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A First-Principles Study of Oxygenates on Co Surfaces in Fischer−Tropsch Synthesis

https://doi.org/10.1021/jp802242t
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What this work says

Outgoing claims: the papers this work cites, builds on, or argues with.

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F ischer‐ T ropsch Process
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Über die direkte Synthese von Erdöl‐Kohlenwasserstoffen bei gewöhnlichem Druck. (Erste Mitteilung)
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Methanol Synthesis and Reverse Water–Gas Shift Kinetics over Cu(110) Model Catalysts: Structural Sensitivity
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Mechanisms for Chain Growth in Fischer–Tropsch Synthesis over Ru(0001)
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Methanol synthesis and reverse water-gas shift kinetics over clean polycrystalline copper
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The Fischer-Tropsch and related syntheses
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Reactions of CHxCl4$minus;x with hydrogen: Relation to the Fischer-Tropsch synthesis of hydrocarbons
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Methanol decomposition on platinum (111)
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The adsorption of methanol on Pt(111), an IR reflection and UV photoemission study
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Step effects in the thermal decomposition of methanol on Pt(111)
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Studies of the Fischer-Tropsch reaction on Co(0001)
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Advances in low temperature Fischer-Tropsch synthesis
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Practical and theoretical aspects of the catalytic Fischer-Tropsch process
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Hydrocarbon synthesis via Fischer-Tropsch reaction: travails and triumphs
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New catalytic routes for syngas and hydrogen production
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Effect of potassium promoter on precipitated iron-manganese catalyst for Fischer?Tropsch synthesis
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Mn promotion effects in Co/TiO Fischer?Tropsch catalysts as investigated by XPS and STEM-EELS
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A quantitative determination of reaction mechanisms from density functional theory calculations: Fischer–Tropsch synthesis on flat and stepped cobalt surfaces
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A density functional theory study of the α-olefin selectivity in Fischer–Tropsch synthesis
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CO dissociation and O removal on Co(0001): a density functional theory study
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A theoretical study of CH chemisorption on the Ru(0001) surface
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The decomposition of formaldehyde on Pt(111): A TPD and hreels study
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TPD, HREELS and UPS study of the adsorption and reaction of methyl nitrite (CH3ONO) on Pt(111)
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Parallel pathways in methanol decomposition on Pt(111)
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Synthesis of higher alcohols over copper/cobalt catalysts
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Mechanism of Hydrocarbon Synthesis over Fischer-Tropsch Catalysts
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The Fischer–Tropsch process: 1950–2000
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Low temperature fuel cells: Interactions between catalysts and engineering design
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Mechanism and electrocatalysis in the direct methanol fuel cell
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Aspects of the anodic oxidation of methanol
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Carbon deposition and catalyst stability over La2NiO4/γ-Al2O3 during CO2 reforming of methane to syngas
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Design, synthesis, and use of cobalt-based Fischer-Tropsch synthesis catalysts
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Catalytic hydrogenation of carbon oxides – a 10-year perspective
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Short history and present trends of Fischer–Tropsch synthesis
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Fischer–Tropsch technology — from active site to commercial process
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A comprehensive mechanism for the Fischer-Tropsch synthesis
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Advances in the Development of Novel Cobalt Fischer−Tropsch Catalysts for Synthesis of Long-Chain Hydrocarbons and Clean Fuels
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Hydrocarbon selectivity from cobalt Fischer-Tropsch catalysts
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Recent Advances in Catalysts for Methanol Synthesis via Hydrogenation of CO and CO2
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Atomic-Scale Restructuring in High-Pressure Catalysis
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High-Resolution Electron Energy-Loss Studies of Hydrocarbon Formation from Methane Decomposition on Ru(0001) and Ru(11.hivin.20) Catalysts
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Insight into Microscopic Reaction Pathways in Heterogeneous Catalysis
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Direct SIMS observation of methylidyne, methylene, and methyl intermediates on a nickel(III) methanation catalyst
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Mechanism of the Fischer-Tropsch reaction. The chain propagation step
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Reactions of diazomethane on transition-metal surfaces and their relationship to the mechanism of the Fischer-Tropsch reaction
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Fischer—Tropsch Synthesis Mechanism Studies. The Addition of Radioactive Alcohols to the Synthesis Gas
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A New Insight into Fischer−Tropsch Synthesis
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A First-Principles Study of Methanol Decomposition on Pt(111)
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General Rules for Predicting Where a Catalytic Reaction Should Occur on Metal Surfaces: A Density Functional Theory Study of C−H and C−O Bond Breaking/Making on Flat, Stepped, and Kinked Metal Surfaces
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Competitive Paths for Methanol Decomposition on Pt(111)
inferredcites →https://doi.org/10.1021/ja991475xopenalex-snapshot
A General Mechanism for CO Oxidation on Close-Packed Transition Metal Surfaces
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Why Must Oxygen Atoms Be Activated from Hollow Sites to Bridge Sites in Catalytic CO Oxidation?
inferredcites →https://doi.org/10.1021/jp0493374openalex-snapshot
DFT Study of Formaldehyde and Methanol Synthesis from CO and H2 on Ni(111)
inferredcites →https://doi.org/10.1021/jp0775653openalex-snapshot
Methanol Adsorption on Clean and Oxygen-Predosed V(100) Single-Crystal Surfaces
inferredcites →https://doi.org/10.1021/jp711051eopenalex-snapshot
Chain Growth Mechanism in Fischer−Tropsch Synthesis: A DFT Study of C−C Coupling over Ru, Fe, Rh, and Re Surfaces
inferredcites →https://doi.org/10.1021/jp960045fopenalex-snapshot
Polarization Modulation Infrared Reflection Absorption Spectroscopy of CO Adsorption on Co(0001) under a High-Pressure Regime
inferredcites →https://doi.org/10.1021/jp963337popenalex-snapshot
A Combinedin-SituPM-RAIRS and Kinetic Study of Single-Crystal Cobalt Catalysts under Synthesis Gas at Pressures up to 300 mbar
inferredcites →https://doi.org/10.1023/a:1019179009796openalex-snapshot
First-principles analysis of the hydrogenation of carbon monoxide over palladium
inferredcites →https://doi.org/10.1039/f19878302963openalex-snapshot
Formation of hydrocarbons from CO + H2 using a cobalt–manganese oxide catalyst. A 13C isotopic study
inferredcites →https://doi.org/10.1063/1.1405157openalex-snapshot
A first principles study of methanol decomposition on Pd(111): Mechanisms for O–H bond scission and C–O bond scission
inferredcites →https://doi.org/10.1063/1.1829257openalex-snapshot
CH x hydrogenation on Co(0001): A density functional theory study
inferredcites →https://doi.org/10.1080/00268970410001723073openalex-snapshot
A density functional theory study on the water formation at high coverages and the water effect in the Fischer–Tropsch synthesis
inferredcites →https://doi.org/10.1080/01614948808071752openalex-snapshot
Preexponential Factors for Elementary Surface Processes
inferredcites →https://doi.org/10.1088/0953-8984/14/11/302openalex-snapshot
The SIESTA method for ab initio order- N materials simulation
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Efficient pseudopotentials for plane-wave calculations
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Generalized Gradient Approximation Made Simple
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CO Oxidation on Pt(111): AnAb InitioDensity Functional Theory Study
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Role of Steps in N 2 Activation on Ru(0001)
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Kinetics of Heterogeneous Catalytic Reactions

What points at this work

Incoming claims: where this work appears in other papers’ reference lists and arguments.

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Density Functional Theory Study of Iron and Cobalt Carbides for Fischer−Tropsch Synthesis
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Mechanism and microkinetics of the Fischer–Tropsch reaction
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First-principles study of structure sensitivity of chain growth and selectivity in Fischer–Tropsch synthesis using HCP cobalt catalysts
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Direct transformation of Carbon Dioxide to aromatics as high-value liquid fuels via the modified fischer-Tropsch synthesis and Methanol-mediated routes
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Understanding the effect of adsorption sites of CO at cobalt surface on its reactivity with H 2 /H by DFT calculations
inferred← citeshttps://doi.org/10.1134/s0965544119050050openalex-snapshot
Mechanism of Fischer–Tropsch Synthesis over Nanosized Catalyst Particles: Approaches and Problems of Ab Initio Calculations
inferred← citeshttps://doi.org/10.3390/catal13050837openalex-snapshot
Density Functional Theory Study of the Hydrogenation of Carbon Monoxide over the Co (001) Surface: Implications for the Fischer–Tropsch Process
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A Review of Theoretical Studies on Carbon Monoxide Hydrogenation via Fischer–Tropsch Synthesis over Transition Metals
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Chemical Pathways to the Origin of Life
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Activity and selectivity loss modelling on Co based Fischer-Tropsch catalysts
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