Primary study2018
Electron delocalization and charge mobility as a function of reduction in a metal-organic framework
Aubrey M.L., Wiers B.M., Andrews S.C. et al. · Nature Materials · 2018
Reported here: Fe(pz)3 computational model chain
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Fe(pz)3 computational model chain
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2018–2018publication span
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| Paper and reported name | Formula and components | Structure context | Source |
|---|---|---|---|
| Fe(pz)3 computational model chain2018 · Electron delocalization and charge mobility as a function of reduction in a metal-organic framework | Fe(pz)3; pz = pyrazolate anionOne-dimensional chain of octahedral iron(III) sites. · Pyrazolate anion, C3H3N2- | 1D · Model SystemSmaller one-dimensional periodic model used to approximate Fe2(BDP)3 near the Fermi level. | main p.4, article p.628 · Electronic structure · Fig. 4 |