDC

Materials-Computation-Data-Science-MCDC

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  1. DFT_Stacking_Fault_Energy DFT_Stacking_Fault_Energy Public

    Jupyter Notebook 3

  2. CGCNN_VFE CGCNN_VFE Public

    Jupyter Notebook 1

  3. DFT_Elastic_Constants DFT_Elastic_Constants Public

    Jupyter Notebook 2

  4. LAMMPS_Vac_Form_Energy LAMMPS_Vac_Form_Energy Public

  5. LAMMPS_Vac_Mig_Bar_Energies LAMMPS_Vac_Mig_Bar_Energies Public

  6. DFT_Vac_Form_Energies DFT_Vac_Form_Energies Public

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