Unraveling the CO Oxidation Mechanism over Highly Dispersed Pt Single Atom on Anatase TiO2 (101)
Catalysts with noble metals deposited as single atoms on metal oxide supports have
recently been studied extensively due to their maximized metal utilization and potential for …
recently been studied extensively due to their maximized metal utilization and potential for …
Nature of stable single atom Pt catalysts dispersed on anatase TiO2
Pt single atom catalysts anchored on the surface of anatase TiO 2 have recently been shown
to be stable through oxidation and reduction conditions and exhibit higher catalytic activity in …
to be stable through oxidation and reduction conditions and exhibit higher catalytic activity in …
Ab Initio Molecular Dynamics Reveals New Metal-Binding Sites in Atomically Dispersed Pt1/TiO2 Catalysts
N Humphrey, S Bac… - The Journal of Physical …, 2020 - ACS Publications
We present a molecular dynamics modeling study of atomically dispersed Pt on the (110)
surface of rutile TiO2. Using density functional theory (DFT) and ab initio molecular …
surface of rutile TiO2. Using density functional theory (DFT) and ab initio molecular …
Site-Sensitivity of CO Oxidation Kinetics Catalyzed by Atomically Dispersed Pt1/TiO2
S Bac, N Humphrey… - The Journal of Physical …, 2024 - ACS Publications
The local coordination environment of the single atom in an atomically dispersed catalyst
(ADC) plays a crucial role in determining its catalytic activity and stability. This study …
(ADC) plays a crucial role in determining its catalytic activity and stability. This study …
CO oxidation with atomically dispersed catalysts: insights from the energetic span model
S Bac, S Mallikarjun Sharada - ACS Catalysis, 2022 - ACS Publications
Using density functional theory and the energetic span model (ESM), this work examines the
activity of a single hollow site (H1) of atomically dispersed Pt on rutile TiO2 (110) toward low …
activity of a single hollow site (H1) of atomically dispersed Pt on rutile TiO2 (110) toward low …
Structural evolution of atomically dispersed Pt catalysts dictates reactivity
The use of oxide-supported isolated Pt-group metal atoms as catalytic active sites is of
interest due to their unique reactivity and efficient metal utilization. However, relationships …
interest due to their unique reactivity and efficient metal utilization. However, relationships …
Interplay of Pt and Crystal Facets of TiO2: CO Oxidation Activity and Operando XAS/DRIFTS Studies
Y Zhou, DE Doronkin, M Chen, S Wei… - ACS Catalysis, 2016 - ACS Publications
In this work, the influence of the terminating or exposed crystal planes of anatase TiO2
support on the catalytic activity of Pt/TiO2 catalysts is reported. Strong effects were observed …
support on the catalytic activity of Pt/TiO2 catalysts is reported. Strong effects were observed …
[HTML][HTML] Distribution of Pt single atom coordination environments on anatase TiO2 supports controls reactivity
Single-atom catalysts (SACs) offer efficient metal utilization and distinct reactivity compared
to supported metal nanoparticles. Structure-function relationships for SACs often assume …
to supported metal nanoparticles. Structure-function relationships for SACs often assume …
Unraveling the Intermediate Reaction Complexes and Critical Role of Support-Derived Oxygen Atoms in CO Oxidation on Single-Atom Pt/CeO2
CeO2-supported Pt single-atom catalysts have been extensively studied due to their
relevance in automobile emission control and for the fundamental understanding of CeO2 …
relevance in automobile emission control and for the fundamental understanding of CeO2 …
A tailored oxide interface creates dense Pt single-atom catalysts with high catalytic activity
Highly reactive dense Pt single-atoms stabilized on an oxide support can resolve a grand
challenge in the economic use of Pt in catalysis. The maximized number density of reaction …
challenge in the economic use of Pt in catalysis. The maximized number density of reaction …