HF Energy calculation with Pb

Nuri Yazdani nuri.a.... at gmail.com
Thu May 14 11:22:49 UTC 2015


Hi!
Thanks for the quick response! I opened up the overnight downloaded new 
CP2K package and indeed I see that Pb has been added in the ADMM set! I 
will try to get this running today! Ill follow up on the thread once I have 
results!
-------------- next part --------------
An HTML attachment was scrubbed...
URL: <https://lists.cp2k.org/archives/cp2k-user/attachments/20150514/b40ec42b/attachment.htm>


More information about the CP2K-user mailing list