Hi all,
I am trying to learn to calculate the magnetic ground state geometry of a system. For example I am testing a well known non-colinear system, IrMn. I have randomized the spins in the Mn and I wish to see if the system returns to the stable anti ferromagnetic state. Here is the input that I am using:
tasks
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! Groundstate calculation from scratch
! Geometric optimization...
2013-02-05 13:30:16 PST in Elk
