Machine learning for alloys | Nature Reviews Materials
PDF) The nature of the active site in heterogeneous metal catalysis | Frank Abild-pedersen - Academia.edu
Gas diffusion electrodes, reactor designs and key metrics of low-temperature CO2 electrolysers | Nature Energy
Gold catalysts containing interstitial carbon atoms boost hydrogenation activity | Nature Communications
Boosting the performance of single-atom catalysts via external electric field polarization | Nature Communications
PDF) Progress and Challenges Toward the Rational Design of Oxygen Electrocatalysts Based on a Descriptor Approach
arXiv:1610.01746v1 [physics.comp-ph] 6 Oct 2016
Frontiers | Activation of Gold on Metal Carbides: Novel Catalysts for C1 Chemistry
When Gold Is Not Noble: Catalysis by Nanoparticles - Haruta - 2003 - The Chemical Record - Wiley Online Library
Predicting the Catalytic Activity of Surface Oxidation Reactions by Ionization Energies
Machine learned features from density of states for accurate adsorption energy prediction | Nature Communications
Rational Design of Atomic Site Catalysts for Electrocatalytic Nitrogen Reduction Reaction: One Step Closer to Optimum Activity and Selectivity | SpringerLink
Observation of charge back-donation states of CO Metal bonding on Pt-Sn alloy
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Measuring the Electronic Structure of Alloy Materials and Relating it to their Catalytic Performance
Oxygen-Inserted Top-Surface Layers of Ni for Boosting Alkaline Hydrogen Oxidation Electrocatalysis | Journal of the American Chemical Society
Identifying the impact of the covalent-bonded carbon matrix to FeN4 sites for acidic oxygen reduction | Nature Communications
Electronic metal–support interaction modulates single-atom platinum catalysis for hydrogen evolution reaction | Nature Communications
Toward a mechanistic understanding of electrocatalytic nanocarbon | Nature Communications
Machine Learning Accelerates the Discovery of Design Rules and Exceptions in Stable Metal–Oxo Intermediate Formation | ACS Catalysis
Theoretical Insight on Highly Efficient Electrocatalytic CO2 Reduction Reaction of Monoatom Dispersion Catalyst (Metal-Nitrogen-Carbon) | SpringerLink
Phase-enabled metal-organic framework homojunction for highly selective CO2 photoreduction | Nature Communications
