4.7 Article

Computational Study of Low-Energy Pt-Ion Implantation into Graphene for Single-Atom Catalysis

相关参考文献

注意:仅列出部分参考文献,下载原文获取全部文献信息。
Article Chemistry, Multidisciplinary

Doping Graphene with Substitutional Mn

Pin-Cheng Lin et al.

Summary: The study demonstrates the successful incorporation of substitutional Mn atoms in high-quality epitaxial graphene using ultralow-energy ion implantation. The position of substitutional Mn atoms with respect to the Moire superstructure and the carbon sublattice, as well as their slight displacement towards the Cu surface in the out-of-plane direction, were characterized. The doped graphene retains the Dirac-like band structure of pristine graphene on Cu(111), making it an ideal system for studying the interplay between local magnetic moments and Dirac electrons.

ACS NANO (2021)

Review Chemistry, Physical

Metal single-atom catalysts for selective hydrogenation of unsaturated bonds

Zhiyi Sun et al.

Summary: Selective hydrogenation is widely used in various fields, and single atom catalysts show excellent catalytic performance by reducing the particle size to the single atom level. Research progress indicates that synthesis methods, composition content, monatomic coordination, and the charge relationship between metal and carrier all affect the catalytic performance of single atom catalysts.

JOURNAL OF MATERIALS CHEMISTRY A (2021)

Review Chemistry, Physical

Oxygen defect-stabilized heterogeneous single atom catalysts: preparation, properties and catalytic application

Lei Zhang et al.

Summary: The review presents the synthetic strategies for oxygen defect-SACs and highlights the relationship between oxygen defects and the stability of metal species. Additionally, characterization methods of oxygen vacancies and recent applications of SACs are summarized.

JOURNAL OF MATERIALS CHEMISTRY A (2021)

Article Chemistry, Multidisciplinary

Transition-metal single atoms embedded into defective BC3 as efficient electrocatalysts for oxygen evolution and reduction reactions

Yanan Zhou et al.

Summary: Finding high-activity, stable, and low-cost catalysts for the oxygen evolution reaction (OER) and oxygen reduction reaction (ORR) is crucial for the development of renewable energy technologies. Using computational screening based on density functional theory, it was found that transition metal atoms doped on defective BC3 monolayers exhibit efficient catalytic properties for OER and ORR. The study highlights the potential of single atom catalysts based on carbon materials for efficient and stable catalytic activity.

NANOSCALE (2021)

Article Chemistry, Physical

Stabilizing mechanism of single-atom catalysts on a defective carbon surface

Lianping Wu et al.

NPJ COMPUTATIONAL MATERIALS (2020)

Article Materials Science, Multidisciplinary

Interatomic potentials for Pt-C and Pd-C systems and a study of structure-adsorption relationship in large Pt/graphene system

Ga-Un Jeong et al.

COMPUTATIONAL MATERIALS SCIENCE (2020)

Review Chemistry, Physical

Atomic-Local Environments of Single-Atom Catalysts: Synthesis, Electronic Structure, and Activity

Wei-Hong Lai et al.

ADVANCED ENERGY MATERIALS (2019)

Article Chemistry, Multidisciplinary

Platinum single-atom adsorption on graphene: a density functional theory study

Sasfan Arman Wella et al.

NANOSCALE ADVANCES (2019)

Article Chemistry, Multidisciplinary

Implanting Germanium into Graphene

Mukesh Tripathi et al.

ACS NANO (2018)

Article Chemistry, Physical

Graphene milling dynamics during helium ion beam irradiation

Songkil Kim et al.

CARBON (2018)

Review Chemistry, Multidisciplinary

Metal Catalysts for Heterogeneous Catalysis: From Single Atoms to Nanoclusters and Nanoparticles

Lichen Liu et al.

CHEMICAL REVIEWS (2018)

Article Chemistry, Physical

Atomic adsorption on graphene with a single vacancy: systematic DFT study through the periodic table of elements

Igor A. Pasti et al.

PHYSICAL CHEMISTRY CHEMICAL PHYSICS (2018)

Article Chemistry, Multidisciplinary

Graphene Defects Trap Atomic Ni Species for Hydrogen and Oxygen Evolution Reactions

Longzhou Zhang et al.

Review Chemistry, Multidisciplinary

Heterogeneous single-atom catalysis

Aiqin Wang et al.

NATURE REVIEWS CHEMISTRY (2018)

Article Engineering, Electrical & Electronic

Mitigating e-beam-induced hydrocarbon deposition on graphene for atomic-scale scanning transmission electron microscopy studies

Ondrej Dyck et al.

JOURNAL OF VACUUM SCIENCE & TECHNOLOGY B (2018)

Article Materials Science, Multidisciplinary

Cleaning graphene: Comparing heat treatments in air and in vacuum

Mukesh Tripathi et al.

PHYSICA STATUS SOLIDI-RAPID RESEARCH LETTERS (2017)

Article Nanoscience & Nanotechnology

Nanopore Creation in Graphene by Ion Beam Irradiation: Geometry, Quality, and Efficiency

Zhitong Bai et al.

ACS APPLIED MATERIALS & INTERFACES (2016)

Article Chemistry, Physical

Mechanisms of monovacancy diffusion in graphene

Jack D. Wadey et al.

CHEMICAL PHYSICS LETTERS (2016)

Article Multidisciplinary Sciences

Tuning selectivity of electrochemical reactions by atomically dispersed platinum catalyst

Chang Hyuck Choi et al.

NATURE COMMUNICATIONS (2016)

Article Chemistry, Multidisciplinary

Ion implantation of low energy Si into graphene: insight from computational studies

Weisen Li et al.

RSC ADVANCES (2015)

Article Chemistry, Physical

Simulation of ion beam sputtering with SDTrimSP, TRIDYN and SRIM

H. Hofsaess et al.

APPLIED SURFACE SCIENCE (2014)

Article Chemistry, Multidisciplinary

Vacancy diffusion and coalescence in graphene directed by defect strain fields

Thomas Trevethan et al.

NANOSCALE (2014)

Article Chemistry, Physical

Stability and dynamics of vacancy in graphene flakes: Edge effects

Adriano Santana et al.

CHEMICAL PHYSICS LETTERS (2013)

Article Physics, Applied

Fabrication of nanopores in a graphene sheet with heavy ions: A molecular dynamics study

Weisen Li et al.

JOURNAL OF APPLIED PHYSICS (2013)

Article Chemistry, Physical

The Effect of N and B Doping on Graphene and the Adsorption and Migration Behavior of Pt Atoms

Christopher L. Muhich et al.

JOURNAL OF PHYSICAL CHEMISTRY C (2013)

Article Chemistry, Multidisciplinary

Ion Implantation of Graphene-Toward IC Compatible Technologies

U. Bangert et al.

NANO LETTERS (2013)

Article Physics, Condensed Matter

Kinetic Stability of Octagraphene

A. I. Podlivaev et al.

PHYSICS OF THE SOLID STATE (2013)

Article Physics, Condensed Matter

On the connection between structural distortion and magnetism in graphene with a single vacancy

Wendel S. Paz et al.

SOLID STATE COMMUNICATIONS (2013)

Article Multidisciplinary Sciences

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

Shuhui Sun et al.

SCIENTIFIC REPORTS (2013)

Article Physics, Applied

Analysis of vacancy-induced amorphization of single-layer graphene

Corinne Carpenter et al.

APPLIED PHYSICS LETTERS (2012)

Article Chemistry, Physical

Molecular Dynamics Simulations of Ion-Bombarded Graphene

Edson P. Bellido et al.

JOURNAL OF PHYSICAL CHEMISTRY C (2012)

Article Chemistry, Physical

A theoretical simulation on the catalytic oxidation of CO on Pt/graphene

Yanan Tang et al.

PHYSICAL CHEMISTRY CHEMICAL PHYSICS (2012)

Review Chemistry, Physical

Graphene-based materials for catalysis

Bruno F. Machado et al.

CATALYSIS SCIENCE & TECHNOLOGY (2012)

Review Chemistry, Multidisciplinary

Structural Defects in Graphene

Florian Banhart et al.

ACS NANO (2011)

Article Chemistry, Physical

Trapping of metal atoms in the defects on graphene

Yanan Tang et al.

JOURNAL OF CHEMICAL PHYSICS (2011)

Article Physics, Condensed Matter

Migration of adatom adsorption on graphene using DFT calculation

K. Nakada et al.

SOLID STATE COMMUNICATIONS (2011)

Article Materials Science, Multidisciplinary

Diffusion and coalescence of vacancies and interstitials in graphite: A first-principles study

Hongyu Zhang et al.

DIAMOND AND RELATED MATERIALS (2010)

Article Materials Science, Multidisciplinary

Visualization and analysis of atomistic simulation data with OVITO-the Open Visualization Tool

Alexander Stukowski

MODELLING AND SIMULATION IN MATERIALS SCIENCE AND ENGINEERING (2010)

Article Chemistry, Physical

Improving platinum catalyst binding energy to graphene through nitrogen doping

M. N. Groves et al.

CHEMICAL PHYSICS LETTERS (2009)

Article Physics, Multidisciplinary

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

A. V. Krasheninnikov et al.

PHYSICAL REVIEW LETTERS (2009)

Article Chemistry, Multidisciplinary

Direct Imaging of Lattice Atoms and Topological Defects in Graphene Membranes

Jannik C. Meyer et al.

NANO LETTERS (2008)

Article Chemistry, Multidisciplinary

One- and two-dimensional diffusion of metal atoms in graphene

Yanjie Gan et al.

Article Materials Science, Multidisciplinary

Investigation of metal/carbon-related materials for fuel cell applications by electronic structure calculations

Ki-jeong Kong et al.

MATERIALS SCIENCE & ENGINEERING C-BIOMIMETIC AND SUPRAMOLECULAR SYSTEMS (2006)

Article Chemistry, Physical

Bending the rules: Contrasting vacancy energetics and migration in graphite and carbon nanotubes

AV Krasheninnikov et al.

CHEMICAL PHYSICS LETTERS (2006)

Article Materials Science, Multidisciplinary

B and N ion implantation into carbon nanotubes: Insight from atomistic simulations

J Kotakoski et al.

PHYSICAL REVIEW B (2005)

Article Multidisciplinary Sciences

Direct evidence for atomic defects in graphene layers

A Hashimoto et al.

NATURE (2004)

Article Physics, Multidisciplinary

Magnetic properties of vacancies in graphene and single-walled carbon nanotubes

YC Ma et al.

NEW JOURNAL OF PHYSICS (2004)

Article Materials Science, Multidisciplinary

Structure and energetics of the vacancy in graphite

AA El-Barbary et al.

PHYSICAL REVIEW B (2003)

Article Chemistry, Physical

Wigner defects bridge the graphite gap

RH Telling et al.

NATURE MATERIALS (2003)

Article Chemistry, Physical

A climbing image nudged elastic band method for finding saddle points and minimum energy paths

G Henkelman et al.

JOURNAL OF CHEMICAL PHYSICS (2000)