Platinum Graphene Catalytic Condenser for Millisecond Programmable Metal Surfaces
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November 2022 |
Microkinetic assessment of electrocatalytic oxygen evolution reaction over iridium oxide in unbuffered conditions
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November 2020 |
Dynamic electrocatalysis: Examining resonant catalytic rate enhancement under oscillating electrochemical potential
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December 2022 |
Evaluation of the degree of rate control via automatic differentiation
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March 2022 |
Operando identification of site-dependent water oxidation activity on ruthenium dioxide single-crystal surfaces
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May 2020 |
The Ir–OOOO–Ir transition state and the mechanism of the oxygen evolution reaction on IrO2(110)
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January 2022 |
Ab initio study of oxygenreduction mechanism at Pt4cluster
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January 2010 |
Discovering Competing Electrocatalytic Mechanisms and Their Overpotentials: Automated Enumeration of Oxygen Evolution Pathways
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November 2020 |
The Reaction Mechanism with Free Energy Barriers at Constant Potentials for the Oxygen Evolution Reaction at the IrO 2 (110) Surface
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December 2016 |
Analysis of Acid-Stable and Active Oxides for the Oxygen Evolution Reaction
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November 2020 |
Universality in Oxygen Evolution Electrocatalysis on Oxide Surfaces
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March 2011 |
Activating Inert ZnO by Surface Cobalt Doping for Efficient Water Oxidation in Neutral Media
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October 2019 |
Two-sites are better than one: revisiting the OER mechanism on CoOOH by DFT with electrode polarization
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January 2020 |
Impact of Pulsed Electrochemical Reduction of CO 2 on the Formation of C 2+ Products over Cu
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September 2020 |
Partial and complete reduction of O2 by hydrogen on transition metal surfaces
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September 2010 |
Microkinetic Modeling: A Tool for Rational Catalyst Design
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November 2020 |
Electrocatalytic properties of transition metal oxides for oxygen evolution reaction
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May 1986 |
Unifying theoretical framework for deciphering the oxygen reduction reaction on platinum
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January 2018 |
Cation Overcrowding Effect on the Oxygen Evolution Reaction
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September 2021 |
Ab Initio Thermodynamics and Kinetics of the Lattice Oxygen Evolution Reaction in Iridium Oxides
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March 2021 |
Perspectives on the Competition between the Electrochemical Water and N2 Oxidation on a TiO2(110) Electrode
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June 2022 |
Revealing Energetics of Surface Oxygen Redox from Kinetic Fingerprint in Oxygen Electrocatalysis
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August 2019 |
Interpreting Tafel behavior of consecutive electrochemical reactions through combined thermodynamic and steady state microkinetic approaches
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January 2020 |
Electrolysis of water on oxide surfaces
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September 2007 |
Kinetic Properties of Oxygen Evolution Reaction Catalysis in Hematite
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May 2023 |
Potential-dependent transition of reaction mechanisms for oxygen evolution on layered double hydroxides
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July 2023 |
Introducing Brønsted acid sites to accelerate the bridging-oxygen-assisted deprotonation in acidic water oxidation
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August 2022 |
Resonance-Promoted Formic Acid Oxidation via Dynamic Electrocatalytic Modulation
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July 2020 |
The Catalytic Mechanics of Dynamic Surfaces: Stimulating Methods for Promoting Catalytic Resonance
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September 2020 |
The oxygen reduction reaction mechanism on Pt(111) from density functional theory calculations
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November 2010 |
Water‐Assisted Chemical Route Towards the Oxygen Evolution Reaction at the Hydrated (110) Ruthenium Oxide Surface: Heterogeneous Catalysis via DFT‐MD and Metadynamics Simulations
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October 2021 |
Insights into the Oxygen Evolution Reaction on Graphene-Based Single-Atom Catalysts from First-Principles-Informed Microkinetic Modeling
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March 2023 |
Structure Sensitivity of the Oxygen Evolution Reaction Catalyzed by Cobalt(II,III) Oxide
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November 2015 |
Oxygen desorption – Critical step for the oxygen evolution reaction
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December 2023 |
Water electrolysis
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October 2022 |
A survey of Earth-abundant metal oxides as oxygen evolution electrocatalysts in acidic media (pH < 1)
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January 2023 |
The low overpotential regime of acidic water oxidation part II: trends in metal and oxygen stability numbers
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January 2022 |
First principles based mean field model for oxygen reduction reaction
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January 2011 |
Improving the intrinsic activity of electrocatalysts for sustainable energy conversion: where are we and where can we go?
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December 2021 |
Catalytic resonance theory: Negative dynamic surfaces for programmable catalysts
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January 2022 |
Dynamic Boundary Layer Simulation of Pulsed CO 2 Electrolysis on a Copper Catalyst
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March 2021 |
Insights into the Electrochemical Oxygen Evolution Reaction with ab Initio Calculations and Microkinetic Modeling: Beyond the Limiting Potential Volcano
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July 2019 |
Activity–Stability Trends for the Oxygen Evolution Reaction on Monometallic Oxides in Acidic Environments
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July 2014 |
Principles of Dynamic Heterogeneous Catalysis: Surface Resonance and Turnover Frequency Response
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May 2019 |
Kinetics-Based Computational Catalyst Design Strategy for the Oxygen Evolution Reaction on Transition-Metal Oxide Surfaces
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October 2018 |
Tafel Kinetics of Electrocatalytic Reactions: From Experiment to First-Principles
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November 2014 |
Large-scale hydrogen production via water electrolysis: a techno-economic and environmental assessment
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January 2022 |
Towards identifying the active sites on RuO 2 (110) in catalyzing oxygen evolution
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January 2017 |
Mechanistic understanding of pH effects on the oxygen evolution reaction
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February 2022 |
Using Brønsted-Evans-Polanyi relations to predict electrode potential-dependent activation energies
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August 2018 |
Theoretical and experimental study of the effects of cobalt and nickel doping within IrO2 on the acidic oxygen evolution reaction
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April 2022 |
Universal Differential Equations for Scientific Machine Learning
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preprint
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January 2020 |
Origin of the Overpotential for Oxygen Reduction at a Fuel-Cell Cathode
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November 2004 |
Beyond the Rate-Determining Step in the Oxygen Evolution Reaction over a Single-Crystalline IrO 2 (110) Model Electrode: Kinetic Scaling Relations
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June 2019 |
Matplotlib: A 2D Graphics Environment
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January 2007 |
Generalizable Trends in Electrochemical Protonation Barriers
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May 2021 |
Enhancing Oxygen Evolution Reaction Activity by Using Switchable Polarization in Ferroelectric InSnO2N
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October 2021 |
Theoretical Insights on the Synergy and Competition between Thermochemical and Electrochemical Steps in Oxygen Electroreduction
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November 2020 |
Key role of chemistry versus bias in electrocatalytic oxygen evolution
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November 2020 |
Theoretical Modeling of Electrochemical Proton-Coupled Electron Transfer
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March 2022 |
Theoretical insights into the oxygen reduction reaction on PtCu (1 1 1): Effects of surface defect and acidic solvent
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December 2021 |
Electrochemistry at Back-Gated, Ultrathin ZnO Electrodes: Field-Effect Modulation of Heterogeneous Electron Transfer Rate Constants by 30× with Enhanced Gate Capacitance
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February 2023 |
Microkinetic modeling in electrocatalysis: Applications, limitations, and recommendations for reliable mechanistic insights
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December 2021 |
Catalytic resonance theory: superVolcanoes, catalytic molecular pumps, and oscillatory steady state
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January 2019 |
First-Principles Free-Energy Barriers for Photoelectrochemical Surface Reactions: Proton Abstraction at TiO 2 ( 110 )
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December 2016 |
Unifying Kinetic and Thermodynamic Analysis of 2 e – and 4 e – Reduction of Oxygen on Metal Surfaces
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March 2014 |
The Comprehensive Understanding of 10 mA cmgeo−2 as an Evaluation Parameter for Electrochemical Water Splitting
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July 2018 |
Synergy between Fe and Ni in the optimal performance of (Ni,Fe)OOH catalysts for the oxygen evolution reaction
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May 2018 |
Adsorption Energy in Oxygen Electrocatalysis
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September 2022 |
Alumina Graphene Catalytic Condenser for Programmable Solid Acids
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May 2022 |
Catalytic resonance of ammonia synthesis by simulated dynamic ruthenium crystal strain
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January 2022 |
Julia: A Fresh Approach to Numerical Computing
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January 2017 |
Electrocatalytic Oxygen Evolution Reaction in Acidic Environments - Reaction Mechanisms and Catalysts
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October 2016 |
Advances in Thermodynamic-Kinetic Model for Analyzing the Oxygen Evolution Reaction
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July 2020 |
Flexible and Extensive Platinum Ion Gel Condensers for Programmable Catalysis
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December 2023 |
First Principles Tafel Kinetics for Resolving Key Parameters in Optimizing Oxygen Electrocatalytic Reduction Catalyst
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June 2012 |
A first principles study of oxygen reduction reaction on a Pt(111) surface modified by a subsurface transition metal M (M = Ni, Co, or Fe)
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January 2011 |
Dynamic strain and switchable polarization: A pathway to enhance the oxygen evolution reaction on InSnO2N
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September 2022 |
Simulation of Potential-Dependent Activation Energies in Electrocatalysis: Mechanism of O–O Bond Formation on RuO 2
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July 2021 |
Water electrolysis: from textbook knowledge to the latest scientific strategies and industrial developments
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January 2022 |
Microkinetic Analysis of the Oxygen Evolution Performance at Different Stages of Iridium Oxide Degradation
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July 2022 |
Self-Supported Hydrous Iridium–Nickel Oxide Two-Dimensional Nanoframes for High Activity Oxygen Evolution Electrocatalysts
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September 2018 |
Dynamic Promotion of the Oxygen Evolution Reaction via Programmable Metal Oxides
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preprint
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January 2024 |
Endergonic synthesis driven by chemical fuelling
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March 2024 |
The Degree of Rate Control: A Powerful Tool for Catalysis Research
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March 2017 |
Towards a generic understanding of oxygen evolution reaction kinetics in polymer electrolyte water electrolysis
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January 2020 |
Calculation of the Tafel slope and reaction order of the oxygen evolution reaction between pH 12 and pH 14 for the adsorbate mechanism
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November 2022 |
Stiff differential equations solved by Radau methods
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November 1999 |
Microkinetic model for pH- and potential-dependent oxygen evolution during water splitting on Fe-doped β-NiOOH
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January 2020 |
Multiple Reaction Pathways for the Oxygen Evolution Reaction May Contribute to IrO 2 (110)’s High Activity
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February 2021 |
Present and Projected Developments in Hydrogen Production: A Technological Review⁎
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June 2022 |
Non-Faradaic Promotion of Ethylene Hydrogenation under Oscillating Potentials
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April 2021 |
Oxygen evolution reaction: a perspective on a decade of atomic scale simulations
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January 2020 |
Orientation-Dependent Oxygen Evolution on RuO 2 without Lattice Exchange
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March 2017 |
Modeling Potential-Dependent Electrochemical Activation Barriers: Revisiting the Alkaline Hydrogen Evolution Reaction
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November 2021 |
Continuous and Reversible Tuning of Electrochemical Reaction Kinetics on Back-Gated 2D Semiconductor Electrodes: Steady-State Analysis Using a Hydrodynamic Method
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November 2018 |
How are transition states modeled in heterogeneous electrocatalysis?
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June 2022 |
Standard and Reversible Hydrogen Electrodes: Theory, Design, Operation, and Applications
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July 2020 |
Enhancing the connection between computation and experiments in electrocatalysis
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May 2022 |
Sustainable oxygen evolution electrocatalysis in aqueous 1 M H2SO4 with earth abundant nanostructured Co3O4
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July 2022 |
Descriptors controlling the catalytic activity of metallic surfaces toward water splitting
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November 2010 |
A Two-Dimensional MoS 2 Catalysis Transistor by Solid-State Ion Gating Manipulation and Adjustment (SIGMA)
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September 2019 |
Combining theory and experiment in electrocatalysis: Insights into materials design
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January 2017 |
Recent advances in understanding oxygen evolution reaction mechanisms over iridium oxide
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January 2021 |
Forward-Mode Automatic Differentiation in Julia
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preprint
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January 2016 |
Theory of multiple proton–electron transfer reactions and its implications for electrocatalysis
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January 2013 |
Fundamental understanding of the acidic oxygen evolution reaction: mechanism study and state-of-the-art catalysts
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January 2020 |
Catalytic Resonance of Methane Steam Reforming by Dynamically Applied Charges
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preprint
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January 2024 |
Fabrication of Large-Area Metal-on-Carbon Catalytic Condensers for Programmable Catalysis
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December 2023 |
DifferentialEquations.jl – A Performant and Feature-Rich Ecosystem for Solving Differential Equations in Julia
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May 2017 |
Accelerating Electro-oxidation Turnover Rates via Potential-Modulated Stimulation of Electrocatalytic Activity
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November 2020 |
Ratcheting synthesis
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December 2023 |
Mechanism and Tafel Lines of Electro-Oxidation of Water to Oxygen on RuO 2 (110)
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December 2010 |
Field Effect Modulation of Electrocatalytic Hydrogen Evolution at Back-Gated Two-Dimensional MoS 2 Electrodes
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August 2019 |
Dynamic Control of Elementary Step Energetics via Pulsed Illumination Enhances Photocatalysis on Metal Nanoparticles
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October 2020 |
Artificial Molecular Ratchets: Tools Enabling Endergonic Processes
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August 2023 |
Programmable catalysis by support polarization: elucidating and breaking scaling relations
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November 2023 |
Toward Settling the Debate on the Role of Fe 2 O 3 Surface States for Water Splitting
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October 2015 |
Catalytic resonance theory: Circumfluence of programmable catalytic loops
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February 2024 |
Microkinetic Barriers of the Oxygen Evolution on the Oxides of Iridium, Ruthenium and their Binary Mixtures
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September 2022 |
Imposed oscillations of kinetic barriers can cause an enzyme to drive a chemical reaction away from equilibrium
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December 1993 |
Thermodynamic theory of multi-electron transfer reactions: Implications for electrocatalysis
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September 2011 |