Dear QE users, I am trying to test a given pseudopotential, which is generated by Vanderbilt's code, using the atomic code (ld1.x). I encounter the message: ------ %%%%%%%%%%%%%%%%%%%% from read_pseudoup : error #1 mesh not supported %%%%%%%%%%%%%%%%%%
Googling, I found a post by Stefano (http://www.democritos.it/pipermail/pw_forum/2010-November.txt) explaining how the former code uses the "xmin" point as r=0. It was suggested to use the "virtual.x" to make an interpolation. Is there an easy way in the upf tools? Besr regards, mahmoud ------------------------------------ Mahmoud Payami Physics Group, AEOI, Tehran, Iran Email : mpayami at aeoi.org.ir -------------------------------------------------
