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Error generating ORCA and Gaussian files #1124
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Thanks for opening your first issue here! Please try to include example files and screenshots if possible. If you're looking for support, please post on our forum: https://discuss.avogadro.cc/ |
Duplicate of #1052? |
@e-kwsm - looks like it, yes. Still not sure why that fix didn't work, but I'll investigate this week. |
@juan0603-chem - can you provide a screenshot of the ORCA input window. Is some of it translated? |
Fixes OpenChemistry#1124 and fixes OpenChemistry#1052 Signed-off-by: Geoff Hutchison <geoff.hutchison@gmail.com>
Here are the build results |
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Describe the bug
Avogadro shows an error while generating an input file for ORCA and Gaussian, simply doesn't let generate that
To Reproduce
Steps to reproduce the behavior:
Expected behavior
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Let me generate an inp file for geometry optimization with ORCA
Screenshots
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Additional context
Add any other context about the problem here. Please consider uploading or linking test files.
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