Hi,
I am new to AMSET. I want to use AMSET for calculating thermoelectric properties of a half-metallic heusler alloy which has metallic character in spin-up channel and is semiconducting in nature in spin-down channel. Can you please tell me how can I write band gap for different spin channels in settings.yaml file?
Thank you.
Hi @Bhawna,
Unfortunately, AMSET doesn’t support metals, half-metals or semimetals. Sorry for the inconvenience.
Best,
Alex