CO oxidation on Ni and Cu embedded graphdiyne as efficient noble metal-free catalysts: A first-principles density-functional theory investigation

Surface Modification Strategy for Promoting the Performance of Non-noble Metal Single-Atom Catalysts in Low-Temperature CO Oxidation

(2020) Hai-Cai Huang et al.   ACS Applied Materials & Interfaces

Fe doped BN monolayer: A promising low-cost single atom catalyst for promoted CO oxidation activity

(2020) Donglin Li et al.   APPLIED SURFACE SCIENCE

Highly Efficient and Selective Generation of Ammonia and Hydrogen on a Graphdiyne-Based Catalyst

(2019) Lan Hui et al.   JOURNAL OF THE AMERICAN CHEMICAL SOCIETY

Catalytic CO oxidation by Fe doped penta-graphene: A density functional study

(2019) Donglin Li et al.   Molecular Catalysis

Computational Screening of Single Non-Noble Transition-Metal Atoms Confined Inside Boron Nitride Nanotubes for CO Oxidation

(2019) Cai Ning et al.   Journal of Physical Chemistry C

A promising and new single-atom catalyst for CO oxidation: Si-embedded MoS2 monolayer

(2019) Mehdi D. Esrafili et al.   JOURNAL OF PHYSICS AND CHEMISTRY OF SOLIDS

Carbon monoxide electroreduction as an emerging platform for carbon utilization

(2019) Matthew Jouny et al.   Nature Catalysis

Engineering the Coordination Environment of Single-Atom Platinum Anchored on Graphdiyne for Optimizing Electrocatalytic Hydrogen Evolution

(2018) Xue-Peng Yin et al.   ANGEWANDTE CHEMIE-INTERNATIONAL EDITION

A comparative DFT study on CO oxidation reaction over Si-doped BC 2 N nanosheet and nanotube

(2018) Parisa Nematollahi et al.   APPLIED SURFACE SCIENCE

Anchoring zero valence single atoms of nickel and iron on graphdiyne for hydrogen evolution

(2018) Yurui Xue et al.   Nature Communications

First-Principles Study on the Single Ir Atom Embedded Graphdiyne: An Efficient Catalyst for CO Oxidation

(2018) Guoliang Xu et al.   Journal of Physical Chemistry C

Graphdiyne-Supported Single-Atom-Sized Fe Catalysts for the Oxygen Reduction Reaction: DFT Predictions and Experimental Validations

(2018) Yuan Gao et al.   ACS Catalysis

Rational Design of Ag38 Cluster Supported by Graphdiyne for Catalytic CO Oxidation

(2017) Z. W. Chen et al.   Journal of Physical Chemistry C

High-efficient physical adsorption and detection of formaldehyde using Sc- and Ti-decorated graphdiyne

(2017) Xi Chen et al.   PHYSICS LETTERS A

First principles study on the interfacial properties of NM/graphdiyne (NM = Pd, Pt, Rh and Ir): The implications for NM growing

(2016) Zhansheng Lu et al.   APPLIED SURFACE SCIENCE

Graphdiyne-supported single-atom Sc and Ti catalysts for high-efficient CO oxidation

(2016) Zheng-Zhe Lin   CARBON

Single non-noble-metal cobalt atom stabilized by pyridinic vacancy graphene: An efficient catalyst for CO oxidation

(2016) Xilin Zhang et al.   JOURNAL OF MOLECULAR CATALYSIS A-CHEMICAL

CO oxidation catalyzed by the single Co atom embedded hexagonal boron nitride nanosheet: a DFT-D study

(2016) Zhansheng Lu et al.   PHYSICAL CHEMISTRY CHEMICAL PHYSICS

Investigation of heavy metal atoms adsorption onto graphene and graphdiyne surface: A density functional theory study

(2016) A. Hamed Mashhadzadeh et al.   SUPERLATTICES AND MICROSTRUCTURES

CO catalytic oxidation on iron-embedded monolayer MoS2

(2015) Dongwei Ma et al.   APPLIED SURFACE SCIENCE

Graphyne as a promising substrate for the noble-metal single-atom catalysts

(2015) D.W. Ma et al.   CARBON

CO Oxidation on Gold-Supported Iron Oxides: New Insights into Strong Oxide–Metal Interactions

(2015) Liang Yu et al.   Journal of Physical Chemistry C

Graphyne-supported single Fe atom catalysts for CO oxidation

(2015) Ping Wu et al.   PHYSICAL CHEMISTRY CHEMICAL PHYSICS

Pristine graphdiyne-hybridized photocatalysts using graphene oxide as a dual-functional coupling reagent

(2015) Xiao Zhang et al.   PHYSICAL CHEMISTRY CHEMICAL PHYSICS

Theoretical and Experimental Investigations on Single-Atom Catalysis: Ir1/FeOx for CO Oxidation

(2014) Jin-Xia Liang et al.   Journal of Physical Chemistry C

Graphdiyne as a metal-free catalyst for low-temperature CO oxidation

(2014) Ping Wu et al.   PHYSICAL CHEMISTRY CHEMICAL PHYSICS

Formation and catalytic activity of Pt supported on oxidized graphene for the CO oxidation reaction

(2014) Yanan Tang et al.   PHYSICAL CHEMISTRY CHEMICAL PHYSICS

Magnetic Properties of Single Transition-Metal Atom Absorbed Graphdiyne and Graphyne Sheet from DFT+U Calculations

(2012) Junjie He et al.   Journal of Physical Chemistry C

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

(2011) Botao Qiao et al.   Nature Chemistry

Engineering quantum anomalous/valley Hall states in graphene via metal-atom adsorption: Anab-initiostudy

(2011) Jun Ding et al.   PHYSICAL REVIEW B

Architecture of graphdiyne nanoscale films

(2010) Guoxing Li et al.   CHEMICAL COMMUNICATIONS

CO Catalytic Oxidation on Iron-Embedded Graphene: Computational Quest for Low-Cost Nanocatalysts

(2010) Yafei Li et al.   Journal of Physical Chemistry C

Embedding Transition-Metal Atoms in Graphene: Structure, Bonding, and Magnetism

(2009) A. V. Krasheninnikov et al.   PHYSICAL REVIEW LETTERS