Correction: The first-principles-based microkinetic simulation of the dry reforming of methane over Ru(0001)

Catalysis Science & Technology ◽

10.1039/d1cy90123k ◽

2022 ◽

Author(s):

Wan-Ying Wang ◽

Gui-Chang Wang

Keyword(s):

First Principles ◽

Dry Reforming ◽

Dry Reforming Of Methane

Correction for ‘The first-principles-based microkinetic simulation of the dry reforming of methane over Ru(0001)’ by Wan-Ying Wang et al., Catal. Sci. Technol., 2021, 11, 1395–1406, DOI: 10.1039/d0cy01942a

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An experimental and first principles DFT investigation on the effect of Cu addition to Ni/Al2O3 catalyst for the dry reforming of methane

Applied Catalysis A General ◽

10.1016/j.apcata.2020.117699 ◽

2020 ◽

Vol 602 ◽

pp. 117699 ◽

Cited By ~ 1

Author(s):

Anjaneyulu Chatla ◽

Minhaj M. Ghouri ◽

Omar Wissam El Hassan ◽

Nosaiba Mohamed ◽

Anuj V. Prakash ◽

...

Keyword(s):

First Principles ◽

Dry Reforming ◽

Dry Reforming Of Methane ◽

Al2o3 Catalyst

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Nickel/Molybdenum Bimetallic Alloy for Dry Reforming of Methane: A Coverage-Dependence Microkinetic Model Simulation Based on the First-Principles Calculation

The Journal of Physical Chemistry C ◽

10.1021/acs.jpcc.1c03417 ◽

2021 ◽

Author(s):

Wan-Ying Wang ◽

Gui-Chang Wang

Keyword(s):

First Principles ◽

Model Simulation ◽

Dry Reforming ◽

First Principles Calculation ◽

Dry Reforming Of Methane ◽

Microkinetic Model ◽

Coverage Dependence ◽

Bimetallic Alloy ◽

Simulation Based

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First-principles theoretical study on dry reforming of methane over perfect and boron-vacancy-containing h-BN sheet-supported Ni catalysts

Physical Chemistry Chemical Physics ◽

10.1039/d0cp04732e ◽

2021 ◽

Vol 23 (1) ◽

pp. 617-627

Author(s):

Yan Zhang ◽

Yi-Fan Yao ◽

Yuan-Yuan Qiao ◽

Gui-Chang Wang

Keyword(s):

First Principles ◽

Density Functional ◽

Theoretical Study ◽

Density Functional Theory Calculations ◽

Dry Reforming ◽

Dry Reforming Of Methane ◽

Ni Catalysts ◽

Functional Theory ◽

Supported Ni Catalysts ◽

Supported Ni

The entire reaction mechanism of the dry reforming of methane (DRM) as well as the competition processes over perfect and boron-vacancy-containing h-BN sheet-supported Ni-catalysts (labeled Ni2/h-BN and Ni2/h-BN-B–D) was studied by density functional theory calculations in the present work.

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The first-principles-based microkinetic simulation of the dry reforming of methane over Ru(0001)

Catalysis Science & Technology ◽

10.1039/d0cy01942a ◽

2021 ◽

Author(s):

Wan-Ying Wang ◽

Gui-Chang Wang

Keyword(s):

First Principles ◽

Dry Reforming ◽

Generation Rate ◽

Dry Reforming Of Methane

As the temperature was increased, the generation rate of H2 and CO in the DRM reaction on Ru(0001) gradually increased along with the ratio of H2/CO generation rate.

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