[Pw_forum] need technical reason -why nscf is not running in gamma point? (Giovanni Cantele)
Raj kamal
rajkamalloyola at gmail.com
Sat Jun 11 13:31:37 CEST 2016
dear experts
> please give me any technical reason for this problem .i was trying to
calculate dos for C60 fullerene but nscf is not running in gamma point and
its running in 1 1 1 k point.
%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%
from tetrahedra : error # 1
cannot remap grid on k-point list
%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%
stopping ...
%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%
from tetrahedra : error # 1
cannot remap grid on k-point list
--
*Best regards,*
*Rajkamal.A.*
*Research Scholar,(SRM UNIV).*
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