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I want to introduce oxygen vacancy in a system and study the magnetic properties it may induce. In order to know the ground state of the system is FM or AFM, i need to set the initial magnetic coupling between two Vo to be FM or AFM coupling. But how?

I know how to set the MAGMOM for existing atoms, but how can I set those information to empty spheres? Could anyone help me out of this? Thanks a lot.

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