TURBOMOLE Users Forum

TmoleX - Graphical User Interface => TmoleX - general topics => Topic started by: Jerry on April 13, 2016, 11:34:52 PM

Title: TmoleX removes .cao files from RICC2 geometry optimization
Post by: Jerry on April 13, 2016, 11:34:52 PM

Hi,
I am using the most recent version of TmoleX and Turbomole 7.0.1.  When I run RICC2 geometry optimizations, the corresponding .cao files are generated in the job directory within TmoleX_Jobs.  When the calculation completes, and TmoleX transfers the files back to the original job directory, the .cao files are gone.  How can I get TmoleX to save and transfer those files as well?

Thank you,
Jerry