Dear Alexander,
Thank you very much, I tranfered the *.IOCH to *.XSF, I am trying to caclulate cbader charge density according to your blog. I have add the some charge in the core and saved the pesudo-core to the *.IOCH. while I am not so clear which part is the pesudo-core charge. Can you gvie me some tips about how to check the pesudo-core charge? Thank you very much. Regards, Fen
