Hello,
In the ypp bands interpolation, if spin-orbit coupling is included the code also outputs files for the "spin factors" and "magnetization along x/y/z". The magnetization output is simply the magnetization of the band state due to spin, right? It doesn't include orbital magnetization?
Best,
Miles
Magnetization output in bands calculation
Moderators: Davide Sangalli, andrea marini, Daniele Varsano
-
milesj
- Posts: 36
- Joined: Thu Jan 26, 2023 9:27 pm
Magnetization output in bands calculation
Miles Johnson
California Institute of Technology
PhD candidate in Applied Physics
California Institute of Technology
PhD candidate in Applied Physics
-
Davide Sangalli
- Posts: 640
- Joined: Tue May 29, 2012 4:49 pm
- Location: Via Salaria Km 29.3, CP 10, 00016, Monterotondo Stazione, Italy
- Contact:
Re: Magnetization output in bands calculation
Dear Miles,
I confirm, the magnetization is only the "spin magnetization"
D.
I confirm, the magnetization is only the "spin magnetization"
D.
Davide Sangalli, PhD
CNR-ISM, Division of Ultrafast Processes in Materials (FLASHit) and MaX Centre
https://sites.google.com/view/davidesangalli
http://www.max-centre.eu/
CNR-ISM, Division of Ultrafast Processes in Materials (FLASHit) and MaX Centre
https://sites.google.com/view/davidesangalli
http://www.max-centre.eu/