Hi, I am doing a series of variable cell optimization at increasing pressures using pw.x. If one uses restart_mode='restart', what happens to the G-vectors? Are they the same of the previous run, or a new set is generated according to the reshaped-resized cell and the cutoffs? Thanks Eduardo
[Pw_forum] G-vectors after a restart with variable cell
Eduardo Ariel Menendez P Tue, 18 Jul 2006 14:25:57 -0400 (CLT)
- [Pw_forum] G-vectors after a restart with variabl... Eduardo Ariel Menendez P
- [Pw_forum] G-vectors after a restart with va... Stefano de Gironcoli
