Interface mediated CO2 hydrogenation on inverse supported ZrO2/Ni(1 1 1) nanocluster catalyst
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Research context
OpenAlex topics: Catalysts for Methane Reforming · Carbon dioxide utilization in catalysis · Catalytic Processes in Materials Science
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References (60)
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1. Advances in the design of heterogeneous catalysts and thermocatalytic processes for CO2 utilization10.1021/acscatal.0c04273 ↗
2. Thermochemical CO2 hydrogenation to single carbon products: scientific and technological challenges10.1021/acsenergylett.8b00740 ↗
3. Inverse oxide/metal catalysts for CO2 hydrogenation to methanol10.1021/acs.energyfuels.2c02131 ↗
4. Photocatalytic reduction of carbon dioxide to methane at the Pd-supported TiO2 interface: mechanistic insights from theoretical studies10.1021/acscatal.2c01519 ↗
5. Ni-In Synergy in CO2 Hydrogenation to Methanol10.1021/acscatal.1c03170 ↗
6. Tandem Catalysis of Direct CO2 Hydrogenation to Higher Alcohols10.1021/acscatal.1c01610 ↗
7. Selective conversion of CO2 to isobutane-enriched C4 alkanes over InZrOx-Beta composite catalyst10.1038/s41467-023-38336-5 ↗
8. Rhenium-promoted selective CO2 methanation on Ni-based catalyst10.1016/j.jcou.2018.04.010 ↗
9. Synergistic Effect of Cu Single Atoms and Au-Cu Alloy Nanoparticles on TiO2 for Efficient CO2 Photoreduction10.1021/acsnano.1c03961 ↗
10. Enhancing activity for carbon dioxide methanation by encapsulating (111) facet Ni particle in metal–organic frameworks at low temperature10.1016/j.jcat.2017.02.031 ↗
11. Support Effect and Surface Reconstruction in In2O3/m-ZrO2 Catalyzed CO2 Hydrogenation10.1021/acscatal.2c00207 ↗
12. Effect of Sm Doping on CO2-to-Methanol Hydrogenation of Cu/Amorphous-ZrO2 Catalysts10.1021/acs.jpcc.1c03444 ↗
13. ZnO-Promoted Inverse ZrO2–Cu Catalysts for CO2-Based Methanol Synthesis under Mild Conditions10.1021/acssuschemeng.1c04751 ↗
14. Surface and interface design for heterogeneous catalysis10.1039/C8CP05717F ↗
15. Water-Gas Shift Reaction on a Highly Active Inverse CeOx/Cu(111) Catalyst: Unique Role of Ceria Nanoparticles10.1002/anie.200903918 ↗
16. Contrasting the Role of Ni/Al2O3 Interfaces in Water-Gas Shift and Dry Reforming of Methane10.1021/jacs.7b08984 ↗
17. Critical Role of Interfacial Sites between Nickel and CeO2 Support in Dry Reforming of Methane: Revisit of Reaction Mechanism and Origin of Stability10.1021/acs.jpcc.9b09856 ↗
18. Elucidating the Role of the Metal Catalyst and Oxide Support in the Ru/CeO2-Catalyzed CO2 Methanation Mechanism10.1021/acs.jpcc.1c07537 ↗
19. Construction of stabilized bulk-nano interfaces for highly promoted inverse CeO2/Cu catalyst10.1038/s41467-019-11407-2 ↗
20. Rodriguez, Unique Properties of Ceria Nanoparticles Supported on Metals: Novel Inverse Ceria/Copper Catalysts for CO Oxidation and the Water-Gas Shift Reaction10.1021/ar300231p ↗
21. Inverse ZrO2/Cu as a highly efficient methanol synthesis catalyst from CO2 hydrogenation10.1038/s41467-020-19634-8 ↗
22. Optimizing Binding Energies of Key Intermediates for CO2 Hydrogenation to Methanol over Oxide-Supported Copper10.1021/jacs.6b05791 ↗
23. CO2-to-Methanol Hydrogenation on Zirconia-Supported Copper Nanoparticles: Reaction Intermediates and the Role of the Metal-Support Interface10.1002/anie.201610166 ↗
24. Reactivity of a Zirconia-Copper Inverse Catalyst for CO2 Hydrogenation10.1021/acs.jpcc.0c06624 ↗
25. CO2 Hydrogenation on ZrO2/Cu(111) Surfaces: Production of Methane and Methanol10.1021/acs.iecr.1c03229 ↗
26. Preparation and Structural Characterization of ZrO2/CuOx/Cu(111) Inverse Model Catalysts10.1021/acs.jpcc.0c00852 ↗
27. Efficient Ceria-Platinum Inverse Catalyst for Partial Oxidation of Methanol10.1021/acs.langmuir.6b01316 ↗
28. What Changes on the Inverse Catalyst? Insights from CO Oxidation on Au-Supported Ceria Nanoparticles Using Ab Initio Molecular Dynamics10.1021/acscatal.9b05175 ↗
29. Formation of a ZnO Overlayer in Industrial Cu/ZnO/Al2O3 Catalysts Induced by Strong Metal-Support Interactions10.1002/anie.201411581 ↗
30. Promoting Strong Metal Support Interaction: Doping ZnO for Enhanced Activity of Cu/ZnO: M (M = Al, Ga, Mg) Catalysts10.1021/acscatal.5b00188 ↗
31. In situ NAP-XPS spectroscopy during methane dry reforming on ZrO2/Pt(1 1 1) inverse model catalyst
32. Assessing the Activity of Ni Clusters Supported on TiC(001) toward CO2 and H2 Dissociation10.1021/acs.jpcc.1c03219 ↗
33. New insights into CO2 methanation mechanisms on Ni/MgO catalysts by DFT calculations: Elucidating Ni and MgO roles and support effects10.1016/j.jcou.2019.04.022 ↗
34. CO2 Activation on Ni/γ–Al2O3 Catalysts by First-Principles Calculations: From Ideal Surfaces to Supported Nanoparticles10.1021/acscatal.6b00822 ↗
35. Mechanisms of CO2 hydrogenative conversion on supported Ni/ZrO2 catalyst10.1016/j.apsusc.2022.154151 ↗
36. Efficient iterative schemes for ab initio total-energy calculations using a plane-wave basis set10.1103/PhysRevB.54.11169 ↗
37. Assessment of the Perdew–Burke–Ernzerhof exchange-correlation functional10.1063/1.478401 ↗
38. Toward reliable density functional methods without adjustable parameters: The PBE0 model10.1063/1.478522 ↗
39. Projector Augmented-Wave Method10.1103/PhysRevB.50.17953 ↗
40. A climbing image nudged elastic band method for finding saddle points and minimum energy paths10.1063/1.1329672 ↗
41. VASPKIT: A user-friendly interface facilitating high-throughput computing and analysis using VASP code10.1016/j.cpc.2021.108033 ↗
42. Surface energy calculation of the fcc metals by using the MAEAM10.1016/j.ssc.2007.07.012 ↗
43. Adlayer Dynamics Drives CO Activation in Ru-Catalyzed Fischer-Tropsch Synthesis10.1021/acscatal.8b01232 ↗
44. Quantitative Studies of the Key Aspects in Selective Acetylene Hydrogenation on Pd(111) by Microkinetic Modeling with Coverage Effects and Molecular Dynamics10.1021/acscatal.0c05345 ↗
45. Electronegativity Is the Average One-Electron Energy of the Valence-Shell Electrons in Ground-State Free Atoms10.1021/ja00207a003 ↗
46. CO2 and H2 Adsorption and Reaction at Nin/YSZ(111) Interfaces: A Density Functional Theory Study10.1021/acs.jpcc.8b03488 ↗
47. First principles study on methane reforming over Ni/TiO2(110) surface in solid oxide fuel cells under dry and wet atmospheres10.1007/s40843-019-1218-1 ↗
48. Mechanism of CO2 Reforming of CH4 on a Pt4/ZrO2(101) Surface: A Density Functional Theory Study10.1021/acs.jpcb.7b03104 ↗
49. Dry Reforming of Methane on Single-Site Ni/MgO Catalysts: Importance of Site Confinement10.1021/acscatal.8b02277 ↗
50. Cooperation of Ni and CaO at Interface for CO2 Reforming of CH4: A Combined Theoretical and Experimental Study10.1021/acscatal.9b02286 ↗
51. Insights into the mechanisms of CO2 methanation on Ni(111) surfaces by density functional theory10.1016/j.apsusc.2015.05.173 ↗
52. DFT and microkinetic investigation of methanol synthesis via CO2 hydrogenation on Ni(111)-based surfaces10.1039/C9CP02970B ↗
53. Hydrogen adsorption on c-ZrO2(111), t-ZrO2(101), and m-ZrO2(111) surfaces and their oxygen-vacancy defect for hydrogen sensing and storage: A first-principles investigation10.1016/j.matlet.2021.130243 ↗
54. Hydrogen Adsorption on Monoclinic (111) and (101) ZrO2 Surfaces: A Periodic ab Initio Study10.1021/jp103463s ↗
55. Hydrogen adsorption on the tetragonal ZrO2(101) surface: a theoretical study of an important catalytic reactant10.1039/b202330j ↗
56. Multiscale Study of the Mechanism of Catalytic CO2 Hydrogenation: Role of the Ni(111) Facets10.1021/acscatal.0c01599 ↗
57. A theoretical study on the role of water and its derivatives in acetic acid steam reforming on Ni(111)10.1016/j.apsusc.2017.05.003 ↗
58. Ab initio study of CO2 hydrogenation mechanisms on inverse ZnO/Cu catalysts10.1016/j.jcat.2018.01.035 ↗
59. Zirconia-modified copper catalyst for CO2 conversion to methanol from DFT study10.1016/j.apsusc.2020.146900 ↗
60. Structure Sensitivity of CO2 Conversion over Nickel Metal Nanoparticles Explained by Micro-Kinetics Simulations10.1021/jacsau.2c00430 ↗