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      Anchoring zero valence single atoms of nickel and iron on graphdiyne for hydrogen evolution

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          Abstract

          Electrocatalysis by atomic catalysts is a major focus of chemical and energy conversion effort. Although transition-metal-based bulk electrocatalysts for electrochemical application on energy conversion processes have been reported frequently, anchoring the stable transition-metal atoms (e.g. nickel and iron) still remains a practical challenge. Here we report a strategy for fabrication of ACs comprising only isolated nickel/iron atoms anchored on graphdiyne. Our findings identify the very narrow size distributions of both nickel (1.23 Å) and iron (1.02 Å), typical sizes of single-atom nickel and iron. The precision of this method motivates us to develop a general approach in the field of single-atom transition-metal catalysis. Such atomic catalysts have high catalytic activity and stability for hydrogen evolution reactions.

          Abstract

          Single atom catalysts provide the most efficient metal atoms usage and afford active site homogeneity, but surface attachment has proven challenging. Here, the authors use triple-bond-rich graphdiyne to anchor nickel/iron atoms and show high hydrogen evolution electrocatalysis activities.

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          Most cited references41

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          First-principles calculations of the electronic structure and spectra of strongly correlated systems: theLDA+Umethod

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            Water photolysis at 12.3% efficiency via perovskite photovoltaics and Earth-abundant catalysts.

            Although sunlight-driven water splitting is a promising route to sustainable hydrogen fuel production, widespread implementation is hampered by the expense of the necessary photovoltaic and photoelectrochemical apparatus. Here, we describe a highly efficient and low-cost water-splitting cell combining a state-of-the-art solution-processed perovskite tandem solar cell and a bifunctional Earth-abundant catalyst. The catalyst electrode, a NiFe layered double hydroxide, exhibits high activity toward both the oxygen and hydrogen evolution reactions in alkaline electrolyte. The combination of the two yields a water-splitting photocurrent density of around 10 milliamperes per square centimeter, corresponding to a solar-to-hydrogen efficiency of 12.3%. Currently, the perovskite instability limits the cell lifetime.
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              Nonlinear ionic pseudopotentials in spin-density-functional calculations

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                Author and article information

                Contributors
                ylli@iccas.ac.cn
                Journal
                Nat Commun
                Nat Commun
                Nature Communications
                Nature Publishing Group UK (London )
                2041-1723
                13 April 2018
                13 April 2018
                2018
                : 9
                : 1460
                Affiliations
                [1 ]ISNI 0000000119573309, GRID grid.9227.e, Key Laboratory of Organic Solids, Institute of Chemistry, , The Chinese Academy of Sciences, ; Beijing, 100190 PR China
                [2 ]ISNI 0000 0004 1764 6123, GRID grid.16890.36, Department of Applied Biology and Chemical Technology, , The Hong Kong Polytechnic University—Hung Hom, ; Kowloon, Hong Kong SAR China
                [3 ]ISNI 0000 0004 1797 8419, GRID grid.410726.6, University of Chinese Academy of Sciences, ; Beijing, 100049 PR China
                Author information
                http://orcid.org/0000-0002-2526-2002
                http://orcid.org/0000-0002-0052-9364
                http://orcid.org/0000-0003-1359-1260
                Article
                3896
                10.1038/s41467-018-03896-4
                5899097
                29654234
                9cbf960d-a176-4a94-b0f1-9052ac6fa98d
                © The Author(s) 2018

                Open Access This article is licensed under a Creative Commons Attribution 4.0 International License, which permits use, sharing, adaptation, distribution and reproduction in any medium or format, as long as you give appropriate credit to the original author(s) and the source, provide a link to the Creative Commons license, and indicate if changes were made. The images or other third party material in this article are included in the article’s Creative Commons license, unless indicated otherwise in a credit line to the material. If material is not included in the article’s Creative Commons license and your intended use is not permitted by statutory regulation or exceeds the permitted use, you will need to obtain permission directly from the copyright holder. To view a copy of this license, visit http://creativecommons.org/licenses/by/4.0/.

                History
                : 6 December 2017
                : 19 March 2018
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