Primary study2019
Rational modifications of PCN-700 to induce electrical conductivity: A computational study
Chong S., Kim J. · Dalton Transactions · 2019
Reported here: DHBQ coordinated Zr6O4(OH)4 cluster model
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DHBQ coordinated Zr6O4(OH)4 cluster model
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2019–2019publication span
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| Paper and reported name | Formula and components | Structure context | Source |
|---|---|---|---|
| DHBQ coordinated Zr6O4(OH)4 cluster model2019 · Rational modifications of PCN-700 to induce electrical conductivity: A computational study | Zr6O4(OH)4 cluster with formate modulators and DHBQ linker(s)Zr6O4(OH)4 cluster models · DHBQ and formate modulators | 0D · Model SystemFinite cluster DFT model used to analyse DHBQ coordination modes rather than a periodic MOF. | main p.3, article p.104 · DHBQ coordination mode analysis |