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pyiron
pyiron pyiron
51
391
bsd-3-clause
15
pyiron - an integrated development environment (IDE) for computational materials science.
ase dft ide hdf5 vasp lammps pyiron python ab-initio simulation molecular-dynamics development-environment
Created 2018-03-22
7,575 commits to main branch, last one 16 days ago
pyiron
pyiron_atomistics pyiron
16
45
bsd-3-clause
8
pyiron_atomistics - an integrated development environment (IDE) for atomistic simulation in computational materials science.
dft vasp lammps pyiron python gaussian
Created 2021-01-09
12,305 commits to main branch, last one 7 days ago