Haibei Huang

most citedLanthanide-radical magnetic coupling in [LnPc

_{2}

]

^{0}

: Competing exchange mechanisms captured via ab initio multi-reference calculations

4 citations · 4 across the 1 of their papers we have counts for

collaborators

1 paper

cond-mat.str-el2020★ 4 cited

Lanthanide-radical magnetic coupling in [LnPc $_{2}$ ] $^{0}$ : Competing exchange mechanisms captured via ab initio multi-reference calculations

Haibei Huang, Willem Van den Heuvel, Alessandro Soncini

We present a computational investigation of the intramolecular exchange coupling in [LnPc $_{2}$ ] $^{0}$ (Ln = Tb, Dy, Ho, and Er) between the Ln $^{3 +}$ 4f electrons and the spin-1/2 rad…

Lanthanide-radical magnetic coupling in [LnPc2​]0: Competing exchange mechanisms captured via ab initio multi-reference calculations

Lanthanide-radical magnetic coupling in [LnPc $_{2}$ ] $^{0}$ : Competing exchange mechanisms captured via ab initio multi-reference calculations