I want to reproduce the results using ORCA and checking my results whether they are matching with those reported in the publications. Can I reproduce the results using ORCA against the reported calculations using Gaussian.
Hello N.N. Subrahmanyeswara Rao
May I suggest that you search the papers citing ORCA? Therein, you will find details regarding the version of ORCA software used, the nature of the run, etc.
I am attaching a link to the page citing ORCA 5.0, and you can try to find papers citing the other versions.
Link 1: Article Software update: The ORCA program system—Version 5.0
I hope this helps!
Regards,
Dilawar
Thank you Dilawar I tried already that link and I got few papers. I did not find many papers with ORCA as gaussian.
Okay, I understand. You can also find many examples in the ORCA manual. They are often from research papers.
- Badges
- Science topic
- Similar topics
- Chemistry, Organic
- Organic