scholarly journals Rational screening of single-atom-doped ZnO catalysts for propane dehydrogenation from microkinetic analysis

2020 ◽  
Vol 10 (15) ◽  
pp. 4938-4951
Author(s):  
Fang Ma ◽  
Qing-Yu Chang ◽  
Qiang Yin ◽  
Zhi-Jun Sui ◽  
Xing-Gui Zhou ◽  
...  

Descriptor-based microkinetic analysis is performed to screen single-atom-doped ZnO for PDH, and Mn1- and Cu1–ZnO prove to be good candidates.

2020 ◽  
Vol 6 (8) ◽  
pp. 1431-1440 ◽  
Author(s):  
Jiashen Meng ◽  
Jiantao Li ◽  
Jinshuai Liu ◽  
Xingcai Zhang ◽  
Gengping Jiang ◽  
...  

Science ◽  
2021 ◽  
Vol 372 (6549) ◽  
pp. 1444-1447
Author(s):  
Ryan T. Hannagan ◽  
Georgios Giannakakis ◽  
Romain Réocreux ◽  
Julia Schumann ◽  
Jordan Finzel ◽  
...  

The complexity of heterogeneous catalysts means that a priori design of new catalytic materials is difficult, but the well-defined nature of single-atom–alloy catalysts has made it feasible to perform unambiguous theoretical modeling and precise surface science experiments. Herein we report the theory-led discovery of a rhodium-copper (RhCu) single-atom–alloy catalyst for propane dehydrogenation to propene. Although Rh is not generally considered for alkane dehydrogenation, first-principles calculations revealed that Rh atoms disperse in Cu and exhibit low carbon-hydrogen bond activation barriers. Surface science experiments confirmed these predictions, and together these results informed the design of a highly active, selective, and coke-resistant RhCu nanoparticle catalyst that enables low-temperature nonoxidative propane dehydrogenation.


Fuel ◽  
2021 ◽  
pp. 122580
Author(s):  
Weiyu Song ◽  
Yikun Kang ◽  
Min Yang ◽  
Zhi Li ◽  
Lulu Chen ◽  
...  

Author(s):  
Jun Zhang ◽  
Rui-Jia Zhou ◽  
Qing-Yu Chang ◽  
Zhi-Jun Sui ◽  
Xing-Gui Zhou ◽  
...  

Author(s):  
Ziwei Zhai ◽  
Bofeng Zhang ◽  
Li Wang ◽  
XiangWen Zhang ◽  
Guozhu Liu

Propane dehydrogenation (PDH) is an effective approach to produce propylene. Downsizing the Pt species to single atom catalysts (SACs) has become a hotspot, owing to the maximum utilization and excellent...


Author(s):  
Ping Rong ◽  
Ya-Fei Jiang ◽  
Qi Wang ◽  
Meng Gu ◽  
Xue-Lian Jiang ◽  
...  

Defects can predominantly dictate properties of oxide materials, in particular, the photocatalytic and electrical properties. By implanting the defects of metallic element, Cu atom doped ZnO (Cu1-ZnO) supported by graphene-coated...


2021 ◽  
Author(s):  
Yuki Nakaya ◽  
Eigo Hayashida ◽  
Hiroyuki Asakura ◽  
Ken-ichi Shimizu ◽  
Shinya Furukawa

Propane dehydrogenation (PDH) has been a promising propylene production process that can compensate for the increasing global demand for propylene. However, Pt-based catalysts with high stability at ≥600°C have barely been reported because the catalysts typically result in short catalyst life owing to side reactions and coke formation. Herein, we report a new class of heterogeneous catalysts using high-entropy intermetallics (HEIs). Pt–Pt ensembles, which cause side reactions, are entirely diluted by the component inert metals in PtGe-type HEI; thereby, unfavorable side reactions are drastically inhibited. The resultant HEI: (PtCoCu)(GeGeSn)/Ca–SiO2 exhibited an outstandingly high catalytic stability, even at 600°C (kd−1 = τ = 4146 h = 173 d), and almost no deactivation of the catalyst was observed two months for the first time.


2020 ◽  
Vol 11 (1) ◽  
Author(s):  
Yuki Nakaya ◽  
Jun Hirayama ◽  
Seiji Yamazoe ◽  
Ken-ichi Shimizu ◽  
Shinya Furukawa

ACS Catalysis ◽  
2021 ◽  
pp. 5135-5147
Author(s):  
Qing-Yu Chang ◽  
Kai-Qi Wang ◽  
Zhi-Jun Sui ◽  
Xing-Gui Zhou ◽  
De Chen ◽  
...  

Sign in / Sign up

Export Citation Format

Share Document