Theoretical Study of the Reverse Water Gas Shift Reaction on Copper Modified β-Mo2C(001) Surfaces

2018 ◽  
Vol 123 (2) ◽  
pp. 1235-1251 ◽  
Author(s):  
Huijuan Jing ◽  
Qiaohong Li ◽  
Jian Wang ◽  
Diwen Liu ◽  
Kechen Wu
Keyword(s):  
Theoretical Study ◽  
Water Gas Shift ◽  
Water Gas Shift Reaction ◽  
Reverse Water Gas Shift ◽  
Shift Reaction ◽  
Water Gas

A theoretical study of surface-structural sensitivity of the reverse water-gas shift reaction over Cu(hkl) surfaces

2003 ◽  
Vol 543 (1-3) ◽  
pp. 118-130 ◽  
Author(s):  
Gui-Chang Wang ◽  
Ling Jiang ◽  
Xian-Yong Pang ◽  
Zun-Sheng Cai ◽  
Yin-Ming Pan ◽  
...  
Keyword(s):  
Theoretical Study ◽  
Water Gas Shift ◽  
Water Gas Shift Reaction ◽  
Structural Sensitivity ◽  
Reverse Water Gas Shift ◽  
Shift Reaction ◽  
Water Gas

Theoretical study on the reaction mechanism of reverse water–gas shift reaction using a Rh–Mo6S8 cluster

RSC Advances ◽  
2016 ◽  
Vol 6 (110) ◽  
pp. 108270-108279 ◽  
Author(s):  
Zhaoru Cao ◽  
Ling Guo ◽  
Naying Liu ◽  
Xiaoli Zheng ◽  
Wenli Li ◽  
...  
Keyword(s):  
Density Functional ◽  
Theoretical Study ◽  
Density Functional Theory Calculations ◽  
Water Gas Shift ◽  
Water Gas Shift Reaction ◽  
Functional Theory ◽  
Reverse Water Gas Shift ◽  
Rwgs Reaction ◽  
Shift Reaction ◽  
Water Gas

The reverse water gas shift (RWGS) reaction catalyzed by a Rh–Mo6S8 cluster is investigated using density functional theory calculations.

scholarly journals A theoretical study of the reverse water‐gas shift reaction on Ni(111) and Ni(311) surfaces

2019 ◽  
Vol 98 (3) ◽  
pp. 740-748 ◽  
Author(s):  
Min Zhang ◽  
Bart Zijlstra ◽  
Ivo A. W. Filot ◽  
Fang Li ◽  
Haiou Wang ◽  
...  
Keyword(s):  
Theoretical Study ◽  
Water Gas Shift ◽  
Water Gas Shift Reaction ◽  
Reverse Water Gas Shift ◽  
Shift Reaction ◽  
Water Gas

Boosting reverse water-gas shift reaction activity of Pt nanoparticles through light doping of W

2021 ◽  
Author(s):  
Daiya Kobayashi ◽  
Hirokazu Kobayashi ◽  
Kohei Kusada ◽  
Tomokazu Yamamoto ◽  
Takaaki Toriyama ◽  
...  
Keyword(s):  
Pt Nanoparticles ◽  
Water Gas Shift ◽  
Solid Solution Alloy ◽  
Alloy Nanoparticles ◽  
Water Gas Shift Reaction ◽  
Reverse Water Gas Shift ◽  
Rwgs Reaction ◽  
Shift Reaction ◽  
Water Gas ◽  
First Time

We report PtW solid-solution alloy nanoparticles (NPs) as a reverse water-gas shift (RWGS) reaction catalyst for the first time. Atomic-level alloying of Pt and W significantly enhanced the RWGS reaction activity of Pt NPs.

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