gaussian log file is not working

joaquinbarroso / UVeh-Vis

Python script for UV-VIs plotting of Qchem output files

GNU General Public License v3.0

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gaussian log file is not working #15

Open sandipgiri576 opened 4 months ago

sandipgiri576 commented 4 months ago

Error: No excited states found Error: None provided file(s) is supported, please check the errors above Used this: UVeh-Vis -wl 150,800 -csv ni-5-result.csv -gau -norm files ni-5-tddft.log

EmanuelContC commented 4 months ago

Hi! there was a bug on the ES checker routine, it is now working, thanks for letting us know! Please stash and pull from your local repository.

sandipgiri576 commented 4 months ago

still threre is a problem, to read the log file. Please do check!

EmanuelContC commented 4 months ago

I just ran locally the latest version and it works well with both, gaussian and q-chem output files, could you please attach your file so I can check?