Hello Everyone,
I am able to sucessfully run scf.in using pw.x but while proceeding for the calculations to be done using thermo_pw.x the following errors occur.
Error in routine c_bands (1):successfully
too many bands are not converged
I have already tried increasing ecut, ecutrho, decreasing conv_thr, reducing mixing beta, reducing k points and pseudopotential too.
but none of them are helpful to fix the issue.
Someone who has faced this error in thermo_pw please guide,
Thanks,
Dr. Abhinav Nag