[ase-users] turbomole calculator

Kondov, Ivan (SCC) ivan.kondov at kit.edu
Tue May 23 11:26:24 CEST 2017


Dear Jens Jørgen,

> Do we have some Turbomole users out there?  Did someone try this?
> Anyway, I think it would be great with an updated interface to Turbomole.
Can
> you create a merge-request or did you already do that?

Some colleagues at KIT are already using it, and me too.  I just created a
merge request. I will be grateful for any comments and suggestions. Thank
you in advance!

Best regards,
Ivan



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