I am investigating a near half-metallic / high-spin polarization material. I ran an SCF calculation with
nspin = 2, with some starting magnetization. So now I wonder how to find the exact percentage of spin-polarization (%SP). I have already done PDOS calculation, and from that I can clearly "see" it's nearly half-metallic, but I don't know how to extract the %SP.
Is it mentioned somewhere in the output file after the SCF, or do I need it to extrapolate it somehow? Please help. Thank you!
codeblock for your