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1 papers
He Y., Cubuk E.D., Allendorf M.D. et al. · Journal of Physical Chemistry Letters · 2018
Reported here: Na13Fe4Sb2W18(C4O43)2
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| Paper and reported name | Formula and components | Structure context | Source |
|---|---|---|---|
| Na13Fe4Sb2W18(C4O43)22018 · Metallic Metal-Organic Frameworks Predicted by the Combination of Machine Learning Methods and Ab Initio Calculations | Na13 Fe4 Sb2 W18 C8 O86Na, Fe, Sb and W-containing framework model · C4O43-containing formula fragment as reported | unknown · Model SystemDFT-optimised triclinic ML-predicted candidate; not DFT-confirmed metallic | 4 · Results and discussion · Table 2 |