CO2 electroreduction performance of a single transition metal atom supported on porphyrin-like graphene: a computational study

Thermochemical and electrochemical CO 2 reduction on octahedral Cu nanocluster: Role of solvent towards product selectivity

(2017) Kuber Singh Rawat et al.   JOURNAL OF CATALYSIS

Enhancing CO2 Electroreduction by Tailoring Strain and Ligand Effects in Bimetallic Copper–Rhodium and Copper–Nickel Heterostructures

(2017) Tuhina Adit Maark et al.   Journal of Physical Chemistry C

CO2 Electroreduction Performance of Phthalocyanine Sheet with Mn Dimer: A Theoretical Study

(2017) Haoming Shen et al.   Journal of Physical Chemistry C

Enhancing CO2 Electroreduction with the Metal–Oxide Interface

(2017) Dunfeng Gao et al.   JOURNAL OF THE AMERICAN CHEMICAL SOCIETY

Electrochemical reduction of CO2 on graphene supported transition metals – towards single atom catalysts

(2017) Haiying He et al.   PHYSICAL CHEMISTRY CHEMICAL PHYSICS

Recent Advances in Atomic Metal Doping of Carbon-based Nanomaterials for Energy Conversion

(2017) Bita Bayatsarmadi et al.   Small

Single-atom catalysts for CO2 electroreduction with significant activity and selectivity improvements

(2017) Seoin Back et al.   Chemical Science

CO2 Electroreduction on Au/TiC: Enhanced Activity Due to Metal–Support Interaction

(2017) Jun-Hyuk Kim et al.   ACS Catalysis

Support Effects in Single-Atom Platinum Catalysts for Electrochemical Oxygen Reduction

(2017) Sungeun Yang et al.   ACS Catalysis

Theoretical insight into effect of doping of transition metal M (M = Ni, Pd and Pt) on CO2 reduction pathways on Cu(111) and understanding of origin of electrocatalytic activity

(2017) Lihui Ou et al.   RSC Advances

Computational screening for high-activity MoS2 monolayer-based catalysts for the oxygen reduction reaction via substitutional doping with transition metal

(2017) Zhongxu Wang et al.   Journal of Materials Chemistry A

TiC- and TiN-Supported Single-Atom Catalysts for Dramatic Improvements in CO2 Electrochemical Reduction to CH4

(2017) Seoin Back et al.   ACS Energy Letters

Recent Advances in Inorganic Heterogeneous Electrocatalysts for Reduction of Carbon Dioxide

(2016) Dong Dong Zhu et al.   ADVANCED MATERIALS

Single-Atom Pt as Co-Catalyst for Enhanced Photocatalytic H2 Evolution

(2016) Xiaogang Li et al.   ADVANCED MATERIALS

3 d transition metal embedded C 2 N monolayers as promising single-atom catalysts: A first-principles study

(2016) D.W. Ma et al.   CARBON

Improved performance of supported single-atom catalysts via increased surface active sites

(2016) Yaxin Chen et al.   CATALYSIS COMMUNICATIONS

High-Performance Ru1 /CeO2 Single-Atom Catalyst for CO Oxidation: A Computational Exploration

(2016) Fengyu Li et al.   CHEMPHYSCHEM

CO and CO2 Electrochemical Reduction to Methane on Cu, Ni, and Cu3Ni (211) Surfaces

(2016) Tuhina Adit Maark et al.   Journal of Physical Chemistry C

Single Atom (Pd/Pt) Supported on Graphitic Carbon Nitride as an Efficient Photocatalyst for Visible-Light Reduction of Carbon Dioxide

(2016) Guoping Gao et al.   JOURNAL OF THE AMERICAN CHEMICAL SOCIETY

The Impact of Specifically Adsorbed Ions on the Copper-Catalyzed Electroreduction of CO2

(2016) Sneha A. Akhade et al.   JOURNAL OF THE ELECTROCHEMICAL SOCIETY

Barriers of Electrochemical CO2 Reduction on Transition Metals

(2016) Chuan Shi et al.   ORGANIC PROCESS RESEARCH & DEVELOPMENT

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

(2016) Wengang Liu et al.   Chemical Science

Curvature-Dependent Selectivity of CO2 Electrocatalytic Reduction on Cobalt Porphyrin Nanotubes

(2016) Guizhi Zhu et al.   ACS Catalysis

Probing the Mechanism of Aqueous CO2 Reduction on Post-Transition-Metal Electrodes using ATR-IR Spectroelectrochemistry

(2016) James E. Pander et al.   ACS Catalysis

Water-Mediated Mars–Van Krevelen Mechanism for CO Oxidation on Ceria-Supported Single-Atom Pt1 Catalyst

(2016) Chunlei Wang et al.   ACS Catalysis

Recent Advances in Breaking Scaling Relations for Effective Electrochemical Conversion of CO2

(2016) Yawei Li et al.   Advanced Energy Materials

Theoretical insight on reactivity trends in CO2 electroreduction across transition metals

(2016) Sneha A. Akhade et al.   Catalysis Science & Technology

A Ti-anchored Ti2CO2 monolayer (MXene) as a single-atom catalyst for CO oxidation

(2016) Xu Zhang et al.   Journal of Materials Chemistry A

Controlled assembly of Cu nanoparticles on pyridinic-N rich graphene for electrochemical reduction of CO 2 to ethylene

(2016) Qing Li et al.   Nano Energy

Electrochemical CO 2 reduction: Electrocatalyst, reaction mechanism, and process engineering

(2016) Qi Lu et al.   Nano Energy

Ultrathin Co3 O4 Layers Realizing Optimized CO2 Electroreduction to Formate

(2015) Shan Gao et al.   ANGEWANDTE CHEMIE-INTERNATIONAL EDITION

CO2 Hydrogenation to Formate and Methanol as an Alternative to Photo- and Electrochemical CO2 Reduction

(2015) Wan-Hui Wang et al.   CHEMICAL REVIEWS

Engineering Transition-Metal-Coated Tungsten Carbides for Efficient and Selective Electrochemical Reduction of CO2to Methane

(2015) Sippakorn Wannakao et al.   ChemSusChem

Catalysts and Reaction Pathways for the Electrochemical Reduction of Carbon Dioxide

(2015) Ruud Kortlever et al.   Journal of Physical Chemistry Letters

Iron-embedded boron nitride nanosheet as a promising electrocatalyst for the oxygen reduction reaction (ORR): A density functional theory (DFT) study

(2015) Li-yan Feng et al.   JOURNAL OF POWER SOURCES

Carbon Dioxide Conversion to Methanol over Size-Selected Cu4 Clusters at Low Pressures

(2015) Cong Liu et al.   JOURNAL OF THE AMERICAN CHEMICAL SOCIETY

Heterogeneous catalytic conversion of CO2: a comprehensive theoretical review

(2015) Yawei Li et al.   Nanoscale

Fe– and Co–P4-embedded graphenes as electrocatalysts for the oxygen reduction reaction: theoretical insights

(2015) Liyan Feng et al.   PHYSICAL CHEMISTRY CHEMICAL PHYSICS

Electrocatalytic reduction of carbon dioxide to carbon monoxide and methane at an immobilized cobalt protoporphyrin

(2015) Jing Shen et al.   Nature Communications

CO2 Electroreduction Performance of Transition Metal Dimers Supported on Graphene: A Theoretical Study

(2015) Yawei Li et al.   ACS Catalysis

Catalysis Applications of Size-Selected Cluster Deposition

(2015) Stefan Vajda et al.   ACS Catalysis

Trace Levels of Copper in Carbon Materials Show Significant Electrochemical CO2 Reduction Activity

(2015) Yanwei Lum et al.   ACS Catalysis

Identifying systematic DFT errors in catalytic reactions

(2015) Rune Christensen et al.   Catalysis Science & Technology

Recent Technological Progress in CO2Electroreduction to Fuels and Energy Carriers in Aqueous Environments

(2015) Manuela Bevilacqua et al.   Energy Technology

Reaction mechanisms of CO2 electrochemical reduction on Cu(111) determined with density functional theory

(2014) Xiaowa Nie et al.   JOURNAL OF CATALYSIS

Carbon dioxide conversion into hydrocarbon fuels on defective graphene-supported Cu nanoparticles from first principles

(2014) Dong-Hee Lim et al.   Nanoscale

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

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

Exploration of High-Performance Single-Atom Catalysts on Support M1/FeOx for CO Oxidation via Computational Study

(2014) Fengyu Li et al.   ACS Catalysis

Theoretical Considerations on the Electroreduction of CO to C2Species on Cu(100) Electrodes

(2013) Federico Calle-Vallejo et al.   ANGEWANDTE CHEMIE-INTERNATIONAL EDITION

Selectivity of CO2Reduction on Copper Electrodes: The Role of the Kinetics of Elementary Steps

(2013) Xiaowa Nie et al.   ANGEWANDTE CHEMIE-INTERNATIONAL EDITION

A review of catalysts for the electroreduction of carbon dioxide to produce low-carbon fuels

(2013) Jinli Qiao et al.   CHEMICAL SOCIETY REVIEWS

CO2 Electroreduction on Well-Defined Bimetallic Surfaces: Cu Overlayers on Pt(111) and Pt(211)

(2013) Ana Sofia Varela 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

Electrochemical ammonia production on molybdenum nitride nanoclusters

(2013) J. G. Howalt et al.   PHYSICAL CHEMISTRY CHEMICAL PHYSICS

DFT based study of transition metal nano-clusters for electrochemical NH3 production

(2013) J. G. Howalt et al.   PHYSICAL CHEMISTRY CHEMICAL PHYSICS

Activity Descriptors for CO2 Electroreduction to Methane on Transition-Metal Catalysts

(2012) Andrew A. Peterson et al.   Journal of Physical Chemistry Letters

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

(2011) Botao Qiao et al.   Nature Chemistry

A theoretical evaluation of possible transition metal electro-catalysts for N2reduction

(2011) Egill Skúlason et al.   PHYSICAL CHEMISTRY CHEMICAL PHYSICS

How copper catalyzes the electroreduction of carbon dioxide into hydrocarbon fuels

(2010) Andrew A. Peterson et al.   Energy & Environmental Science

Prospects of CO2 Utilization via Direct Heterogeneous Electrochemical Reduction

(2010) Devin T. Whipple et al.   Journal of Physical Chemistry Letters