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@m2qm-efrc

Center for Molecular Magnetic Quantum Materials

An Energy Frontier Research Centers (EFRC) established by DOE.

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  1. SB SB Public

    Forked from Dmitry-Skachkov/SB

    First-Principles Method for Schottky Barrier

    Fortran 2

  2. Crystal-Field-Mn12-C6H4F Crystal-Field-Mn12-C6H4F Public

    Forked from Dmitry-Skachkov/Crystal-Field-Mn12-C6H4F

    Electric field in Mn12 –C6H4F crystal

    Fortran 1

  3. transform_Bkq transform_Bkq Public

    Transform the crystal field parameters Bkq for extended Stevens operators when the reference frame is rotated.

    Python 1

  4. clock_eseem clock_eseem Public

    Python

  5. SMM-Mn12 SMM-Mn12 Public

    Forked from Dmitry-Skachkov/SMM-Mn12

    SMM Mn12

  6. SCOcopilot SCOcopilot Public

    Forked from amalbavera/SCOcopilot

    Spin-Crossover copilot based on an Equivariant Graph Convolutional Neural Network

    Python

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