Hi all, The explanation for ’niter_cg_restart’ parameter belonging to cp.x input in docs is:
“frequency in iterations for which the conjugate-gradient algorithm for electronic relaxation is restarted” with a default value of 20. Does this mean for all types of electron_dynamics like ’none’, ‘verlet’, ‘damp’ etc., conjugate gradient algorithm will be used to converge the wave function every 20 steps by default? Thanks, -Zeeshan -- Zeeshan Ahmad PhD candidate, Mechanical Engineering Carnegie Mellon University _______________________________________________ users mailing list [email protected] https://lists.quantum-espresso.org/mailman/listinfo/users
