DFT insight into the effect of potassium on the adsorption, activation and dissociation of CO2 over Fe-based catalysts
Published 2018 View Full Article
- Home
- Publications
- Publication Search
- Publication Details
Title
DFT insight into the effect of potassium on the adsorption, activation and dissociation of CO2 over Fe-based catalysts
Authors
Keywords
-
Journal
PHYSICAL CHEMISTRY CHEMICAL PHYSICS
Volume 20, Issue 21, Pages 14694-14707
Publisher
Royal Society of Chemistry (RSC)
Online
2018-05-09
DOI
10.1039/c8cp02218f
References
Ask authors/readers for more resources
Related references
Note: Only part of the references are listed.- ZrO 2 support imparts superior activity and stability of Co catalysts for CO 2 methanation
- (2018) Wenhui Li et al. APPLIED CATALYSIS B-ENVIRONMENTAL
- First Principle Study on the Adsorption of Hydrocarbon Chains Involved in Fischer–Tropsch Synthesis over Iron Carbides
- (2017) José G. Rivera de la Cruz et al. Journal of Physical Chemistry C
- Stanene based gas sensors: effect of spin–orbit coupling
- (2017) Priyanka Garg et al. PHYSICAL CHEMISTRY CHEMICAL PHYSICS
- CO2 activation and dissociation on the low miller index surfaces of pure and Ni-coated iron metal: a DFT study
- (2017) Caroline R. Kwawu et al. PHYSICAL CHEMISTRY CHEMICAL PHYSICS
- CO adsorption, oxidation and carbonate formation mechanisms on Fe3O4 surfaces
- (2017) Xiaohu Yu et al. PHYSICAL CHEMISTRY CHEMICAL PHYSICS
- Directly converting CO2 into a gasoline fuel
- (2017) Jian Wei et al. Nature Communications
- Catalytic hydrogenation of CO2 to methane over supported Pd, Rh and Ni catalysts
- (2017) Natalia M. Martin et al. Catalysis Science & Technology
- CO2 hydrogenation to higher hydrocarbons on K/Fe–Al–O spinel catalysts promoted with Si, Ti, Zr, Hf, Mn and Ce
- (2017) A. Samanta et al. Catalysis Science & Technology
- The evolution of Fe phases of a fused iron catalyst during reduction and Fischer–Tropsch synthesis
- (2017) Juan Zhang et al. Catalysis Science & Technology
- Insights into the influence of support and potassium or sulfur promoter on iron-based Fischer–Tropsch synthesis: understanding the control of catalytic activity, selectivity to lower olefins, and catalyst deactivation
- (2017) Feng Jiang et al. Catalysis Science & Technology
- A review of the catalytic hydrogenation of carbon dioxide into value-added hydrocarbons
- (2017) Haiyan Yang et al. Catalysis Science & Technology
- The role of CO2 capture and utilization in mitigating climate change
- (2017) Niall Mac Dowell et al. Nature Climate Change
- Fe-MOF-derived highly active catalysts for carbon dioxide hydrogenation to valuable hydrocarbons
- (2017) Junhui Liu et al. Journal of CO2 Utilization
- CO 2 hydrogenation to hydrocarbons over alumina-supported iron catalyst: Effect of support pore size
- (2017) Tianze Xie et al. Journal of CO2 Utilization
- Density functional theory study on the interaction of CO 2 with Fe 3 O 4 (111) surface
- (2016) Tongming Su et al. APPLIED SURFACE SCIENCE
- Structural Elucidation of β-Lactam Diastereoisomers through Ion Mobility Mass Spectrometry Studies and Theoretical Calculations
- (2016) Anna Troć et al. JOURNAL OF MASS SPECTROMETRY
- A computational study of adsorption and activation of CO 2 and H 2 over Fe(1 0 0) surface
- (2016) Haozhi Wang et al. Journal of CO2 Utilization
- A DFT perspective of potassium promotion of χ-Fe5C2(100)
- (2015) Melissa A. Petersen et al. APPLIED CATALYSIS A-GENERAL
- Study on reduction and carburization behaviors of iron phases for iron-based Fischer–Tropsch synthesis catalyst
- (2015) Mingyue Ding et al. APPLIED ENERGY
- Hydrocarbons via CO2 Hydrogenation Over Iron Catalysts: The Effect of Potassium on Structure and Performance
- (2015) N. Fischer et al. CATALYSIS LETTERS
- Light olefin synthesis from CO2 hydrogenation over K-promoted Fe–Co bimetallic catalysts
- (2015) Ratchprapa Satthawong et al. CATALYSIS TODAY
- Potassium-Induced Effect on the Structure and Chemical Activity of the CuxO/Cu(1 1 1) (x≤ 2) Surface: A Combined Scanning Tunneling Microscopy and Density Functional Theory Study
- (2015) Wei An et al. ChemCatChem
- Iron-Based Catalysts for the High-Temperature Water–Gas Shift (HT-WGS) Reaction: A Review
- (2015) Minghui Zhu et al. ACS Catalysis
- Facet Dependence of CO2 Reduction Paths on Cu Electrodes
- (2015) Wenjia Luo et al. ACS Catalysis
- CO2 Hydrogenation to Hydrocarbons over Iron-based Catalyst: Effects of Physicochemical Properties of Al2O3 Supports
- (2014) Fanshu Ding et al. INDUSTRIAL & ENGINEERING CHEMISTRY RESEARCH
- Reaction mechanisms of CO2 electrochemical reduction on Cu(111) determined with density functional theory
- (2014) Xiaowa Nie et al. JOURNAL OF CATALYSIS
- Density functional theory study of carbon dioxide electrochemical reduction on the Fe(100) surface
- (2014) Nicole J. Bernstein et al. PHYSICAL CHEMISTRY CHEMICAL PHYSICS
- A review of advanced catalyst development for Fischer–Tropsch synthesis of hydrocarbons from biomass derived syn-gas
- (2014) Hessam Jahangiri et al. Catalysis Science & Technology
- Effect of SiO2-coating of FeK/Al2O3 catalysts on their activity and selectivity for CO2 hydrogenation to hydrocarbons
- (2014) Fanshu Ding et al. RSC Advances
- Hydrogenation of CO2 to value-added products—A review and potential future developments
- (2014) Samrand Saeidi et al. Journal of CO2 Utilization
- Selectivity of CO2Reduction on Copper Electrodes: The Role of the Kinetics of Elementary Steps
- (2013) Xiaowa Nie et al. ANGEWANDTE CHEMIE-INTERNATIONAL EDITION
- Synthesis of lower olefins by hydrogenation of carbon dioxide over supported iron catalysts
- (2013) Jingjuan Wang et al. CATALYSIS TODAY
- Catalysis for CO2 conversion: a key technology for rapid introduction of renewable energy in the value chain of chemical industries
- (2013) Gabriele Centi et al. Energy & Environmental Science
- Comparative Study on CO2 Hydrogenation to Higher Hydrocarbons over Fe-Based Bimetallic Catalysts
- (2013) Ratchprapa Satthawong et al. TOPICS IN CATALYSIS
- Air as the renewable carbon source of the future: an overview of CO2 capture from the atmosphere
- (2012) Alain Goeppert et al. Energy & Environmental Science
- Mechanistic studies of methanol synthesis over Cu from CO/CO2/H2/H2O mixtures: The source of C in methanol and the role of water
- (2012) Y. Yang et al. JOURNAL OF CATALYSIS
- Fe5C2 Nanoparticles: A Facile Bromide-Induced Synthesis and as an Active Phase for Fischer–Tropsch Synthesis
- (2012) Ce Yang et al. JOURNAL OF THE AMERICAN CHEMICAL SOCIETY
- Impact of K and Ba promoters on CO2hydrogenation over Cu/Al2O3catalysts at high pressure
- (2012) Atul Bansode et al. Catalysis Science & Technology
- On the Surface Chemistry of Iron Oxides in Reactive Gas Atmospheres
- (2011) Emiel de Smit et al. ANGEWANDTE CHEMIE-INTERNATIONAL EDITION
- The Mechanism of Potassium Promoter: Enhancing the Stability of Active Surfaces
- (2011) Chun-Fang Huo et al. ANGEWANDTE CHEMIE-INTERNATIONAL EDITION
- C2-C5+ olefin production from CO2 hydrogenation using ceria modified Fe/Mn/K catalysts
- (2011) Robert W. Dorner et al. CATALYSIS COMMUNICATIONS
- VESTA 3for three-dimensional visualization of crystal, volumetric and morphology data
- (2011) Koichi Momma et al. JOURNAL OF APPLIED CRYSTALLOGRAPHY
- Insight into methanol synthesis from CO2 hydrogenation on Cu(111): Complex reaction network and the effects of H2O
- (2011) Ya-Fan Zhao et al. JOURNAL OF CATALYSIS
- Effects of Alkali Adatoms on CO and H2S Adsorptions on the Fe(100) Surface: A Density Functional Theory Study
- (2011) M. Haris Mahyuddin et al. Journal of Physical Chemistry C
- Density Functional Theory Study of Water Dissociative Chemisorption on the Fe3O4(111) Surface
- (2010) Chenggang Zhou et al. Journal of Physical Chemistry C
- Stability and Reactivity of ϵ−χ−θ Iron Carbide Catalyst Phases in Fischer−Tropsch Synthesis: Controlling μC
- (2010) Emiel de Smit et al. JOURNAL OF THE AMERICAN CHEMICAL SOCIETY
- Adsorption and activation of CO coadsorbed with K on Fe(100) surface: A plane-wave DFT study
- (2010) Dan C. Sorescu SURFACE SCIENCE
- The renaissance of iron-based Fischer–Tropsch synthesis: on the multifaceted catalyst deactivation behaviour
- (2008) Emiel de Smit et al. CHEMICAL SOCIETY REVIEWS
- VESTA: a three-dimensional visualization system for electronic and structural analysis
- (2008) Koichi Momma et al. JOURNAL OF APPLIED CRYSTALLOGRAPHY
- Interaction of alkali metals with the Fe3O4(111) Surface
- (2008) Tao Yang et al. SURFACE SCIENCE
Publish scientific posters with Peeref
Peeref publishes scientific posters from all research disciplines. Our Diamond Open Access policy means free access to content and no publication fees for authors.
Learn MoreFind the ideal target journal for your manuscript
Explore over 38,000 international journals covering a vast array of academic fields.
Search