The intention of this repository is to provide some scripts which should help with the execution and submission of ORCA.
Currently only a submission script is available, and it is pretty much tailored to the RWTH Cluster (CLAIX18).
To view a short description, issue:
orca.submit.sh -h
Configuration of the script with the files
orca.tools.rc or .orca.toolsrc (has precedence)
in one of the directories:
installation directory, HOME, HOME/.config, PWD.
The last found file will be applied.
GNU General Public License v3.0
See LICENSE to see the full text.