Mo doped Ru-based cluster to promote alkaline hydrogen evolution with ultra-low Ru loading

Wang, 2021, Recent developments of nanocatalyzed liquid-phase hydrogen generation, Chem. Soc. Rev., 50, 3437, 10.1039/D0CS00515K Zheng, 2018, The hydrogen evolution reaction in alkaline solution: from theory, single crystal models, to practical electrocatalysts, Angew. Chem. Int. Ed., 57, 7568, 10.1002/anie.201710556 Yao, 2022, Strong electronic coupling between ruthenium single atoms and ultrafine nanoclusters enables economical and effective hydrogen production, Appl. Catal. B, 312, 10.1016/j.apcatb.2022.121378 Choi, 2018, Effects of metal-doping on hydrogen evolution reaction catalyzed by MAu24 and M2Au36 nanoclusters (M = Pt, Pd), ACS Appl. Mater. Interfaces, 10, 44645, 10.1021/acsami.8b16178 Kettler, 2003, Platinum group metals in catalysis: fabrication of catalysts and catalyst precursors, Org. Proc. Res. Dev., 7, 342, 10.1021/op034017o Jiang, 2014, A cost-effective 3D hydrogen evolution cathode with high catalytic activity: FeP nanowire array as the active phase, Angew. Chem. Int. Ed., 53, 12855, 10.1002/anie.201406848 Hu, 2022, Subnanometric Ru clusters with upshifted D band center improve performance for alkaline hydrogen evolution reaction, Nat. Commun., 13, 3958, 10.1038/s41467-022-31660-2 Danilovic, 2013, Electrocatalysis of the HER in acid and alkaline media, J. Serb. Chem. Soc., 78, 2007, 10.2298/JSC131118136D Trasatti, 1972, Work function, electronegativity, and electrochemical behavior of metals: III. Electrolytic hydrogen evolution in acid solutions, J. Electroanal. Chem., 39, 163, 10.1016/S0022-0728(72)80485-6 Jiang, 2021, The heterostructure of Ru2P/WO3/NPC synergistically promotes H2O dissociation for improved hydrogen evolution, Angew. Chem. Int. Ed., 60, 4110, 10.1002/anie.202014411 Koike, 2014, Visible-light radical reaction designed by Ru- and Ir-based photoredox catalysis, Inorg. Chem. Front., 1, 562, 10.1039/C4QI00053F Tomasini, 2021, Towards mild conditions by predictive catalysis via sterics in the Ru-catalyzed hydrogenation of thioesters, Mol. Catal., 510 Wang, 2022, An all-in-one zeolite@ Ru-Al2O3 nanoplatform towards highly efficient, anticoking, and recyclable hydrocarbon cracking catalysis, MT Nano, 20, 100244 Li, 2021, Unveiling the nature of Pt single-atom catalyst during electrocatalytic hydrogen evolution and oxygen reduction reactions, Small, 17 Li, 2021, Porous γ-Fe2O3 nanoparticle decorated with atomically dispersed platinum: study on atomic site structural change and gas sensor activity evolution, Nano Res., 14, 1435, 10.1007/s12274-020-3199-5 Sun, 2022, Supported Cu3 cluster on graphitic carbon nitride as an efficient catalyst for CO electroreduction to propene, J. Mater. Chem. A, 10, 14460, 10.1039/D2TA02463B Xu, 2021, Organic wastewater treatment by a single-atom catalyst and electrolytically produced H2O2, Nat. Sustain., 4, 233, 10.1038/s41893-020-00635-w Zhang, 2021, Silver single-atom catalyst for efficient electrochemical CO2 reduction synthesized from thermal transformation and surface reconstruction, Angew. Chem. Int. Ed., 60, 6170, 10.1002/anie.202014718 Zhang, 2020, Stable monovalent aluminum(I) in a reduced phosphomolybdate cluster as an active acid catalyst, Chem. Sci., 12, 1886, 10.1039/D0SC05277A Zhou, 2021, Platinum single-atom catalyst coupled with transition metal/metal oxide heterostructure for accelerating alkaline hydrogen evolution reaction, Nat. Commun., 12, 3783, 10.1038/s41467-021-24079-8 Li, 2021, Implanting Ru nanoclusters into N-doped graphene for efficient alkaline hydrogen evolution, Carbon, 183, 362, 10.1016/j.carbon.2021.07.039 Fu, 2022, High-entropy alloy nanosheets for fine-tuning hydrogen evolution, ACS Catal., 12, 11955, 10.1021/acscatal.2c02778 Ologunagba, 2022, Pt- and Pd-modified transition metal nitride catalysts for the hydrogen evolution reaction, Phys. Chem. Chem. Phys., 24, 12149, 10.1039/D2CP00792D Shah, 2022, The role of alkali metal cations and platinum-surface hydroxyl in the alkaline hydrogen evolution reaction, Nat. Catal., 5, 923, 10.1038/s41929-022-00851-x Zhao, 2022, Correlating alkaline hydrogen electrocatalysis and hydroxide binding energies on Mo-modified Ru catalysts, ACS Sustain. Chem. Eng., 10, 1616, 10.1021/acssuschemeng.1c07306 McCrum, 2020, The role of adsorbed hydroxide in hydrogen evolution reaction kinetics on modified platinum, Nat. Energy, 5, 891, 10.1038/s41560-020-00710-8 Cui, 2021, Trace oxophilic metal induced surface reconstruction at buried RuRh cluster interfaces possesses extremely fast hydrogen redox kinetics, Nano Energy, 90, 10.1016/j.nanoen.2021.106579 Su, 2022, Recent advances in alkaline hydrogen oxidation reaction, J. Energy Chem., 66, 107, 10.1016/j.jechem.2021.07.015 Li, 2022, P and Mo dual doped Ru ultrasmall nanoclusters embedded in P-doped porous carbon toward efficient hydrogen evolution reaction, Adv. Energy Mater., 12, 2200029, 10.1002/aenm.202200029 Wang, 2017, One-pot process for hydrodeoxygenation of lignin to alkanes using Ru-based bimetallic and bifunctional catalysts supported on zeolite Y, ChemSusChem, 10, 1846, 10.1002/cssc.201700160 Yang, 2022, Amorphous Ru nanoclusters onto Co-doped 1D carbon nanocages enables efficient hydrogen evolution catalysis, Chin. J. Catal., 43, 110, 10.1016/S1872-2067(21)63921-9 Yu, 2019, Recent advances and prospective in ruthenium-based materials for electrochemical water splitting, ACS Catal., 9, 9973, 10.1021/acscatal.9b02457 Liu, 2022, Recent advances in carbon-supported noble-metal electrocatalysts for hydrogen evolution reaction: syntheses, structures, and properties, Adv. Energy Mater., 12 Li, 2019, Thermally driven structure and performance evolution of atomically dispersed FeN4 sites for oxygen reduction, Angew. Chem. Int. Ed., 58, 18971, 10.1002/anie.201909312 Sui, 2022, Advanced support materials and interactions for atomically dispersed noble-metal catalysts: from support effects to design strategies, Adv. Energy Mater., 12, 10.1002/aenm.202102556 Chen, 2020, Self-regenerative noble metal catalysts supported on high-entropy oxides, Chem. Commun., 56, 15056, 10.1039/D0CC05860B Mahmood, 2017, An efficient and pH-universal ruthenium-based catalyst for the hydrogen evolution reaction, Nat. Nanotechnol., 12, 441, 10.1038/nnano.2016.304 Wang, 2018, Spatially confined assembly of monodisperse ruthenium nanoclusters in a hierarchically ordered carbon electrode for efficient hydrogen evolution, Angew. Chem. Int. Ed., 57, 5848, 10.1002/anie.201801467 Wang, 2018, Highly uniform Ru nanoparticles over N-doped carbon: pH and temperature-universal hydrogen release from water reduction, Energy Environ. Sci., 11, 800, 10.1039/C7EE03345A Xu, 2018, Boosting the hydrogen evolution performance of ruthenium clusters through synergistic coupling with cobalt phosphide, Energy Environ. Sci., 11, 1819, 10.1039/C7EE03603E Jiang, 2017, Pt-like electrocatalytic behavior of Ru-MoO2 nanocomposites for the hydrogen evolution reaction, J. Mater. Chem., 5, 5475, 10.1039/C6TA09994G Lao, 2021, Manipulating the coordination chemistry of Ru–N(O)–C moieties for fast alkaline hydrogen evolution kinetics, Adv. Funct. Mater., 31, 10.1002/adfm.202100698 Qi, 2021, Bimetallic ZIF-derived Co/N-codoped porous carbon supported ruthenium catalysts for highly efficient hydrogen evolution reaction, Nanomaterials, 11, 1228, 10.3390/nano11051228 Li, 2018, Mechanochemically assisted synthesis of a Ru catalyst for hydrogen evolution with performance superior to Pt in both acidic and alkaline media, Adv. Mater., 30, 10.1002/adma.201870330 Xia, 2019, Low-cost porous ruthenium layer deposited on nickel foam as a highly active universal-pH electrocatalyst for the hydrogen evolution reaction, ChemSusChem, 12, 2780, 10.1002/cssc.201900472 Wang, 2019, Nitrogen-doped carbon-stabilized Ru nanoclusters as excellent catalysts for hydrogen production, ACS Sustainable Chem. Eng., 7, 1178, 10.1021/acssuschemeng.8b04823 Meng, 2021, Ru to W electron donation for boosted HER from acidic to alkaline on Ru/WNO sponges, Nano Energy, 80, 10.1016/j.nanoen.2020.105531 Pu, 2017, RuP2-Based catalysts with platinum-like activity and higher durability for the hydrogen evolution reaction at all pH values, Angew. Chem. Int. Ed., 56, 11559, 10.1002/anie.201704911 Cao, 2021, Construction of dual-site atomically dispersed electrocatalysts with Ru-C5 single atoms and Ru-O4 nanoclusters for accelerated alkali hydrogen evolution, Small, 17, 10.1002/smll.202101163 Wang, 2020, Promoted alkaline hydrogen evolution reaction performance of Ru/C by introducing TiO2 nanoparticles, ChemElectroChem, 7, 1182, 10.1002/celc.201902170 Qin, 2018, Low loading of RhxP and RuP on N, P codoped carbon as two trifunctional electrocatalysts for the oxygen and hydrogen electrode reactions, Adv. Energy Mater., 8 Tang, 2009, A grid-based Bader analysis algorithm without lattice bias, J. Phys. Condens. Matter, 21, 10.1088/0953-8984/21/8/084204 Bi, 2022, Boron doped graphdiyne: a metal-free peroxidase mimetic nanozyme for antibacterial application, Nano Res., 15, 1446, 10.1007/s12274-021-3685-4 Kresse, 1994, Ab initio molecular-dynamics simulation of the liquid-metal-amorphous-semiconductor transition in germanium, Phys. Rev. B, 49, 14251, 10.1103/PhysRevB.49.14251 Kresse, 1999, From ultrasoft pseudopotentials to the projector augmented-wave method, Phys. Rev. B, 59, 1758, 10.1103/PhysRevB.59.1758 Grimme, 2010, A consistent and accurate ab initio parametrization of density functional dispersion correction (DFT-D) for the 94 elements H–Pu, J. Chem. Phys., 132, 10.1063/1.3382344 Nørskov, 2004, Origin of the overpotential for oxygen reduction at a fuel-cell cathode, J. Phys. Chem. B, 108, 17886, 10.1021/jp047349j