Dear Wang: I think the fermi level of scf is more believable than that of nscf??
2009/12/29 Q.J.Wang <wangqj1 at 126.com> > Dear all > After I run scf(k-points,3*3*3)with 'smearing' , I increase the > k-points (5*5*5)and run nscf with 'tetrahedra' in order to get DOS,but the > fermi levels have little difference between the scf.out and nscf.out . > Which I should select when plot DOS pictuce ? > I have search in the forum ,but still haven't the correct answer . > -- > Best regards > > Q.J.Wang > > XiangTan University > > ____________________________________ Hui Wang School of physics, Nankai University, Tianjin, China -------------- next part -------------- An HTML attachment was scrubbed... URL: http://www.democritos.it/pipermail/pw_forum/attachments/20091229/a903e87a/attachment.htm
