[QE-users] [Spin direction]

[박기명]

Dear users,

If I set starting_magnetization = 1 and angle1,2 for one atom, how do the spin directions of the remaining atoms align?
In this case, the DFT calculation does not seem to perform total energy minimization. So how can programs find out optimal spin directions?

Thank you

Sincerely,
Gimyung Park
Yonsei University

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