Defect engineering of oxide perovskites for catalysis and energy storage: synthesis of chemistry and materials science

H Arandiyan, SS Mofarah, CC Sorrell… - Chemical Society …, 2021 - pubs.rsc.org
Oxide perovskites have emerged as an important class of materials with important
applications in many technological areas, particularly thermocatalysis, electrocatalysis …

[HTML][HTML] C–H bond activation in light alkanes: a theoretical perspective

Y Wang, P Hu, J Yang, YA Zhu, D Chen - Chemical Society Reviews, 2021 - pubs.rsc.org
Alkanes are the major constituents of natural gas and crude oil, the feedstocks for the
chemical industry. The efficient and selective activation of C–H bonds can convert abundant …

The Open Catalyst 2022 (OC22) dataset and challenges for oxide electrocatalysts

R Tran, J Lan, M Shuaibi, BM Wood, S Goyal… - ACS …, 2023 - ACS Publications
The development of machine learning models for electrocatalysts requires a broad set of
training data to enable their use across a wide variety of materials. One class of materials …

Highly active and stable oxygen vacancies via sulfur modification for efficient catalysis in lithium–sulfur batteries

C Zhao, B Jiang, Y Huang, X Sun, M Wang… - Energy & …, 2023 - pubs.rsc.org
The introduction of oxygen vacancies (Vo) in lithium–sulfur battery (LSB) catalysts is
regarded as an effective approach to improving catalyst performance. However, the high …

Machine learning for catalysis informatics: recent applications and prospects

T Toyao, Z Maeno, S Takakusagi, T Kamachi… - Acs …, 2019 - ACS Publications
The discovery and development of catalysts and catalytic processes are essential
components to maintaining an ecological balance in the future. Recent revolutions made in …

Platinum and Frustrated Lewis Pairs on Ceria as Dual‐Active Sites for Efficient Reverse Water‐Gas Shift Reaction at Low Temperatures

W Li, J Gan, Y Liu, Y Zou, S Zhang… - Angewandte Chemie, 2023 - Wiley Online Library
The low‐temperature reverse water‐gas shift (RWGS) reaction faces the following obstacles:
low activity and unsatisfactory selectivity. Herein, the dual‐active sites of platinum (Pt) …

Factors governing oxygen vacancy formation in oxide perovskites

RB Wexler, GS Gautam, EB Stechel… - Journal of the American …, 2021 - ACS Publications
The control of oxygen vacancy (VO) formation is critical to advancing multiple metal-oxide-
perovskite-based technologies. We report the construction of a compact linear model for the …

Shape-tuned electrodeposition of bismuth-based nanosheets on flow-through hollow fiber gas diffusion electrode for high-efficiency CO2 reduction to formate

H Rabiee, L Ge, X Zhang, S Hu, M Li, S Smart… - Applied Catalysis B …, 2021 - Elsevier
Gas-phase CO 2 electrochemical reduction reaction (CO 2 RR) requires advanced gas
diffusion electrodes (GDEs) for efficient mass transport. Meantime, engineering catalyst …

In-situ hydrothermal synthesis of Fe-doped hydroxyapatite photocatalyst derived from converter slag toward xanthate photodegradation and Cr (VI) reduction under …

K Shu, C Chuaicham, Y Noguchi, L Xu… - Chemical Engineering …, 2023 - Elsevier
In this work, the salicylic acid-pretreated artificial converter slag—an end product of the steel-
making process containing rich Fe and Ca—was successfully utilized for in-situ fabrication of …

Rhodium Single‐Atom Catalyst Design through Oxide Support Modulation for Selective Gas‐Phase Ethylene Hydroformylation

MG Farpón, W Henao, PN Plessow… - Angewandte Chemie …, 2023 - Wiley Online Library
A frontier challenge in single‐atom (SA) catalysis is the design of fully inorganic sites
capable of emulating the high reaction selectivity traditionally exclusive of organometallic …