[Pw_forum] radius of the "core" in pseudopotential
rdong at ncsu.edu
Mon May 14 23:26:36 CEST 2012
I was trying to determine the effective radius of the core in a given
pseudopotential, core meaning the actual *atomic core* + *core electrons.* Or,
if I can get the charge distribution of the core, it will also work.
Does anyone have idea what should I do?
Thank you for help!
-------------- next part --------------
An HTML attachment was scrubbed...
More information about the users