Dear all, While running transiesta for an Fe slab, I came across the following error " ERROR in Contour: No. points in gaufermi not valid" and thereafter the code stops. - I have seen the answer to the same pblm in the forum by Frederico Dutilh Novaes, to reduce the TS.ComplexContour.NLine to 11. But I have already done some other calculations with TS.ComplexContour.NLine upto 100 points. I didnt get this error that time. Could anybody please explain why this error is coming to some specific inputs only?? and how to solve it.. Thanks in advance, Asa - Assa Aravindh.S Research Scholar Theory and Computational Studies Section, Material Science Division, IGCAR, India
