Dear Abdul,
starting_magnetization is the initial ratio of the number of polarized
electrons to the total number of valence electrons for the respective atomic
species. Therefore, it ranges from –1.0 (all spins down) through 0.0 (paired
spins) to +1.0 (all spins up). It is used to construct
Hello QE users,
I am trying to understand how to appropriately set the
|starting_magnetization |value and how to interpret the output related
to magnetization in the pw.x. I tested for a simple system (BCC Fe) with
various |starting_magnetization |and observed that it doesn't matter.
The
