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  • MG
  • Brazil
  • 06:21 (UTC -03:00)

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Achievement: Pull SharkAchievement: YOLO

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  1. fix-burai fix-burai Public

    A way to fixer the burai.app.QEFXMain problem for more recents versions of Ubuntu (18.04 or higher)

    Shell 2

  2. auto-rerun-orca-input auto-rerun-orca-input Public

    automation of resubmission of ORCA calculations with problems of imaginary frequencies or other errors.

    Shell 1

  3. old-scripts old-scripts Public

    some old script that I created to my phd

    Shell

  4. neb_visualize neb_visualize Public

    Forked from via9a/neb_visualize

    script to visualize results from an ORCA NEB run

    Python