Updated unfolding script to read HDF5 format #53
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The previous version of the unfolding script was deprecated. I have updated the script to read the wavefunctions in
HDF5
format, so now the script works forQuantum Espresso
versions up to7.3.1
(assuming wavefunctions are saved inHDF5
).On the other hand, now it is possible to unfold a rotated supercell, by giving in the argument the rotation matrix between the unit cell and the supercell.