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Hi, I'm conducting single point calculation via autodE. By defult, the xyz file of atoms will be printed automatically,
%output xyzfile=True
How can I cancel the output of xyz file?
The text was updated successfully, but these errors were encountered:
Unfortunately, I don't think it's possible – autodE reads that file for the output geometry from the calculation. It's added in
autodE/autode/wrappers/ORCA.py
Lines 133 to 137 in 6a6eebe
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Hi, I'm conducting single point calculation via autodE. By defult, the xyz file of atoms will be printed automatically,
How can I cancel the output of xyz file?
The text was updated successfully, but these errors were encountered: