ForceGen support for Gaussian 16

Derives force constants from Gaussian QM for Gromacs MD

Brought to you by: acnash

ForceGen support for Gaussian 16

Forum: General Discussion

Creator: Kalyan Kumar N

Created: 2021-08-29

Updated: 2021-08-29

Kalyan Kumar N - 2021-08-29

Hi,

One of our user informed me that the forcegen is not recognising log file and .fchk file generated by Gaussian 16. Is there a tweak to use it along with Gaussian 16?

Thanks - KK

If you would like to refer to this comment somewhere else in this project, copy and paste the following link:

Log in to post a comment.