Advanced Functional Materials · 2023 · 134 citations · 52 references
Natural SciencesChemical EngineeringChemistryCatalysisElectrochemistryNanomaterialsCatalyst DesignElectrochemical CellsElectrochemical Energy ConversionElectrode MaterialsNanocatalysisRedox-active MaterialsBifunctional CatalysisDehydrogenationDehydrogenation ReactionsElectrocatalystsElectrocatalytic NanomaterialsFaradaic EfficiencyHydrogen EvolutionStructured Catalysts
Abstract Glycerol electrooxidation (GOR), as a typical nucleophile oxidation reaction, is deemed as a promising alternative anodic route to assist cathodic hydrogen evolution reaction. However, the investigations of high‐performance catalysts and industrial‐scale application of GOR remain a grand challenge. Herein, biphasic Ni 3 N/Co 3 N heterostructure nanowires (denoted as Ni 3 N/Co 3 N‐NWs) are proposed as an efficient bifunctional catalyst, which realizes a high Faradaic efficiency of 94.6% toward formate production. Importantly, the flow electrolyzer achieves an industry‐level current density of 1 A cm −2 at 2.01 V with impressive stability for steady running over 200 h, realizing lower electricity expense of 4.82 kWh m −3 H2 and energy saving efficiency of 9.7%, as well as outstanding co‐production rates of 11 and 21.4 mmol cm −2 h −1 toward formate and H 2 , respectively. Theoretical calculations reveal that the efficient electron transfer on Ni 3 N/Co 3 N heterointerfaces simultaneously optimizes nucleophile reaction tendency and glycerol dehydrogenation kinetics, thus contributing to excellent GOR performance.
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Generalized Gradient Approximation Made Simple
John P. Perdew, Kieron Burke, Matthias Ernzerhof · Physical Review Letters · 1996 · 211.5K citations · Full text
Natural Sciences, Chemistry, Physics +16
<i>Ab initio</i>molecular dynamics for liquid metals
Georg Kresse, J. Häfner · Physical review. B, Condensed matter · 1993 · 44.9K citations
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