[Pw_forum] conjugate gradient diagonalization
Jaita Paul
jaita at jncasr.ac.in
Wed Jun 1 16:08:35 CEST 2005
hello everyone,
i'm using conjugate gradient diagonalization scheme.and i have this msg.
%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%
from c_bands : error # 1
CG and DIIS diagonalization not implemented
%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%
why is it coming?and what shud i do so that it does not come?
thanks in advance!
Jaita
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