[Pw_forum] Magnetic moment

Manoj Narayanan manojnarayan86 at gmail.com
Sun Jun 22 03:23:11 CEST 2014


Dear QE users

I am doing some spin polarized calculations. The output itself gives a
value for total magnetization and absolute magnetization in  μB/cell. Can I
get magnetic moment directly from this value ? Is this value different from
magnetic moment obtained by the formula  μ = (Mu-Md), where Mu and Md are
no. of electrons in up and down spin states.

Thanks for you attention


Manoj N
Allahabad Uty.
India
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