* https://github.com/pyiron/pyiron_atomistics * https://github.com/pyiron/atomistics * https://github.com/ICAMS/calphy * https://github.com/patherlkd/LAMMPS_python_instructions * https://github.com/mcherukara/LammpsRL * https://github.com/tcnicholas/amorphous-calcium-carbonate/ * https://github.com/bnovak1/set-berendsen-pdamp