Spin-orbit coupling
Posted: Tue Dec 30, 2008 10:48 pm
Dear Vasp users.
I have a question.
I am tring to calculate including SOC effect for magnetic compounds. Is is possible including SOC effect on only some atom in unit cell? It means that i want to turn off SOC effect for some of atoms in considered all atoms.
If so, please tell me how to do it?
Thansks
I have a question.
I am tring to calculate including SOC effect for magnetic compounds. Is is possible including SOC effect on only some atom in unit cell? It means that i want to turn off SOC effect for some of atoms in considered all atoms.
If so, please tell me how to do it?
Thansks