scholarly journals Evaluation of the Oxygen Mobility in CePO4-Supported Catalysts: Mechanistic Implications on the Water–Gas Shift Reaction

2020 ◽  
Vol 124 (30) ◽  
pp. 16391-16401
Author(s):  
Sara Navarro-Jaén ◽  
Luis F. Bobadilla ◽  
Francisca Romero-Sarria ◽  
Oscar H. Laguna ◽  
Nicolas Bion ◽  
...  
2012 ◽  
Vol 286 ◽  
pp. 279-286 ◽  
Author(s):  
Jorge H. Pazmiño ◽  
Mayank Shekhar ◽  
W. Damion Williams ◽  
M. Cem Akatay ◽  
Jeffrey T. Miller ◽  
...  

2009 ◽  
Vol 52 (6-7) ◽  
pp. 688-692 ◽  
Author(s):  
C. Galletti ◽  
S. Specchia ◽  
G. Saracco ◽  
V. Specchia

2010 ◽  
Vol 51 (6) ◽  
pp. 843-848 ◽  
Author(s):  
T. P. Maniecki ◽  
P. Mierczyński ◽  
W. K. Jóźwiak

2009 ◽  
Vol 52 (13-20) ◽  
pp. 1940-1945 ◽  
Author(s):  
Olivier Thinon ◽  
Karim Rachedi ◽  
Fabrice Diehl ◽  
Priscilla Avenier ◽  
Yves Schuurman

2019 ◽  
Vol 4 (436) ◽  
pp. 12-18
Author(s):  
K.A. Valishevskiy ◽  
◽  
S.S. Itkulova ◽  
Y.A. Boleubaev ◽  
◽  
...  

2020 ◽  
Author(s):  
Nore Stolte ◽  
Junting Yu ◽  
Zixin Chen ◽  
Dimitri A. Sverjensky ◽  
Ding Pan

The water-gas shift reaction is a key reaction in Fischer-Tropsch-type synthesis, which is widely believed to generate hydrocarbons in the deep carbon cycle, but is little known at extreme pressure-temperature conditions found in Earth’s upper mantle. Here, we performed extensive ab initio molecular dynamics simulations and free energy calculations to study the water-gas shift reaction. We found the direct formation of formic acid out of CO and supercritical water at 10∼13 GPa and 1400 K without any catalyst. Contrary to the common assumption that formic acid or formate is an intermediate product, we found that HCOOH is thermodynamically more stable than the products of the water-gas shift reaction above 3 GPa and at 1000∼1400 K. Our study suggests that the water-gas shift reaction may not happen in Earth’s upper mantle, and formic acid or formate may be an important carbon carrier, participating in many geochemical processes in deep Earth.<br>


2013 ◽  
Vol 33 (9) ◽  
pp. 1572-1577 ◽  
Author(s):  
Yuanzhuo ZHANG ◽  
Ziying YU ◽  
Fumin ZHANG ◽  
Qiang XIAO ◽  
Yijun ZHONG ◽  
...  

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