Computational Study of an Iron(II) Polypyridine...

Inorganic Chemistry 2020 / 05

Computational Study of an Iron(II) Polypyridine Electrocatalyst for CO 2 Reduction: Key Roles for Intramolecular Interactions in CO 2 Binding and Proton Transfer

Loipersberger, Matthias, Zee, David Z., Panetier, Julien A., Chang, Christopher J., Long, Jeffrey R., Head-Gordon, Martin
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Journal:
Inorganic Chemistry
DOI:
10.1021/acs.inorgchem.0c00454
Date:
May, 2020
File:
PDF, 4.09 MB
2020
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