q-posev (Evgeny) · GitHub
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@TREX-CoE

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q-posev/README.md

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  1. TREX-CoE/trexio TREX-CoE/trexio Public

    TREX I/O library

    C 71 23

  2. TREX-CoE/trexio_tools TREX-CoE/trexio_tools Public

    Set of tools for trexio files

    Python 20 11

  3. TREX-CoE/qmckl TREX-CoE/qmckl Public

    Quantum Monte Carlo Kernel Library

    C 40 16

  4. dftlibs-qmckl-demo dftlibs-qmckl-demo Public

    Jupyter notebooks demonstrating the use of open-source libraries for DFT calculations.

    1 1

  5. qp2-singularity qp2-singularity Public

    Definition files to build Singularity containers with Quantum Package

    Shell 7 3

  6. hdf5-on-manylinux hdf5-on-manylinux Public

    Docker containers for producing manylinux wheels with HDF5 library

    Shell