Table 3 Hopping matrix elements (in meV) for Fe2(DOBDC) at the geometry of π-O2.
From: Redox chemistry and metal–insulator transitions intertwined in a nano-porous material
Band |
| t 1 | t 2 | t 3 |
|---|---|---|---|---|
| −88 | −103 | −2.5 | −0.6 |
From: Redox chemistry and metal–insulator transitions intertwined in a nano-porous material
Band |
| t 1 | t 2 | t 3 |
|---|---|---|---|---|
| −88 | −103 | −2.5 | −0.6 |
