Dynamics of H2 dissociation on the close-packed (111) surface of the noblest metal: H2 + Au(111): The Journal of Chemical Physics: Vol 145, No 14
arXiv:1610.01746v1 [physics.comp-ph] 6 Oct 2016
Observation of charge back-donation states of CO Metal bonding on Pt-Sn alloy
Phase-enabled metal-organic framework homojunction for highly selective CO2 photoreduction | Nature Communications
Directing reaction pathways via in situ control of active site geometries in PdAu single-atom alloy catalysts | Nature Communications
Measuring and Relating the Electronic Structures of Nonmodel Supported Catalytic Materials to Their Performance | Journal of the American Chemical Society
Turning main-group element magnesium into a highly active electrocatalyst for oxygen reduction reaction | Nature Communications
Applied Sciences | Free Full-Text | Grain Boundary—A Route to Enhance Electrocatalytic Activity for Hydrogen Evolution Reaction
Sensors | Free Full-Text | Design of Pyrrole-Based Gate-Controlled Molecular Junctions Optimized for Single-Molecule Aflatoxin B1 Detection
An improved d-band model of the catalytic activity of magnetic transition metal surfaces | Scientific Reports
Catalysts | Free Full-Text | Impact of Geometric and Electronic Factors on Selective Hydro-Deoxygenation of Guaiacol by Surface-Rich Metal/Silica Catalysts
Theory-Guided Machine Learning Finds Geometric Structure-Property Relationships for Chemisorption on Subsurface Alloys - ScienceDirect
Measuring and Relating the Electronic Structures of Nonmodel Supported Catalytic Materials to Their Performance | Journal of the American Chemical Society
First principles analysis of hydrogen chemisorption on Pd–Re alloyed overlayers and alloyed surfaces: The Journal of Chemical Physics: Vol 112, No 12
Application of Atom-resolved Scanning Tunneling Microscopy in Catalysis Research | SpringerLink
Electronic structure factors and the importance of adsorbate effects in chemisorption on surface alloys | npj Computational Materials
Boosting the performance of single-atom catalysts via external electric field polarization | Nature Communications
Catalysts | Free Full-Text | Ab Initio Investigation of the Adsorption and Dissociation of O2 on Cu-Skin Cu3Au(111) Surface
Machine Learning Prediction of CO Adsorption Energies and Properties of Layered Alloys Using an Improved Feature Selection Algorithm | The Journal of Physical Chemistry C
Topological quantum materials for energy conversion and storage | Nature Reviews Physics
Identifying the impact of the covalent-bonded carbon matrix to FeN4 sites for acidic oxygen reduction | Nature Communications
New Aspects of Platinum Group Metal‐Based Solid‐Solution Alloy Nanoparticles: Binary to High‐Entropy Alloys - Kusada - 2020 - Chemistry – A European Journal - Wiley Online Library
Oxygen adsorption at anionic free and supported Au clusters: The Journal of Chemical Physics: Vol 123, No 16