In Situ/Operando Electrocatalyst Characterization by X-ray Absorption Spectroscopy

J Timoshenko, B Roldan Cuenya - Chemical reviews, 2020 - ACS Publications
During the last decades, X-ray absorption spectroscopy (XAS) has become an
indispensable method for probing the structure and composition of heterogeneous catalysts …

A theory/experience description of support effects in carbon-supported catalysts

IC Gerber, P Serp - Chemical Reviews, 2019 - ACS Publications
The support plays an important role for supported metal catalysts by positioning itself as a
macromolecular ligand, which conditions the nature of the active site and contributes …

Dilute alloys based on Au, Ag, or Cu for efficient catalysis: from synthesis to active sites

JD Lee, JB Miller, AV Shneidman, L Sun… - Chemical …, 2022 - ACS Publications
The development of new catalyst materials for energy-efficient chemical synthesis is critical
as over 80% of industrial processes rely on catalysts, with many of the most energy-intensive …

Supervised machine-learning-based determination of three-dimensional structure of metallic nanoparticles

J Timoshenko, D Lu, Y Lin… - The journal of physical …, 2017 - ACS Publications
Tracking the structure of heterogeneous catalysts under operando conditions remains a
challenge due to the paucity of experimental techniques that can provide atomic-level …

High Zn/Al ratios enhance dehydrogenation vs hydrogen transfer reactions of Zn-ZSM-5 catalytic systems in methanol conversion to aromatics

I Pinilla-Herrero, E Borfecchia, J Holzinger… - Journal of catalysis, 2018 - Elsevier
Two series of Zn-ZSM-5 catalysts were prepared by ion exchanging two commercial zeolites
with different Si/Al ratios (40 and 15) with increasing Zn loadings. The nature of the Zn sites …

Physicochemical characterization of nanomaterials: Polymorph, composition, wettability, and thermal stability

A Barhoum, ML García-Betancourt, H Rahier… - Emerging applications of …, 2018 - Elsevier
Many methods have been used for evaluating physicochemical properties of nanomaterials
(NMs). Characterization of nanoparticles (NPs) includes the determination not only of size …

“Inverting” X-ray absorption spectra of catalysts by machine learning in search for activity descriptors

J Timoshenko, AI Frenkel - Acs Catalysis, 2019 - ACS Publications
The rapid growth of methods emerging in the past decade for synthesis of “designer”
catalysts—ranging from the size and shape-selected nanoparticles to mass-selected …

Aqueous phase catalytic and electrocatalytic hydrogenation of phenol and benzaldehyde over platinum group metals

N Singh, U Sanyal, G Ruehl, KA Stoerzinger… - Journal of …, 2020 - Elsevier
The mechanisms of aqueous-phase thermal catalytic hydrogenation (TCH) and
electrocatalytic hydrogenation (ECH) of organic molecules over Pt group metals are not as …

Adsorbate-induced structural evolution of Pd catalyst for selective hydrogenation of acetylene

Y Liu, F Fu, A McCue, W Jones, D Rao, J Feng… - ACS …, 2020 - ACS Publications
This work describes the transformation of Pd species under reaction conditions to control the
reactivity of heterogeneous catalysts, in which the real active sites for hydrogenation differ …

Tandem site-and size-controlled Pd nanoparticles for the directed hydrogenation of furfural

SM Rogers, CRA Catlow, CE Chan-Thaw… - ACS …, 2017 - ACS Publications
The conversion of biomass to useful chemical products requires precise catalytic properties
to achieve the required activity, selectivity, and durability. Here we show, through optimized …