Metal-support interaction for heterogeneous catalysis: from nanoparticles to single atoms
With the downsizing of metal sizes (nanoparticles, nanoclusters, and single atoms), the
catalytic behaviors of supported metal species change significantly for various chemical …
catalytic behaviors of supported metal species change significantly for various chemical …
Insights into the mechanistic CO2 conversion to methanol on single Ru atom anchored on MoS2 monolayer
Single atom catalysts (SACs) have received great attention due to their promising catalytic
activity and sustainability. In this regard, the catalytic activity toward CO 2 conversion …
activity and sustainability. In this regard, the catalytic activity toward CO 2 conversion …
Hierarchical Heterostructures of Ultrasmall Fe2O3-Encapsulated MoS2/N-Graphene as an Effective Catalyst for Oxygen Reduction Reaction
In this study, a facile approach has been successfully applied to synthesize a hierarchical
three-dimensional architecture of ultrasmall hematite nanoparticles homogeneously …
three-dimensional architecture of ultrasmall hematite nanoparticles homogeneously …
Machine Learning, Density Functional Theory, and Experiments to Understand the Photocatalytic Reduction of CO2 on CuPt/TiO2
The photoconversion of CO2 to hydrocarbons is a sustainable route for its transformation
into value-added compounds, which is crucial to mitigating energy and climate crises. CuPt …
into value-added compounds, which is crucial to mitigating energy and climate crises. CuPt …
Defect-Selective Energy Barrier Crossing during Adsorption of Colloidal Gold Nanoparticles on Zinc Sulfide Crystals under Overall Electrostatic Repulsion
M Matten, T Lange, M Rohe, B Mei… - The Journal of …, 2024 - ACS Publications
Nanofunctionalized particles are widely used in heterogeneous catalysis, additive
manufacturing, and environmental technologies. The electrostatically driven adsorption is an …
manufacturing, and environmental technologies. The electrostatically driven adsorption is an …
Interaction of zinc oxide nanoparticles with water: Implications for catalytic activity
Novel technological applications in catalysis and bactericidal formulation have emerged for
zinc oxide (ZnO) nanoparticles owing to their ability to generate reactive oxygen species by …
zinc oxide (ZnO) nanoparticles owing to their ability to generate reactive oxygen species by …
Syngas molecules as probes for defects in 2D hexagonal boron nitride: their adsorption and vibrations
Single-layer, defect-laden hexagonal boron nitride (dh-BN) is attracting a great deal of
attention for its diverse applications: catalysis on the one hand, and single photon emission …
attention for its diverse applications: catalysis on the one hand, and single photon emission …
High Catalytic Activity of Pd1/ZnO(101̅0) toward Methanol Partial Oxidation: A DFT+KMC Study
We perform density functional theory (DFT) calculations of the energetics for several
pathways associated with methanol partial oxidation (MPO) reaction on singly distributed Pd …
pathways associated with methanol partial oxidation (MPO) reaction on singly distributed Pd …
MoS2 Nanoclusters Grown on TiO2: Evidence for New Adsorption Sites at Edges and Sulfur Vacancies
MoS2 clusters have been grown on a TiO2 (110) substrate to provide a model surface for
better understanding the adsorbate interactions and chemical activity on titania-supported …
better understanding the adsorbate interactions and chemical activity on titania-supported …
Methanol carbonylation to acetaldehyde on Au particles supported by single-layer MoS2 grown on silica
Homogenous single-layer MoS 2 films coated with sub-single layer amounts of gold are
found to isolate the reaction of methanol with carbon monoxide, the fundamental step toward …
found to isolate the reaction of methanol with carbon monoxide, the fundamental step toward …