[Pw_forum] how to calculate magnetic moment on each atoms

[Arles V. Gil Rebaza]

Hi Patriot, if you want to get the magnetic moment per atom just add the
variable "report = 1" in &SYSTEM, please read the QE manual.

Best

PhD stud Arles V. Gil Rebaza
IFLP - Argentina

2011/10/5 patriot pershing <science35 at gmail.com>

> dear any one:
> i have performed scf calculations for Ferromagnetic (FM) and
> anti-ferromagnetic (AFM) state of C doped ZnO and i would known how to
> calculate the magnetic moment on each atoms in my supercell as well as
> electronic charge density for the spin up and down
> best regards
>
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