Spin density for each MO
Xiaoming Wang
wxia... at gmail.com
Mon Sep 25 21:16:05 UTC 2017
I find the solution. One can generate the MO_CUBE files and do the
multiplication by VESTA.
Best,
Xiaoming
On Monday, September 25, 2017 at 10:44:38 AM UTC-4, Xiaoming Wang wrote:
>
> Hello,
>
> Is there a way to print the spin density for each MO?
>
> Best,
> Xiaoming
>
-------------- next part --------------
An HTML attachment was scrubbed...
URL: <https://lists.cp2k.org/archives/cp2k-user/attachments/20170925/7c06888c/attachment.htm>
More information about the CP2K-user
mailing list