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CP2KCIF

CP2K input/restart file converter to cif or xyz

out2cif automatically detects whether coordinates are scaled or not and converts cartesian to a fraction or vice versa for cif and xyz files. Works only for units in angstrom.

use: python3 out2cif.py -cif/-xyz cp2k.inp

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CP2K input/restart file converter to cif

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