Active learning-based framework for optimal reaction mechanism selection from microkinetic modeling: a case study of electrocatalytic oxygen reduction reaction on carbon nanotubes

2020 ◽  
Vol 22 (8) ◽  
pp. 4581-4591
Author(s):  
Aleksandr A. Kurilovich ◽  
Caleb T. Alexander ◽  
Egor M. Pazhetnov ◽  
Keith J. Stevenson
Keyword(s):  
Experimental Data ◽  
Carbon Nanotubes ◽  
Reaction Mechanism ◽  
Reduction Reaction ◽  
Model Parameters ◽  
Optimal Model ◽  
Parameters Uncertainty ◽  
Electrocatalytic Oxygen Reduction ◽  
Optimal Reaction

Our quantitative framework demonstrates that model parameters uncertainty treatment is crucial to select an optimal model for available experimental data.

Enhancing the production of hydrogen peroxide from electrocatalytic oxygen reduction reaction by tailoring the electronic states of single-walled carbon nanotubes: a synergistic effect from interior filling and exterior oxidation

2019 ◽  
Vol 3 (8) ◽  
pp. 1951-1956 ◽  
Author(s):  
Rongtao Hu ◽  
Fenfa Yao ◽  
Chuxin Wu ◽  
Chuanhong Jin ◽  
Lunhui Guan
Keyword(s):  
Carbon Nanotubes ◽  
Oxygen Reduction Reaction ◽  
Oxygen Reduction ◽  
Single Walled Carbon Nanotubes ◽  
Phosphomolybdic Acid ◽  
Reduction Reaction ◽  
Single Walled Carbon ◽  
Electrocatalytic Oxygen Reduction ◽  
Production Of Hydrogen ◽  
Walled Carbon Nanotubes

Single-walled carbon nanotubes co-modified with interior filling of phosphomolybdic acid and successive exterior oxidation (O-HPMO@SWCNTs) possess better two-electron oxygen reduction reaction performance than the HPMO-filled SWCNTs, oxidized SWCNTs or pristine SWCNTs.

Chemically drilling carbon nanotubes for electrocatalytic oxygen reduction reaction

2016 ◽  
Vol 190 ◽  
pp. 49-56 ◽  
Author(s):  
Guoyu Zhong ◽  
Hongjuan Wang ◽  
Hao Yu ◽  
Haihui Wang ◽  
Feng Peng
Keyword(s):  
Carbon Nanotubes ◽  
Oxygen Reduction Reaction ◽  
Oxygen Reduction ◽  
Reduction Reaction ◽  
Electrocatalytic Oxygen Reduction

Selective hydrogenation of oleic acid to fatty alcohols over a Rh–Sn–B/Al2O3 catalyst: kinetics and optimal reaction conditions

2021 ◽  
Vol 6 (4) ◽  
pp. 726-746
Author(s):  
Cristhian A. Fonseca Benítez ◽  
Vanina A. Mazzieri ◽  
Carlos R. Vera ◽  
Viviana M. Benitez ◽  
Carlos L. Pieck
Keyword(s):  
Experimental Data ◽  
Oleic Acid ◽  
Reaction Mechanism ◽  
Selective Hydrogenation ◽  
Oleyl Alcohol ◽  
Fatty Alcohols ◽  
Reaction Conditions ◽  
Optimal Reaction ◽  
Al2o3 Catalyst

The selective hydrogenation of oleic acid to oleyl alcohol over a Rh(1 wt%)–Sn(4 wt%)–B/Al2O3 catalyst was studied. A comprehensive set of experimental data was used for elucidating the reaction mechanism.

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