Dear PWSCF users,
I have question regarding utilization of different type of Ultrasoft
pseudopotentials. Is it correct to use different type of ultrasoft PS ( like
rrkjus and Vanderbilt) for different atoms in a given system??? (e.g. one can
use rrkjus PS of Cobalt and Vanderbilt PS of Mn with same XC functionals in a
given system)

With best regards
Saqib JAVAID

PhD Student
University of Strasbourg
Strasbourg, France.

----------------------------------------------------------------
This message was sent using IMP, the Internet Messaging Program.

Reply via email to