GTH_BASIS_SETS CANNOT BE OPENED
Conrad
cjohns... at qub.ac.uk
Mon Jul 18 13:24:32 UTC 2016
Hi Dj MG,
You will need to know where CP2K is on your machine, and point to the data
directory, as described by Huan,
or put the data files you need in the directory that you run the
calculation from.
Also, upgrading to 3.0 is recommended!
Best wishes,
Conrad
-------------- next part --------------
An HTML attachment was scrubbed...
URL: <https://lists.cp2k.org/archives/cp2k-user/attachments/20160718/042c2e46/attachment.htm>
More information about the CP2K-user
mailing list