Hi everyone, I have had success with non-spin-polarized optical calculations in the past.
Now I've run an optical calculation on a spin-polarized system. I've changed the optical.f file so that it reads either the e2.dat.spin1 or e2.dat.spin2 that the input program produces. My spin2 state finishes successfully, but the spin1 file prompts for the: Do you want to include a Drude term? This is typically needed for metals if yes: enter 1, if no: enter 0 I have tried entering both 0 and 1 for separate calculations but I get the respective: bash: 0: command not found or bash: 1: command not found I don't have any NaN values in either the .EPSIMG or e2.dat.spin1 files - the values look normal. Does anyone know what's happening? Thank you, Chris Rowan M.Sc. Candidate University of Victoria Victoria, Canada
