SCF run NOT converged

Rizwan Nabi rizwan... at
Tue Mar 8 07:45:17 UTC 2016

Hi Cindy Putri Arinta 

I have modified your input file please try with this one. Hope it will work 
fine now. 


-------------- next part --------------
An HTML attachment was scrubbed...
URL: <>
-------------- next part --------------
A non-text attachment was scrubbed...
Name: withOTmethod.inp
Type: chemical/x-gamess-input
Size: 2336 bytes
Desc: not available
URL: <>

More information about the CP2K-user mailing list