Comments (3)
pierrehirel
commented on July 25, 2024
Dear @redoxmatlab ,
Thank you for your feedback.
I do not know the *.stru file format. Can you please provide a link where it is formally documented, and some examples of codes that use this file format?
Best regards
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pierrehirel
commented on July 25, 2024
Dear @redoxmatlab ,
I started working on an implementation of the STR file format produced by PDFFIT, as documented here. Can you confirm you are interested in this file format?
Thanks
from atomsk.
pierrehirel
commented on July 25, 2024
The STR file format used by PDFFIT can now be read and written by Atomsk version Beta 0.10.
In the absence of answer from OP after more than 3 months, I close this issue.
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