Screening single-atom catalysts for methane activation: α−Al2O3(0001) -supported Ni

Thermal Methane Conversion to Syngas Mediated by Rh1-Doped Aluminum Oxide Cluster Cations RhAl3O4+

(2016) Ya-Ke Li et al.   JOURNAL OF THE AMERICAN CHEMICAL SOCIETY

Atomically Dispersed Ru on Ultrathin Pd Nanoribbons

(2016) Jingjie Ge et al.   JOURNAL OF THE AMERICAN CHEMICAL SOCIETY

Understanding trends in C–H bond activation in heterogeneous catalysis

(2016) Allegra A. Latimer et al.   NATURE MATERIALS

Thermally stable single-atom platinum-on-ceria catalysts via atom trapping

(2016) J. Jones et al.   SCIENCE

Photochemical route for synthesizing atomically dispersed palladium catalysts

(2016) P. Liu et al.   SCIENCE

Single-atom dispersed Co–N–C catalyst: structure identification and performance for hydrogenative coupling of nitroarenes

(2016) Wengang Liu et al.   Chemical Science

Platinum single-atom and cluster catalysis of the hydrogen evolution reaction

(2016) Niancai Cheng et al.   Nature Communications

Understanding and Tuning the Intrinsic Hydrophobicity of Rare-Earth Oxides: A DFT+U Study

(2015) Giuliano Carchini et al.   ACS Applied Materials & Interfaces

Dynamic formation of single-atom catalytic active sites on ceria-supported gold nanoparticles

(2015) Yang-Gang Wang et al.   Nature Communications

Electronic Metal-Support Interactions in Single-Atom Catalysts

(2014) Pingping Hu et al.   ANGEWANDTE CHEMIE-INTERNATIONAL EDITION

Thermal Methane Conversion to Formaldehyde Promoted by Single Platinum Atoms in PtAl2O4−Cluster Anions

(2014) Yan-Xia Zhao et al.   ANGEWANDTE CHEMIE-INTERNATIONAL EDITION

Effect of carbon on the Ni catalyzed methane cracking reaction: A DFT study

(2014) Jingde Li et al.   APPLIED SURFACE SCIENCE

CO Oxidation Catalyzed by Single Gold Atoms Supported on Aluminum Oxide Clusters

(2014) Zi-Yu Li et al.   JOURNAL OF THE AMERICAN CHEMICAL SOCIETY

Improved catalytic activity of rhodium monolayer modified nickel (110) surface for the methane dehydrogenation reaction: a first-principles study

(2014) Pallavi Bothra et al.   Nanoscale

Direct, Nonoxidative Conversion of Methane to Ethylene, Aromatics, and Hydrogen

(2014) X. Guo et al.   SCIENCE

Single-Atom Catalysts: A New Frontier in Heterogeneous Catalysis

(2013) Xiao-Feng Yang et al.   ACCOUNTS OF CHEMICAL RESEARCH

Effect of Metal–Support Interface During CH4 and H2 Dissociation on Ni/γ-Al2O3: A Density Functional Theory Study

(2013) Jingde Li et al.   Journal of Physical Chemistry C

Remarkable Performance of Ir1/FeOx Single-Atom Catalyst in Water Gas Shift Reaction

(2013) Jian Lin et al.   JOURNAL OF THE AMERICAN CHEMICAL SOCIETY

Catalytically active single-atom niobium in graphitic layers

(2013) Xuefeng Zhang et al.   Nature Communications

Single-atom Catalysis Using Pt/Graphene Achieved through Atomic Layer Deposition

(2013) Shuhui Sun et al.   Scientific Reports

Theoretical study of two states reactivity of methane activation on iron atom and iron dimer

(2012) Qiao Sun et al.   FUEL

Density functionals for surface science: Exchange-correlation model development with Bayesian error estimation

(2012) Jess Wellendorff et al.   PHYSICAL REVIEW B

Isolated Metal Atom Geometries as a Strategy for Selective Heterogeneous Hydrogenations

(2012) Georgios Kyriakou et al.   SCIENCE

Methane Dissociation on High and Low Indices Rh Surfaces

(2011) Pieter W. van Grootel et al.   Journal of Physical Chemistry C

Single-atom catalysis of CO oxidation using Pt1/FeO x

(2011) Botao Qiao et al.   Nature Chemistry

Linear Alkane Polymerization on a Gold Surface

(2011) D. Zhong et al.   SCIENCE

Methane Activation and Catalytic Ethylene Formation on Free Au2+

(2010) Sandra M. Lang et al.   ANGEWANDTE CHEMIE-INTERNATIONAL EDITION

Methane dissociation and adsorption on Ni(111), Pt(111), Ni(100), Pt(100), and Pt(110)-(1×2): Energetic study

(2010) Sven Nave et al.   JOURNAL OF CHEMICAL PHYSICS

The unusual surface chemistry of α-Al2O3 (0001)

(2010) Die Yang et al.   PHYSICAL CHEMISTRY CHEMICAL PHYSICS

Comparative study of the kinetics of methane steam reforming on supported Ni and Sn/Ni alloy catalysts: The impact of the formation of Ni alloy on chemistry

(2009) Eranda Nikolla et al.   JOURNAL OF CATALYSIS

Influence of Nickel Catalyst Geometry on the Dissociation Barriers of H2 and CH4: Ni13 versus Ni(111)

(2009) Bin Liu 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

Coordinatively Unsaturated Al3+ Centers as Binding Sites for Active Catalyst Phases of Platinum on  -Al2O3

(2009) J. H. Kwak et al.   SCIENCE

Gas-phase activation of methane by ligated transition-metal cations

(2008) D. Schroder et al.   PROCEEDINGS OF THE NATIONAL ACADEMY OF SCIENCES OF THE UNITED STATES OF AMERICA