M06-2x and DISP v.4


Click here for full thread
Just Got Here
Using CVR_scaling together with torsional angle constrain
Dear all

I am trying to use cvr_scaling together with torsion constrain which are both found in zcoord block. What seems to be a problem is that the cvr_scaling deactivates the constrains used. The job runs and finishes without errors but the constrain angle is not what I fixed it to.