[CP2K-user] MOLOPT basis set for Pt with 10 electrons

Sun Geng gengs... at gmail.com
Tue Oct 13 00:55:09 UTC 2020


Dear CP2K users,
I found the GTH pseudopotential file contains Pt with 10 valence electrons, 
but I did not find any MOLOPT basis for that?
Is there any known basis set  for Pt10 compatible with that GTH-PP?
Thank you very much in advance,

Best,
Geng
-------------- next part --------------
An HTML attachment was scrubbed...
URL: <https://lists.cp2k.org/archives/cp2k-user/attachments/20201012/3ab12e40/attachment.htm>


More information about the CP2K-user mailing list