On Jan 13, 2010, at 21:00 , vtmtrinh at caltech.edu wrote: > Could you give me the pp again, if you don't mind.
I don't mind, but I don't know which file exactly you are referring to. There is a new Mn USPP that should be better than the previous one. Please get it here: http://www.quantum-espresso.org/pseudo/upfdetails.php?upf=Mn.pbe-sp- van_mit.UPF P. --- Paolo Giannozzi, Dept of Physics, University of Udine via delle Scienze 208, 33100 Udine, Italy Phone +39-0432-558216, fax +39-0432-558222
