Skip to content
@SCM-NV

SCM - Software for Chemistry and Materials

Pinned Loading

  1. PLAMS PLAMS Public

    Python Library for Automating Molecular Simulations

    Python 67 24

  2. ftl ftl Public

    The Fortran Template Library

    Fortran 114 13

  3. amspipe amspipe Public

    a library that implements the worker side of the AMS pipe protocol

    C++

Repositories

Showing 10 of 11 repositories
  • PLAMS Public

    Python Library for Automating Molecular Simulations

    SCM-NV/PLAMS’s past year of commit activity
    Python 67 24 1 5 Updated Nov 19, 2024
  • json-fortran Public Forked from jacobwilliams/json-fortran

    A Modern Fortran JSON API

    SCM-NV/json-fortran’s past year of commit activity
    Fortran 0 89 0 0 Updated Jul 23, 2024
  • ftl Public

    The Fortran Template Library

    SCM-NV/ftl’s past year of commit activity
    Fortran 114 GPL-3.0 13 7 1 Updated Jul 23, 2024
  • nano-qmflows Public

    Package containing several workflows to compute molecular properties for nanomaterials

    SCM-NV/nano-qmflows’s past year of commit activity
    Python 10 Apache-2.0 10 8 5 Updated Jun 28, 2024
  • pyZacros Public

    Python Library for Automating Zacros Simulations

    SCM-NV/pyZacros’s past year of commit activity
    Python 7 2 0 0 Updated Mar 28, 2024
  • amspipe Public

    a library that implements the worker side of the AMS pipe protocol

    SCM-NV/amspipe’s past year of commit activity
    C++ 0 MIT 0 0 0 Updated Mar 15, 2024
  • qmflows Public

    This library tackles the construction and efficient execution of computational chemistry workflows

    SCM-NV/qmflows’s past year of commit activity
    Python 45 9 1 3 Updated Feb 1, 2024
  • dftd3-lib Public Forked from dftbplus/dftd3-lib

    Library version of S. Grimmes DFTD3 code.

    SCM-NV/dftd3-lib’s past year of commit activity
    Fortran 0 4 0 0 Updated Feb 11, 2019
  • SPGL1_python_port Public Forked from drrelyea/spgl1

    Port of SPGL1 to python

    SCM-NV/SPGL1_python_port’s past year of commit activity
    Python 1 LGPL-2.1 29 0 0 Updated Feb 8, 2018
  • qmflows_examples Public

    Computational chemistry workflow examples using the QMFlows package

    SCM-NV/qmflows_examples’s past year of commit activity
    Python 1 Apache-2.0 0 0 0 Updated Jan 30, 2018
View all repositories

Top languages

Loading…

Most used topics

Loading…