Mechanistic Study of Efficient Producing CO2 Electroreduction via 2D Metal-Organic Frameworks M3(2,3,6,7,10,11-hexaiminotriphenylene)2 Surface

Mechanism of Electrocatalytically Active Precious Metal (Ni, Pd, Pt, and Ru) Complexes in the Graphene Basal Plane for ORR Applications in Novel Fuel Cells

(2020) Weibin Zhang et al.   ENERGY & FUELS

Electrochemical CO2 Reduction to CO Catalyzed by 2D Nanostructures

(2020) Chaitanya B. Hiragond et al.   Catalysts

High-Throughput Approach Exploitation: Two-Dimensional Double-Metal Sulfide (M2S2) of Efficient Electrocatalysts for Oxygen Reduction Reaction in Fuel Cells

(2020) Yi Xiao et al.   ENERGY & FUELS

Bifunctional HER/OER or OER/ORR Catalytic Activity of Two-Dimensional TM3(HITP)2 with TM = Fe–Zn

(2020) Junru Wang et al.   Journal of Physical Chemistry C

Grain-Boundary-Rich Copper for Efficient Solar-Driven Electrochemical CO2 Reduction to Ethylene and Ethanol

(2020) Zhiqiang Chen et al.   JOURNAL OF THE AMERICAN CHEMICAL SOCIETY

Facile synthesis of novel Mn-doped Bi4O5Br2 for enhanced photocatalytic NO removal activity

(2020) Wei-Bin Zhang et al.   JOURNAL OF ALLOYS AND COMPOUNDS

Rhodium and Nitrogen Codoped Graphene as a Bifunctional Electrocatalyst for the Oxygen Reduction Reaction and CO2 Reduction Reaction: Mechanism Insights

(2019) Yanan Meng et al.   Journal of Physical Chemistry C

A new promising catalytic activity on blue phosphorene nitrogen-doped nanosheets for the ORR as cathode in nonaqueous Li–air batteries

(2019) Yi Xiao et al.   APPLIED SURFACE SCIENCE

Whether Corrugated or Planar Vacancy Graphene-like Carbon Nitride (g-C3N4) Is More Effective for Nitrogen Reduction Reaction?

(2019) Chunjin Ren et al.   Journal of Physical Chemistry C

Multifunctional Transition Metal‐Based Phosphides in Energy‐Related Electrocatalysis

(2019) Yang Li et al.   Advanced Energy Materials

2D/2D Heterojunction of Ultrathin MXene/Bi2 WO6 Nanosheets for Improved Photocatalytic CO2 Reduction

(2018) Shaowen Cao et al.   ADVANCED FUNCTIONAL MATERIALS

Surface Immobilization of Transition Metal Ions on Nitrogen-Doped Graphene Realizing High-Efficient and Selective CO2 Reduction

(2018) Wentuan Bi et al.   ADVANCED MATERIALS

Theoretical insights into the catalytic mechanism for the oxygen reduction reaction on M3(hexaiminotriphenylene)2 (M = Ni, Cu)

(2018) Yu Tian et al.   PHYSICAL CHEMISTRY CHEMICAL PHYSICS

Calculations of Product Selectivity in Electrochemical CO2 Reduction

(2018) Javed Hussain et al.   ACS Catalysis

Elucidating the active sites for CO2 electroreduction on ligand-protected Au25 nanoclusters

(2018) Natalie Austin et al.   Catalysis Science & Technology

Establishing new scaling relations on two-dimensional MXenes for CO2 electroreduction

(2018) Albertus D. Handoko et al.   Journal of Materials Chemistry A

CO2 electroreduction on copper-cobalt nanoparticles: Size and composition effect

(2018) M. Bernal et al.   Nano Energy

Metal-Free Boron Nitride Nanoribbon Catalysts for Electrochemical CO2 Reduction: Combining High Activity and Selectivity

(2018) Shaobin Tang et al.   ACS Applied Materials & Interfaces

Alloy Nanocatalysts for the Electrochemical Oxygen Reduction (ORR) and the Direct Electrochemical Carbon Dioxide Reduction Reaction (CO2 RR)

(2018) Cheonghee Kim et al.   ADVANCED MATERIALS

An In Situ Surface-Enhanced Infrared Absorption Spectroscopy Study of Electrochemical CO2 Reduction: Selectivity Dependence on Surface C-Bound and O-Bound Reaction Intermediates

(2018) Yu Katayama et al.   Journal of Physical Chemistry C

Molecular Nitrogen-Carbon Catalysts, Solid Metal Organic Framework Catalysts, and Solid Metal/Nitrogen-Doped Carbon (MNC) Catalysts for the Electrochemical CO2 Reduction

(2018) Ana Sofia Varela et al.   Advanced Energy Materials

DFT study of the two dimensional metal–organic frameworks X3(HITP)2 as the cathode electrocatalysts for fuel cell

(2018) Xin Chen et al.   APPLIED SURFACE SCIENCE

Electrochemical reduction of carbon dioxide on the two–dimensional M3(Hexaiminotriphenylene)2 sheet: A computational study

(2018) Yu Tian et al.   APPLIED SURFACE SCIENCE

Signature of Metallic Behavior in the Metal–Organic Frameworks M3(hexaiminobenzene)2 (M = Ni, Cu)

(2017) Jin-Hu Dou et al.   JOURNAL OF THE AMERICAN CHEMICAL SOCIETY

Theoretical Investigations into Defected Graphene for Electrochemical Reduction of CO2

(2017) Samira Siahrostami et al.   ACS Sustainable Chemistry & Engineering

Light-Driven Heterogeneous Reduction of Carbon Dioxide: Photocatalysts and Photoelectrodes

(2015) James L. White et al.   CHEMICAL REVIEWS

Metal–organic Kagome lattices M3(2,3,6,7,10,11-hexaiminotriphenylene)2 (M = Ni and Cu): from semiconducting to metallic by metal substitution

(2015) Shuang Chen et al.   PHYSICAL CHEMISTRY CHEMICAL PHYSICS

Thermal Facet Healing of Concave Octahedral Pt–Ni Nanoparticles Imaged in Situ at the Atomic Scale: Implications for the Rational Synthesis of Durable High-Performance ORR Electrocatalysts

(2015) Lin Gan et al.   ACS Catalysis

Trends in electrochemical CO2 reduction activity for open and close-packed metal surfaces

(2014) Chuan Shi et al.   PHYSICAL CHEMISTRY CHEMICAL PHYSICS

Rationalization of Interactions in Precious Metal/Ceria Catalysts Using the d-Band Center Model

(2013) N. Acerbi et al.   ANGEWANDTE CHEMIE-INTERNATIONAL EDITION

High emission of carbon dioxide and methane during ice thaw in high latitude lakes

(2013) Jan Karlsson et al.   GEOPHYSICAL RESEARCH LETTERS

Ultrathin, Single-Crystal WO3 Nanosheets by Two-Dimensional Oriented Attachment toward Enhanced Photocatalystic Reduction of CO2 into Hydrocarbon Fuels under Visible Light

(2012) Xiaoyu Chen et al.   ACS Applied Materials & Interfaces

Generalization of Natural Bond Orbital Analysis to Periodic Systems: Applications to Solids and Surfaces via Plane-Wave Density Functional Theory

(2012) Benjamin D. Dunnington et al.   Journal of Chemical Theory and Computation

System-Dependent Dispersion Coefficients for the DFT-D3 Treatment of Adsorption Processes on Ionic Surfaces

(2011) Stephan Ehrlich et al.   CHEMPHYSCHEM

Metal–organic framework materials as catalysts

(2009) JeongYong Lee et al.   CHEMICAL SOCIETY REVIEWS

Towards the computational design of solid catalysts

(2009) J. K. Nørskov et al.   Nature Chemistry