[Pw_forum] How to find the charge density corresponding to AE and Pseudo states in atomic code?
sonu kumar
1009ukumar at gmail.com
Tue Jul 27 18:48:34 CEST 2010
Dear All Quantum Espresso users,
How can i find out :
1) all electron charge density corresponding to core and valence states
2) pseudo charge density corresponding to pseudized core(nlcc) and
valence(or/and semicore) states
using "atomic" code in Quantum Espresso?
I am not an experienced QE user.
With Kind Regards,
Sonu Kumar
Phd Student
Physics Department
Indian Institute of Technology
Delhi-110016, India
web:-http://www.iitd.ac.in/
-------------- next part --------------
An HTML attachment was scrubbed...
URL: http://www.democritos.it/pipermail/pw_forum/attachments/20100727/f3f99ae5/attachment-0001.htm
More information about the Pw_forum
mailing list