Primary study2019
Rational modifications of PCN-700 to induce electrical conductivity: A computational study
Chong S., Kim J. · Dalton Transactions · 2019
Reported here: PCN-700 linker-installation model series
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1 papers
Chong S., Kim J. · Dalton Transactions · 2019
Reported here: PCN-700 linker-installation model series
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| Paper and reported name | Formula and components | Structure context | Source |
|---|---|---|---|
| PCN-700 linker-installation model series2019 · Rational modifications of PCN-700 to induce electrical conductivity: A computational study | Not specifiedZr6O4(OH)4 PCN-700 clusters · FA, DHBQ, BDC, NDC, or BPDC installed in PCN-700 in separate MD models | 3D · Model SystemFlexible MD models used to validate sequential linker installation and unit-cell dimensions. | main p.5, article p.106 · Electronic properties of PCN-700-DHBQ · Table 1 |