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@FitSNAP

FitSNAP

Software and Information Related to Machine Learned Interatomic Potentials in LAMMPS

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  1. FitSNAP FitSNAP Public

    Software for generating machine-learning interatomic potentials for LAMMPS

    Python 149 55

  2. TestSNAP TestSNAP Public

    SNAP Proxy app

    C 5 5

  3. fitsnap.github.io fitsnap.github.io Public

    Software and information related to SNAP and FitSNAP

    HTML 2 1

  4. active-learning active-learning Public

    FitSnap scripts for active learning workflows.

    Python 2 1

  5. lammps lammps Public

    Forked from lammps/lammps

    Public development project of the LAMMPS MD software package

    C++

  6. fitsnap-datasets fitsnap-datasets Public

    Repo for housing training sets

    AMPL 3

Repositories

Showing 10 of 11 repositories
  • FitSNAP Public

    Software for generating machine-learning interatomic potentials for LAMMPS

    FitSNAP/FitSNAP’s past year of commit activity
    Python 149 GPL-2.0 55 14 8 Updated Sep 19, 2024
  • workflow-workups Public

    Collaborative repo for testing early-stage workflow ideas for FitSNAP/fitting MLIAPs.

    FitSNAP/workflow-workups’s past year of commit activity
    Python 0 0 0 0 Updated Nov 29, 2023
  • fitsnap.github.io Public

    Software and information related to SNAP and FitSNAP

    FitSNAP/fitsnap.github.io’s past year of commit activity
    HTML 2 1 0 0 Updated Sep 8, 2023
  • active-learning Public

    FitSnap scripts for active learning workflows.

    FitSNAP/active-learning’s past year of commit activity
    Python 2 1 0 0 Updated Sep 8, 2023
  • TestSNAP Public

    SNAP Proxy app

    FitSNAP/TestSNAP’s past year of commit activity
    C 5 5 1 0 Updated Aug 15, 2023
  • benchmarks Public

    Benchmarks for SNAP, ACE, and other ML potentials

    FitSNAP/benchmarks’s past year of commit activity
    Gnuplot 0 GPL-3.0 0 0 0 Updated Jul 6, 2023
  • fitsnap-datasets Public

    Repo for housing training sets

    FitSNAP/fitsnap-datasets’s past year of commit activity
    AMPL 0 3 0 0 Updated Apr 19, 2023
  • entropy-set Public
    FitSNAP/entropy-set’s past year of commit activity
    0 1 0 0 Updated Jan 12, 2023
  • joss-paper Public
    FitSNAP/joss-paper’s past year of commit activity
    TeX 0 GPL-3.0 0 0 0 Updated Nov 30, 2022
  • fitsnap-examples Public

    FitSNAP examples for creating and using potentials

    FitSNAP/fitsnap-examples’s past year of commit activity
    0 GPL-2.0 1 0 0 Updated Nov 3, 2022
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