hi
i am trying to use gradient-corrected pseudo potentials for O in TiO2.
according to the INPUT_PW file , the XC functional is read from PP's file
.so why do i have this error among an scf calculation :
%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%
from readpp : error # 2
inconsistent DFT read
%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%
any suggestion will be appreciated
_________________________________________________________________
Don't just search. Find. Check out the new MSN Search!
http://search.msn.com/