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fleur output node in case of relaxation #101
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@Tseplyaev
which will have length of natom type. The core-level workflows parse generate a whole bunch of info for the atom types but I think we want need this. |
write routines for
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@broeder-j |
Currently we parse the relaxation results like this:
relax_brav_vectors
relax_atom_positions
force_x_type1
abspos_x_type1
example:
Problems with this:
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