[CP2K-user] check electron densities generated using plane waves similar to electron densities generated using gaussian in GPW.

ganta.pra... at gmail.com ganta.pra... at gmail.com
Tue Jan 22 11:41:59 CET 2019


Dear CP2K team/users,

Is there any way to check/validate the electron densities generated using 
plane waves and electron densities generated using gaussians in GPW method 
are similar for a system?.

Please let me know.

Have a nice day.

Thanks and Regards,
Prasanth. 
-------------- next part --------------
An HTML attachment was scrubbed...
URL: <https://lists.cp2k.org/archives/cp2k-user/attachments/20190122/5f9b5590/attachment.html>


More information about the CP2K-user mailing list