[CP2K:6600] Errors in regtests, CP2K 2.6

bbry... at gmail.com bbry... at gmail.com
Fri Jun 12 15:08:00 UTC 2015

Thank you. I will remember that :)

Right now things are working - the regression tests went through for sopt, 
ssmp, popt, and psmp.


On Thursday, June 11, 2015 at 4:33:15 PM UTC+2, Andreas Glöss wrote:
> Hi Brigitte,
> Just in case you need higher angular momenta later - using the same values 
> for CP2K and LIBINT will not work. If you don't use LIBINT's defaults, you 
> will need to increase the corresponding CP2K values by 1.
> Please have a look at the following location and search for 'Note':
> cp2k/tools/hfx_tools/libint_tools/README_LIBINT
> Best regards,
> Andreas
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