Spin-orbit coupling on/off switch
Posted: Tue Nov 20, 2018 8:56 am
Dear VASP users,
I would like to consider spin-orbit coupling effect not for all atoms but for specific atoms in a unit cell.
Is it possible including SOC effect on only some atoms in unit cell? I want to turn on SOC for some atoms in a unit cell and turn off SOC effect for the other atoms.
If so, how can I do it?
Many thanks.
I would like to consider spin-orbit coupling effect not for all atoms but for specific atoms in a unit cell.
Is it possible including SOC effect on only some atoms in unit cell? I want to turn on SOC for some atoms in a unit cell and turn off SOC effect for the other atoms.
If so, how can I do it?
Many thanks.