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findTDE v1.1.12

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@hauck-as hauck-as released this 29 Jan 18:20
· 69 commits to main since this release
v1.1.12
f97ad6f

Use pymatgen for reading POSCAR/POTCAR files for adding velocity to structure (read atomic symbols, number of ions, check POSCAR/POTCAR match, read/write velocity vector). Use pymatgen to read atomic masses from LAMMPS input file for LAMMPS version.

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