<div dir="ltr">Dear Wien2k users;<div><br></div><div>we have done an SCF calculation for a compound that contains two different magnetic atoms, we oriented the spins of the two atoms in the same direction along z (ferromagnetic case) but at the end of the calculation, we found that they are moving antiparallelally (ferrimagntism)<br>in this case, can we judge that the ground state of this material is ferrimagnetic .? or else we have to redo the calculation with two different directions (antiparallelally)
to confirm?<br></div><div><br></div><div><br></div></div>