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pyiron
pyiron pyiron
49
365
bsd-3-clause
16
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
7,552 commits to main branch, last one 2 days ago
pyiron
pyiron_atomistics pyiron
15
44
bsd-3-clause
9
pyiron_atomistics - an integrated development environment (IDE) for atomistic simulation in computational materials science.
dft vasp lammps pyiron python gaussian
Created 2021-01-09
12,008 commits to main branch, last one 2 days ago