Result of · via Exchange couplings (Jij)
TCTP-TCSP Mo6B4Mn2Fe2 — Fe substitution at 2.43 Å Mn-Mn pair - relaxed
From TCTP-TCSP Mo6B4Mn2Fe2 — Fe substitution at 2.43 Å Mn-Mn pair
Heisenberg exchange pair couplings (1676 pairs) from TB2J