Recent advances of Rh-based intermetallic nanomaterials for catalytic applications
Rhodium (Rh) has received widespread attention in fundamental catalytic research and
numerous industrial catalytic applications. Compared to homogeneous catalysts, Rh-based …
numerous industrial catalytic applications. Compared to homogeneous catalysts, Rh-based …
Perspective on computational reaction prediction using machine learning methods in heterogeneous catalysis
Heterogeneous catalysis plays a significant role in the modern chemical industry. Towards
the rational design of novel catalysts, understanding reactions over surfaces is the most …
the rational design of novel catalysts, understanding reactions over surfaces is the most …
Application of Intermetallic Compounds as Catalysts for the Selective Hydrogenation of CO2 to Methanol
Direct catalytic conversion of CO2 to methanol via renewable hydrogen has emerged as a
promising technology among the various CO2 conversion techniques. However, efficient …
promising technology among the various CO2 conversion techniques. However, efficient …
Structure sensitivity of ethanol steam reforming over the Rh catalyst: Reaction kinetics and deactivation mechanisms
H Wu, B Yang - Applied Surface Science, 2023 - Elsevier
Rh catalyst exhibits high activity and selectivity of hydrogen production for ethanol steam
reforming (ESR). In this work, we used density functional theory calculations and …
reforming (ESR). In this work, we used density functional theory calculations and …
Mechanism of Methanol Synthesis from CO2 Hydrogenation over Pt8/In2O3 Catalysts: A Combined Study on Density Functional Theory and Microkinetic Modeling
In2O3-based catalysts have attracted considerable attention in CO2 hydrogenation to
methanol reactions, thanks to their excellent CO2 conversion rate and methanol selectivity …
methanol reactions, thanks to their excellent CO2 conversion rate and methanol selectivity …
Promoted coke resistance of Ni by surface carbon for the dry reforming of methane
Z Guo, S Chen, B Yang - Iscience, 2023 - cell.com
Dry reforming of methane (DRM) is an efficient process to transform methane and carbon
dioxide to syngas. Nickel could show good catalytic activity for DRM, whereas the …
dioxide to syngas. Nickel could show good catalytic activity for DRM, whereas the …
Theoretical Investigation of the Properties of Pd2Cu Intermetallics and CO2 Hydrogenation to Ethanol Catalyzed on Pd2Cu (110)
H Guo, TT Shi, JT Chen, ZX Chen - The Journal of Physical …, 2023 - ACS Publications
Intermetallics or ordered alloys are catalytically more advantageous than solid solution
alloys. The B 2 phase Pd2Cu intermetallics exhibit excellent catalytic properties for CO2 …
alloys. The B 2 phase Pd2Cu intermetallics exhibit excellent catalytic properties for CO2 …
A new adsorption energy-barrier relation and its application to CO 2 hydrogenation to methanol over In 2 O 3-supported metal catalysts
D Yang, H Lu, G Zeng, ZX Chen - Chemical Communications, 2023 - pubs.rsc.org
Herein, we report a new adsorption energy-barrier relation, the adsorbate-dependent barrier
scaling (ADBS) relation, with which the catalytic activity of In2O3-supported metal catalysts …
scaling (ADBS) relation, with which the catalytic activity of In2O3-supported metal catalysts …
Promotion of activity and stability mechanisms of adjusting the Co ratio in nickel-based catalysts for dry reforming of methane reaction
T Cui, Q Chen, Y Zhang, B Nie, B Yang - Molecular Catalysis, 2024 - Elsevier
The dry reforming of methane plays a vital role in carbon recycling. However, despite their
high activity, Ni catalysts are susceptible to deactivation caused by the deposition of carbon …
high activity, Ni catalysts are susceptible to deactivation caused by the deposition of carbon …
Theoretical Insights into the Formation Mechanism of Methane, Ethylene and Methanol in Fischer‐Tropsch Synthesis at Co2C Surfaces
Fischer‐Tropsch synthesis (FTS) is an attractive opportunity to prepare fuels and chemicals,
avoiding fossil resources exploration. Co2C was recently demonstrated to exhibit …
avoiding fossil resources exploration. Co2C was recently demonstrated to exhibit …