相关参考文献
注意:仅列出部分参考文献,下载原文获取全部文献信息。Materials Screening by the Descriptor Gmax(η): The Free-Energy Span Model in Electrocatalysis
Samad Razzaq et al.
ACS CATALYSIS (2023)
Implications of Nonelectrochemical Reaction Steps on the Oxygen Evolution Reaction: Oxygen Dimer Formation on Perovskite Oxide and Oxynitride Surfaces
Nathalie Vonrueti et al.
ACS CATALYSIS (2022)
Statistical analysis of breaking scaling relation in the oxygen evolution reaction
Samad Razzaq et al.
ELECTROCHIMICA ACTA (2022)
Adsorption Energy in Oxygen Electrocatalysis
Junming Zhang et al.
CHEMICAL REVIEWS (2022)
On the shifting peak of volcano plots for oxygen reduction and evolution
Elizabeth Sargeant et al.
ELECTROCHIMICA ACTA (2022)
The Ir-OOOO-Ir transition state and the mechanism of the oxygen evolution reaction on IrO2(110)
Tobias Binninger et al.
ENERGY & ENVIRONMENTAL SCIENCE (2022)
Importance of the gas-phase error correction for O2 when using DFT to model the oxygen reduction and evolution reactions
Elizabeth Sargeant et al.
JOURNAL OF ELECTROANALYTICAL CHEMISTRY (2021)
The electrochemical-step asymmetry index
Kai S. Exner
METHODSX (2021)
Why the breaking of the OOH versus OH scaling relation might cause decreased electrocatalytic activity
Kai S. Exner
CHEM CATALYSIS (2021)
How oxidation state and lattice distortion influence the oxygen evolution activity in acid of iridium double perovskites
Maria Retuerto et al.
JOURNAL OF MATERIALS CHEMISTRY A (2021)
A Universal Descriptor for the Screening of Electrode Materials for Multiple-Electron Processes: Beyond the Thermodynamic Overpotential
Kai S. Exner
ACS CATALYSIS (2020)
Designing water splitting catalysts using rules of thumb: advantages, dangers and alternatives
Oriol Pique et al.
PHYSICAL CHEMISTRY CHEMICAL PHYSICS (2020)
Outlining the Scaling-Based and Scaling-Free Optimization of Electrocatalysts
Nitish Govindarajan et al.
ACS CATALYSIS (2019)
La1.5Sr0.5NiMn0.5Ru0.5O6 Double Perovskite with Enhanced ORR/OER Bifunctional Catalytic Activity
Maria Retuerto et al.
ACS APPLIED MATERIALS & INTERFACES (2019)
Na-doped ruthenium perovskite electrocatalysts with improved oxygen evolution activity and durability in acidic media
Maria Retuerto et al.
NATURE COMMUNICATIONS (2019)
Universal scaling relations for the rational design of molecular water oxidation catalysts with near-zero overpotential
Michael John Craig et al.
NATURE COMMUNICATIONS (2019)
Oxygen Evolution Reaction on Perovskites: A Multieffect Descriptor Study Combining Experimental and Theoretical Methods
Xi Cheng et al.
ACS CATALYSIS (2018)
Role of lattice oxygen content and Ni geometry in the oxygen evolution activity of the Ba-Ni-O system
Maria Retuerto et al.
JOURNAL OF POWER SOURCES (2018)
Energetic Span as a Rate-Determining Term for Electrocatalytic Volcanos
Junxiang Chen et al.
ACS CATALYSIS (2018)
Does the breaking of adsorption-energy scaling relations guarantee enhanced electrocatalysis?
Nitish Govindarajan et al.
CURRENT OPINION IN ELECTROCHEMISTRY (2018)
Potential- and Rate-Determining Step for Oxygen Reduction on Pt(111)
Vladimir Tripkovic et al.
JOURNAL OF PHYSICAL CHEMISTRY C (2017)
Activating lattice oxygen redox reactions in metal oxides to catalyse oxygen evolution
Alexis Grimaud et al.
NATURE CHEMISTRY (2017)
Combining theory and experiment in electrocatalysis: Insights into materials design
Zhi Wei Seh et al.
SCIENCE (2017)
How covalence breaks adsorption-energy scaling relations and solvation restores them
Federico Calle-Vallejo et al.
CHEMICAL SCIENCE (2017)
Descriptors of Oxygen-Evolution Activity for Oxides: A Statistical Evaluation
Wesley T. Hong et al.
JOURNAL OF PHYSICAL CHEMISTRY C (2016)
NiFe-Based (Oxy)hydroxide Catalysts for Oxygen Evolution Reaction in Non-Acidic Electrolytes
Fabio Dionigi et al.
ADVANCED ENERGY MATERIALS (2016)
Toward the rational design of non-precious transition metal oxides for oxygen electrocatalysis
Wesley T. Hong et al.
ENERGY & ENVIRONMENTAL SCIENCE (2015)
Why Is Bulk Thermochemistry a Good Descriptor for the Electrocatalytic Activity of Transition Metal Oxides?
Federico Calle-Vallejo et al.
ACS CATALYSIS (2015)
Beyond the volcano limitations in electrocatalysis - oxygen evolution reaction
Niels Bendtsen Halck et al.
PHYSICAL CHEMISTRY CHEMICAL PHYSICS (2014)
Scaling relations between adsorption energies for computational screening and design of catalysts
Matthew M. Montemore et al.
CATALYSIS SCIENCE & TECHNOLOGY (2014)
Analysis of electrocatalytic reaction schemes: distinction between rate-determining and potential-determining steps
Marc T. M. Koper
JOURNAL OF SOLID STATE ELECTROCHEMISTRY (2013)
Oxygen reduction and evolution at single-metal active sites: Comparison between functionalized graphitic materials and protoporphyrins
F. Calle-Vallejo et al.
SURFACE SCIENCE (2013)
Number of outer electrons as descriptor for adsorption processes on transition metals and their oxides
Federico Calle-Vallejo et al.
CHEMICAL SCIENCE (2013)
Addressing the terawatt challenge: scalability in the supply of chemical elements for renewable energy
Peter C. K. Vesborg et al.
RSC ADVANCES (2012)
Tailoring the Activity for Oxygen Evolution Electrocatalysis on Rutile TiO2(110) by Transition-Metal Substitution
Monica Garcia-Mota et al.
CHEMCATCHEM (2011)
Universality in Oxygen Evolution Electrocatalysis on Oxide Surfaces
Isabela C. Man et al.
CHEMCATCHEM (2011)
Thermodynamic theory of multi-electron transfer reactions: Implications for electrocatalysis
Marc T. M. Koper
JOURNAL OF ELECTROANALYTICAL CHEMISTRY (2011)
Density functional studies of functionalized graphitic materials with late transition metals for oxygen reduction reactions
Federico Calle-Vallejo et al.
PHYSICAL CHEMISTRY CHEMICAL PHYSICS (2011)
Enzymatic versus Inorganic Oxygen Reduction Catalysts: Comparison of the Energy Levels in a Free-Energy Scheme
Christian H. Kjaergaard et al.
INORGANIC CHEMISTRY (2010)
Electrolysis of water on oxide surfaces
J. Rossmeisl et al.
JOURNAL OF ELECTROANALYTICAL CHEMISTRY (2007)
Origin of the overpotential for oxygen reduction at a fuel-cell cathode
JK Norskov et al.
JOURNAL OF PHYSICAL CHEMISTRY B (2004)