Dear all,
I want to use ATAT to build a disordered magnetic structure.Atoms have disordered up and down spin in structure in details. Can you give me suggestions about which moudle can make my intent true.EZVASP in mannual seems to meet my requirements,but i am not sure.
Thanks!
MCSQS
Build ‘spin up’ and ‘spin down’ as two different elements.
Thank you for your reply! l want to use SQS to construct a PM structure with DLM frame. For example, if i want to get a structure of PM Fe,i need to construct Fe-B(B is an other element) by SQS. Futhermore, i set Fe up spin and B down spin.