libAtoms

workflow Public
python workflow toolkit

libAtoms/workflow’s past year of commit activity

Python 35 GPL-2.0 18 64 4 Updated Nov 1, 2024
ExPyRe Public
Execute Python Remotely

libAtoms/ExPyRe’s past year of commit activity

Python 6 GPL-2.0 3 9 0 Updated Oct 31, 2024
matscipy Public
Materials science with Python at the atomic-scale

libAtoms/matscipy’s past year of commit activity

Python 185 LGPL-2.1 54 26 0 Updated Oct 16, 2024
QUIP Public
libAtoms/QUIP molecular dynamics framework: https://libatoms.github.io

libAtoms/QUIP’s past year of commit activity

Fortran 349 122 104 1 Updated Sep 27, 2024
pymatnest Public
Nested Sampling code

libAtoms/pymatnest’s past year of commit activity

Jupyter Notebook 30 GPL-3.0 18 3 1 Updated Sep 18, 2024
ExtXYZ.jl Public
Extended XYZ read/write support for Julia

libAtoms/ExtXYZ.jl’s past year of commit activity

Julia 13 MIT 6 3 0 Updated Sep 9, 2024
soap_turbo Public

libAtoms/soap_turbo’s past year of commit activity

Fortran 5 8 5 0 Updated Sep 4, 2024
GAP Public

libAtoms/GAP’s past year of commit activity

Fortran 40 19 0 1 Updated Aug 17, 2024
extxyz Public
Extended XYZ specification and parsers

libAtoms/extxyz’s past year of commit activity

Python 16 MIT 4 8 1 Updated Jul 1, 2024
abcd Public

libAtoms/abcd’s past year of commit activity

Python 2 4 24 1 Updated Jun 14, 2024

Provide feedback