Primary study2020
Efficient and tunable one-dimensional charge transport in layered lanthanide metal–organic frameworks
Skorupskii G., Trump B.A., Kasel T.W. et al. · Nature Chemistry · 2020
Reported here: LuHHTP hypothetical computational model
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LuHHTP hypothetical computational model
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2020–2020publication span
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| Paper and reported name | Formula and components | Structure context | Source |
|---|---|---|---|
| LuHHTP hypothetical computational model2020 · Efficient and tunable one-dimensional charge transport in layered lanthanide metal–organic frameworks | LuHHTP model derived from NdHHTP by metal substitutionHypothetical Lu3+ analogue used as a closed-shell proxy for smaller lanthanides. · HHTP linkers in periodic DFT model. | 3D · Model SystemHypothetical model for electronic-structure comparison; not synthesised in this paper. | main p.132 · Electronic band structure calculations |