Substrate doping: A strategy for enhancing reactivity on gold nanocatalysts by tuning sp bands: The Journal of Chemical Physics: Vol 143, No 14
Directing reaction pathways via in situ control of active site geometries in PdAu single-atom alloy catalysts | Nature Communications
Substrate doping: A strategy for enhancing reactivity on gold nanocatalysts by tuning sp bands: The Journal of Chemical Physics: Vol 143, No 14
Main Descriptors To Correlate Structures with the Performances of Electrocatalysts - Wang - - Angewandte Chemie International Edition - Wiley Online Library
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
The perturbation energy: A missing key to understand the “nobleness” of bulk gold: The Journal of Chemical Physics: Vol 142, No 19
Machine learning for alloys | Nature Reviews Materials
Lewis‐Acidic PtIr Multipods Enable High‐Performance Li–O2 Batteries - Zhou - 2021 - Angewandte Chemie International Edition - Wiley Online Library
Bimetallic electrodes boost molecular junctions | Nature Materials
The perturbation energy: A missing key to understand the “nobleness” of bulk gold: The Journal of Chemical Physics: Vol 142, No 19
The density of states of graphene underneath a metal electrode and its correlation with the contact resistivity: Applied Physics Letters: Vol 103, No 3
Structure‐Dependent Strain Effects - Dietze - 2020 - ChemPhysChem - Wiley Online Library
Single‐Crystal Cobalt Phosphate Nanosheets for Biomimetic Oxygen Evolution in Neutral Electrolytes - Shao - 2019 - Angewandte Chemie International Edition - Wiley Online Library
A Bayesian framework for adsorption energy prediction on bimetallic alloy catalysts | npj Computational Materials
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
Communications: Exceptions to the d-band model of chemisorption on metal surfaces: The dominant role of repulsion between adsorbate states and metal d-states: The Journal of Chemical Physics: Vol 132, No 22
The perturbation energy: A missing key to understand the “nobleness” of bulk gold: The Journal of Chemical Physics: Vol 142, No 19
The perturbation energy: A missing key to understand the “nobleness” of bulk gold: The Journal of Chemical Physics: Vol 142, No 19
Optimizing electron density of nickel sulfide electrocatalysts through sulfur vacancy engineering for alkaline hydrogen evolution - Journal of Materials Chemistry A (RSC Publishing)
Support functionalization as an approach for modifying activation entropies of catalytic reactions on atomically dispersed metal sites - ScienceDirect
Statistical learning goes beyond the d-band model providing the thermochemistry of adsorbates on transition metals | Nature Communications
An improved d-band model of the catalytic activity of magnetic transition metal surfaces | Scientific Reports
Wetting Induced Oxidation of Pt-based Nano Catalysts Revealed by In Situ High Energy Resolution X-ray Absorption Spectroscopy | Scientific Reports
Communications: Exceptions to the d-band model of chemisorption on metal surfaces: The dominant role of repulsion between adsorbate states and metal d-states: The Journal of Chemical Physics: Vol 132, No 22
Characterization of methoxy adsorption on some transition metals: A first principles density functional theory study: The Journal of Chemical Physics: Vol 122, No 4
