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Manuscript title: Active and Selective Ensembles in Oxide-Derived Copper Catalysts for CO2 Reduction

DOI: 10.1021/acsenergylett.0c01777

Metadata:

Title: U-Cu₂O-PBE+U-5-0-17-e⁻
Authors: Dattila, Federico
Issue Date: 5-May-2020
Publisher: Institute of Chemical Research of Catalonia
Description: Benchmark tests for Cu₂O formation; PBE + U (Ueff = 5.0 eV); 17 valence electrons.
URI: https://iochem-bd.iciq.es/browse/handle/100/24702
Appears in Collections:redCO2_OD-Cu



Please use this identifier to cite or link to this item: https://iochem-bd.iciq.es/browse/handle/100/24702

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