Closed mondracek closed 7 months ago
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@ondrejkrejci , I think I need your review so that I could merge.
example/FFPB_KPFM/
directory createdparams.ini
(parameters for the KPFM scan),input_plot.xyz
(atom positions in the FFPB molecule), andrun.sh
(scrip to run the KPFM simulation)LOCPOT_V?.xsf
(the Hatree potentials) from Zenodo included inexample/FFPB_KPFM/run.sh
, usingwget
ppafm/ppafm/data.py
updated.