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A kinetic model for the reverse water gas shift and methanol formation reactions over metallic copper sites

https://doi.org/10.2139/ssrn.7578611
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Outgoing claims: the papers this work cites, builds on, or argues with.

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Calculation of Thermochemical Functions
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Quasi‐Homogeneous Methanol Synthesis Over Highly Active Copper Nanoparticles
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Cu‐Bound Formates are Main Reaction Intermediates during CO 2 Hydrogenation to Methanol over Cu/ZrO 2
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Methanol Synthesis from CO/CO2/H2over Cu/ZnO/Al2O3at Differential and Finite Conversions
inferredcites →https://doi.org/10.1007/bf00806097openalex-snapshot
On the activation energies of the forward and reverse water-gas shift reaction
inferredcites →https://doi.org/10.1007/bf00808595openalex-snapshot
Methanol synthesis and reverse water-gas shift kinetics over clean polycrystalline copper
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Isotope Effects in Methanol Synthesis and the Reactivity of Copper Formates on a Cu/SiO2 Catalyst
inferredcites →https://doi.org/10.1007/s10562-020-03162-7openalex-snapshot
Quantification of Formate and Oxygen Coverages on Cu Under Industrial Methanol Synthesis Conditions
inferredcites →https://doi.org/10.1016/0021-9517(79)90128-3openalex-snapshot
Entropies of adsorption in heterogeneous catalytic reactions
inferredcites →https://doi.org/10.1016/0021-9517(80)90061-5openalex-snapshot
Kinetics and mechanism of the CO shift on Cu/ZnO1. Kinetics of the forward and reverse CO shift reactions
inferredcites →https://doi.org/10.1016/0021-9517(87)90341-1openalex-snapshot
A surface science investigation of the water-gas shift reaction on Cu(111)
inferredcites →https://doi.org/10.1016/0021-9517(92)90210-9openalex-snapshot
Kinetics of the reverse water-gas shift reaction over Cu(110)
inferredcites →https://doi.org/10.1016/0039-6028(75)90113-2openalex-snapshot
Infrared spectroscopy of chemisorbed carbon monoxide on copper
inferredcites →https://doi.org/10.1016/0039-6028(79)90078-5openalex-snapshot
Observation of formate species on a copper (100) surface by high resolution electron energy loss spectroscopy
inferredcites →https://doi.org/10.1016/0039-6028(83)90021-3openalex-snapshot
An iras study of formic acid and surface formate adsorbed on Cu(110)
inferredcites →https://doi.org/10.1016/0045-7949(85)90039-2openalex-snapshot
First-order, second-moment methods
inferredcites →https://doi.org/10.1016/j.apcatb.2024.124198openalex-snapshot
Realizing synergy between Cu, Ga, and Zr for selective CO2 hydrogenation to methanol
inferredcites →https://doi.org/10.1016/j.cej.2023.147732openalex-snapshot
Mechanistic insights into the role of zinc oxide, zirconia and ceria supports in Cu-based catalysts for CO 2 hydrogenation to methanol
inferredcites →https://doi.org/10.1016/j.ces.2004.04.028openalex-snapshot
The effects of diffusion mechanism and void structure on transport rates and tortuosity factors in complex porous structures
inferredcites →https://doi.org/10.1016/j.jcat.2008.05.024openalex-snapshot
Dimer saddle point searches to determine the reactivity of formate on Cu(111)
inferredcites →https://doi.org/10.1016/j.jcat.2010.01.009openalex-snapshot
Glycine–nitrate combustion synthesis of CuO–ZnO–ZrO2 catalysts for methanol synthesis from CO2 hydrogenation
inferredcites →https://doi.org/10.1016/j.jcat.2012.10.028openalex-snapshot
Mechanistic studies of methanol synthesis over Cu from CO/CO2/H2/H2O mixtures: The source of C in methanol and the role of water
inferredcites →https://doi.org/10.1016/j.jcat.2018.11.012openalex-snapshot
Mechanism and structure sensitivity of methanol synthesis from CO2 over SiO2-supported Cu nanoparticles
inferredcites →https://doi.org/10.1016/j.jcat.2019.12.022openalex-snapshot
Probing into the multifunctional role of copper species and reaction pathway on copper-cerium-zirconium catalysts for CO2 hydrogenation to methanol using high pressure in situ DRIFTS
inferredcites →https://doi.org/10.1016/s0039-6028(87)80221-2openalex-snapshot
Quantum chemical studies of formate on Cu(100) and Cu(110)
inferredcites →https://doi.org/10.1016/s0039-6028(99)00605-6openalex-snapshot
Adsorption of the formate species on copper surfaces: a DFT study
inferredcites →https://doi.org/10.1016/s0167-2991(97)80427-2openalex-snapshot
A microkinetic analysis of the reverse water gas shift reaction
inferredcites →https://doi.org/10.1016/s0926-860x(96)00267-0openalex-snapshot
In-situ surface and gas phase analysis for kinetic studies under transient conditions The catalytic hydrogenation of CO2
inferredcites →https://doi.org/10.1016/s0926-860x(96)00369-9openalex-snapshot
Kinetic study of the reverse water-gas shift reaction over CuO/ZnO/Al2O3 catalysts
inferredcites →https://doi.org/10.1021/acs.accounts.5c00599openalex-snapshot
Nature and Dynamics of Active Sites in Cu-Based Catalysts for the CO 2 Hydrogenation to Methanol
inferredcites →https://doi.org/10.1021/acs.chemrev.3c00148openalex-snapshot
The Enigma of Methanol Synthesis by Cu/ZnO/Al2O3-Based Catalysts
inferredcites →https://doi.org/10.1021/acs.chemrev.9b00723openalex-snapshot
Recent Advances in Carbon Dioxide Hydrogenation to Methanol via Heterogeneous Catalysis
inferredcites →https://doi.org/10.1021/acs.jpcb.7b06901openalex-snapshot
Hydrogenation of CO2 on ZnO/Cu(100) and ZnO/Cu(111) Catalysts: Role of Copper Structure and Metal–Oxide Interface in Methanol Synthesis
inferredcites →https://doi.org/10.1021/acs.jpcc.0c08262openalex-snapshot
Surface Orientation and Pressure Dependence of CO 2 Activation on Cu Surfaces
inferredcites →https://doi.org/10.1021/acs.jpcc.2c03723openalex-snapshot
CO2 Hydrogenation to Methanol over Inverse ZrO2/Cu(111) Catalysts: The Fate of Methoxy under Dry and Wet Conditions
inferredcites →https://doi.org/10.1021/acs.jpclett.3c01692openalex-snapshot
Cu Facet-Dependent Elementary Surface Reaction Kinetics of CO2 Hydrogenation to Methanol Catalyzed by ZrO2/Cu Inverse Catalysts
inferredcites →https://doi.org/10.1021/acscatal.2c01099openalex-snapshot
Experimental and Computational Synergistic Design of Cu and Fe Catalysts for the Reverse Water–Gas Shift: A Review
inferredcites →https://doi.org/10.1021/acscatal.4c04577openalex-snapshot
Interdependence Between the Extent of Ga Promotion, the Nature of Active Sites, and the Reaction Mechanism Over Cu Catalysts for CO 2 Hydrogenation to Methanol
inferredcites →https://doi.org/10.1021/acscatal.5c01716openalex-snapshot
ZrO2 Morphology-Dependent Cu–ZrO2 Interfacial Catalysis in CO2 Hydrogenation to Methanol Reaction
inferredcites →https://doi.org/10.1021/acscatal.9b02412openalex-snapshot
Surface Lewis Acidity of Periphery Oxide Species as a General Kinetic Descriptor for CO2 Hydrogenation to Methanol on Supported Copper Nanoparticles
inferredcites →https://doi.org/10.1021/ja0768237openalex-snapshot
On the Mechanism of Low-Temperature Water Gas Shift Reaction on Copper
inferredcites →https://doi.org/10.1021/jacs.2c02797openalex-snapshot
Hydrogenation of Formate Species Using Atomic Hydrogen on a Cu(111) Model Catalyst
inferredcites →https://doi.org/10.1021/jacs.8b07906openalex-snapshot
Steps Control the Dissociation of CO2 on Cu(100)
inferredcites →https://doi.org/10.1021/jp002644zopenalex-snapshot
Structure-Dependent Kinetics for Synthesis and Decomposition of Formate Species over Cu(111) and Cu(110) Model Catalysts
inferredcites →https://doi.org/10.1021/jp104068kopenalex-snapshot
(Non)formation of Methanol by Direct Hydrogenation of Formate on Copper Catalysts
inferredcites →https://doi.org/10.1023/a:1019071117449openalex-snapshot
Mechanism of CO formation in reverse water–gas shift reaction over Cu/Al2O3 catalyst
inferredcites →https://doi.org/10.1038/s41929-024-01236-yopenalex-snapshot
Atom-by-atom design of Cu/ZrOx clusters on MgO for CO2 hydrogenation using liquid-phase atomic layer deposition
inferredcites →https://doi.org/10.1039/c4cs00122bopenalex-snapshot
Recycling of carbon dioxide to methanol and derived products – closing the loop
inferredcites →https://doi.org/10.1039/c4cy00848kopenalex-snapshot
The role of copper particle size in low pressure methanol synthesis via CO 2 hydrogenation over Cu/ZnO catalysts
inferredcites →https://doi.org/10.1039/c6cp00967kopenalex-snapshot
Different routes to methanol: inelastic neutron scattering spectroscopy of adsorbates on supported copper catalysts
inferredcites →https://doi.org/10.1039/d0dt00754dopenalex-snapshot
Mechanism of CO 2 conversion to methanol over Cu(110) and Cu(100) surfaces
inferredcites →https://doi.org/10.1039/d2nr02612kopenalex-snapshot
Competition between reverse water gas shift reaction and methanol synthesis from CO 2 : influence of copper particle size
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