Dear All, I am trying to do GWW calculations and I am worried about the convergence of the calculations, e.g. take CH4 molecule then how one can get a good converge results. Please point me out the parameters and how to get a good guess of that parameter's values.
Thanks and Regards, -- Manoar Hossain Research Scholar School of Physical Sciences NISER, Bhubaneswar
_______________________________________________ Pw_forum mailing list Pw_forum@pwscf.org http://pwscf.org/mailman/listinfo/pw_forum
