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Machine Learning Accelerates the Discovery of Design Rules and Exceptions in Stable Metal–Oxo Intermediate Formation | ACS Catalysis
Electronic structure factors and the importance of adsorbate effects in chemisorption on surface alloys | npj Computational Materials
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A fundamental look at electrocatalytic sulfur reduction reaction | Nature Catalysis
Initial atomic-scale oxidation pathways on a Ni–15Cr(100) alloy surface | npj Materials Degradation
Frontiers | Activation of Gold on Metal Carbides: Novel Catalysts for C1 Chemistry
Rational Design of Atomic Site Catalysts for Electrocatalytic Nitrogen Reduction Reaction: One Step Closer to Optimum Activity and Selectivity | SpringerLink
arXiv:1610.01746v1 [physics.comp-ph] 6 Oct 2016
Machine learning for alloys | Nature Reviews Materials
Phase-enabled metal-organic framework homojunction for highly selective CO2 photoreduction | Nature Communications
Oxygen-Inserted Top-Surface Layers of Ni for Boosting Alkaline Hydrogen Oxidation Electrocatalysis | Journal of the American Chemical Society