24.04.2021 15:21, 413119...@nitt.edu wrote:
I am using wien2k in my ubuntu system and Iam not able to open this
cif file into structgen.when i click use this file iam getting an error
in error files such that "this cif file cannot be acccessed.Also i want
to know how can i make this as an input file for AFM calculation for Yb
ions.
If I change the name to simpler - sd.cif, cif2struct starts working with
the file, but also gives errors:
cif2struct sd.cif
Cell dimension(s) missing!
F F F
So try to change the name and then look again at the diagnostic of
structgen.
Best wishes
Lyudmila Dobysheva
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