[SIESTA-L] parallel command

Hi, This question has been shared before, but since I didn't find any solution for that I share it again. I have compiled Siesta once with ifort and once with gfortran. I have used once mpich2 and once again openmpi. The parallel compilation of Siesta goes on with no problem mentioning the proper

Re: [SIESTA-L] Strange band structure

Dear Haci, I can only repeat what I suggested before: A possible reason: wrong units; remember that you can define k-points in units of 2*pi/(lattice constant) or in absolute units. You input contains BandLinesScale pi/a and what is your a?? How to figure out what's going on: look at the