Structure sensitivity of the Fischer–Tropsch reaction; molecular kinetics simulations

Carbon deposition on Co catalysts during Fischer–Tropsch synthesis: A computational and experimental study

(2010) Kong Fei Tan et al.   JOURNAL OF CATALYSIS

CO activation pathways and the mechanism of Fischer–Tropsch synthesis

(2010) Manuel Ojeda et al.   JOURNAL OF CATALYSIS

Role of Step Sites and Surface Vacancies in the Adsorption and Activation of CO on χ-Fe5C2 Surfaces

(2010) Melissa A. Petersen et al.   Journal of Physical Chemistry C

Methane Formation on Corrugated Ru Surfaces

(2010) Sharan Shetty et al.   Journal of Physical Chemistry C

Understanding the Effect of Cobalt Particle Size on Fischer−Tropsch Synthesis: Surface Species and Mechanistic Studies by SSITKA and Kinetic Isotope Effect†

(2010) Jia Yang et al.   LANGMUIR

Symmetric Transition State Analysis: An Analysis of Dissociative Methane Adsorption on Rh{111} Using Quantum Chemical Calculations

(2010) Bouke S. Bunnik et al.   TOPICS IN CATALYSIS

The role of electrophilic species in the Fischer–Tropsch reaction

(2009) Peter M. Maitlis et al.   CHEMICAL COMMUNICATIONS

Reactivity Theory of Transition-Metal Surfaces: A Brønsted−Evans−Polanyi Linear Activation Energy−Free-Energy Analysis

(2009) Rutger A. van Santen et al.   CHEMICAL REVIEWS

Density Functional Theory Study of the CO Insertion Mechanism for Fischer−Tropsch Synthesis over Co Catalysts

(2009) Mingkun Zhuo et al.   Journal of Physical Chemistry C

Insight into CH4Formation in Iron-Catalyzed Fischer−Tropsch Synthesis

(2009) Chun-Fang Huo et al.   JOURNAL OF THE AMERICAN CHEMICAL SOCIETY

Direct versus Hydrogen-Assisted CO Dissociation

(2009) Sharan Shetty et al.   JOURNAL OF THE AMERICAN CHEMICAL SOCIETY

On the Origin of the Cobalt Particle Size Effects in Fischer−Tropsch Catalysis

(2009) J. P. den Breejen et al.   JOURNAL OF THE AMERICAN CHEMICAL SOCIETY

DFT study on H2O activation by stepped and planar Rh surfaces

(2009) Pieter W. van Grootel et al.   SURFACE SCIENCE

Complementary Structure Sensitive and Insensitive Catalytic Relationships

(2008) Rutger A. Van Santen   ACCOUNTS OF CHEMICAL RESEARCH

Structure sensitivity of the methanation reaction: H2-induced CO dissociation on nickel surfaces

(2008) M.P. Andersson et al.   JOURNAL OF CATALYSIS

A quantitative determination of reaction mechanisms from density functional theory calculations: Fischer–Tropsch synthesis on flat and stepped cobalt surfaces

(2008) J CHENG et al.   JOURNAL OF CATALYSIS

CO Dissociation on the Ru(112̅1) Surface

(2008) S. Shetty et al.   Journal of Physical Chemistry C

A First-Principle Study of Chain Propagation Steps in the Fischer−Tropsch Synthesis on Fe(100)

(2008) John M. H. Lo et al.   Journal of Physical Chemistry C

Fischer−Tropsch Mechanism Revisited:  Alternative Pathways for the Production of Higher Hydrocarbons from Synthesis Gas

(2008) Oliver R. Inderwildi et al.   Journal of Physical Chemistry C

Intermediates in the Formation of Graphitic Carbon on a Flat FCC-Co(111) Surface

(2008) Jurie C. W. Swart et al.   Journal of Physical Chemistry C

Bulk and surface analysis of Hägg Fe carbide (Fe5C2): a density functional theory study

(2008) P J Steynberg et al.   JOURNAL OF PHYSICS-CONDENSED MATTER

Origin of Selectivity Switch in Fischer−Tropsch Synthesis over Ru and Rh from First-Principles Statistical Mechanics Studies

(2008) Jia Chen et al.   JOURNAL OF THE AMERICAN CHEMICAL SOCIETY

Interaction of graphene with FCC–Co(111)

(2008) J. C. W. Swart et al.   PHYSICAL CHEMISTRY CHEMICAL PHYSICS

Studies on the reaction mechanism of the Fischer–Tropsch synthesis on iron and cobalt

(2007) J. Gaube et al.   JOURNAL OF MOLECULAR CATALYSIS A-CHEMICAL