Global and local reactivity indexes applied to understand the chemistry of graphene oxide and doped graphene
出版年份 2012 全文链接
标题
Global and local reactivity indexes applied to understand the chemistry of graphene oxide and doped graphene
作者
关键词
Conceptual DFT, Doped graphene, Functionalized graphene, Graphene, Graphene oxide
出版物
JOURNAL OF MOLECULAR MODELING
Volume 19, Issue 2, Pages 919-930
出版商
Springer Nature
发表日期
2012-10-20
DOI
10.1007/s00894-012-1642-6
参考文献
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。- Electrochemical sensor based on nitrogen doped graphene: Simultaneous determination of ascorbic acid, dopamine and uric acid
- (2012) Zhen-Huan Sheng et al. BIOSENSORS & BIOELECTRONICS
- Nitrogen-doped graphene nanosheets as cathode materials with excellent electrocatalytic activity for high capacity lithium-oxygen batteries
- (2012) Yongliang Li et al. ELECTROCHEMISTRY COMMUNICATIONS
- Reduced graphene oxide/nickel nanocomposites: facile synthesis, magnetic and catalytic properties
- (2012) Zhenyuan Ji et al. JOURNAL OF MATERIALS CHEMISTRY
- Effect of Microstructure of Nitrogen-Doped Graphene on Oxygen Reduction Activity in Fuel Cells
- (2012) Lipeng Zhang et al. LANGMUIR
- Thermal conductivity of isotopically modified graphene
- (2012) Shanshan Chen et al. NATURE MATERIALS
- Doped Graphene Sheets As Anode Materials with Superhigh Rate and Large Capacity for Lithium Ion Batteries
- (2011) Zhong-Shuai Wu et al. ACS Nano
- Electrochemical bisphenol A sensor based on N-doped graphene sheets
- (2011) Haixia Fan et al. ANALYTICA CHIMICA ACTA
- Density functional theory prediction for diffusion of lithium on boron-doped graphene surface
- (2011) Shuanghong Gao et al. APPLIED SURFACE SCIENCE
- Nitrogen doping effects on the structure of graphene
- (2011) Dongsheng Geng et al. APPLIED SURFACE SCIENCE
- Graphene oxide covalently functionalized with zinc phthalocyanine for broadband optical limiting
- (2011) Jinhui Zhu et al. CARBON
- Oxygen reduction reaction mechanism on nitrogen-doped graphene: A density functional theory study
- (2011) Liang Yu et al. JOURNAL OF CATALYSIS
- Adsorption of nitrogen oxides on graphene and graphene oxides: Insights from density functional calculations
- (2011) Shaobin Tang et al. JOURNAL OF CHEMICAL PHYSICS
- Fabrication of gold nanoparticle/graphene oxide nanocomposites and their excellent catalytic performance
- (2011) Nana Zhang et al. JOURNAL OF MATERIALS CHEMISTRY
- Chemical Reactivity of Lithium Doped Monolayer and Bilayer Graphene
- (2011) Pablo A. Denis Journal of Physical Chemistry C
- Ab Initio Study of Boron- and Nitrogen-Doped Graphene and Carbon Nanotubes Functionalized with Carboxyl Groups
- (2011) Nabil Al-Aqtash et al. Journal of Physical Chemistry C
- Mechanisms of Oxygen Reduction Reaction on Nitrogen-Doped Graphene for Fuel Cells
- (2011) Lipeng Zhang et al. Journal of Physical Chemistry C
- SnO2/Reduced Graphene Oxide Nanocomposite for the Simultaneous Electrochemical Detection of Cadmium(II), Lead(II), Copper(II), and Mercury(II): An Interesting Favorable Mutual Interference
- (2011) Yan Wei et al. Journal of Physical Chemistry C
- Fabrication of an electrochemical platform based on the self-assembly of graphene oxide–multiwall carbon nanotube nanocomposite and horseradish peroxidase: direct electrochemistry and electrocatalysis
- (2011) Qian Zhang et al. NANOTECHNOLOGY
- Nitrogen and boron doping effects on the electrical conductivity of graphene and nanotube
- (2011) Hamze Mousavi et al. SOLID STATE SCIENCES
- Nitrogen-Doped Graphene as Efficient Metal-Free Electrocatalyst for Oxygen Reduction in Fuel Cells
- (2010) Liangti Qu et al. ACS Nano
- Nitrogen-Doped Graphene and Its Application in Electrochemical Biosensing
- (2010) Ying Wang et al. ACS Nano
- Graphene Oxide as Catalyst: Application of Carbon Materials beyond Nanotechnology
- (2010) Jeffrey Pyun ANGEWANDTE CHEMIE-INTERNATIONAL EDITION
- A first-principles study of calcium-decorated, boron-doped graphene for high capacity hydrogen storage
- (2010) Elham Beheshti et al. CARBON
- Enhanced electrochemical sensitivity of PtRh electrodes coated with nitrogen-doped graphene
- (2010) Da-Wei Wang et al. ELECTROCHEMISTRY COMMUNICATIONS
- Gabedit-A graphical user interface for computational chemistry softwares
- (2010) Abdul-Rahman Allouche JOURNAL OF COMPUTATIONAL CHEMISTRY
- First principles calculations of the electronic and chemical properties of graphene, graphane, and graphene oxide
- (2010) J. J. Hernández Rosas et al. JOURNAL OF MOLECULAR MODELING
- Reduced Graphene Oxide/Copper Phthalocyanine Composite and Its Optoelectrical Properties
- (2010) Anindarupa Chunder et al. Journal of Physical Chemistry C
- Anomalously Large Reactivity of Single Graphene Layers and Edges toward Electron Transfer Chemistries
- (2010) Richa Sharma et al. NANO LETTERS
- Adsorption of molecular oxygen on doped graphene: Atomic, electronic, and magnetic properties
- (2010) Jiayu Dai et al. PHYSICAL REVIEW B
- Doping graphene by adsorption of polar molecules at the oxidized zigzag edges
- (2010) Julia Berashevich et al. PHYSICAL REVIEW B
- Ab initio study of the binding of collagen amino acids to graphene and A-doped (A=H, Ca) graphene
- (2010) Claudio Cazorla THIN SOLID FILMS
- Gas adsorption on graphene doped with B, N, Al, and S: A theoretical study
- (2009) Jiayu Dai et al. APPLIED PHYSICS LETTERS
- First-principles study on the enhancement of lithium storage capacity in boron doped graphene
- (2009) Xianlong Wang et al. APPLIED PHYSICS LETTERS
- First-principles molecular dynamics simulation of O2 reduction on nitrogen-doped carbon
- (2009) Yasuharu Okamoto APPLIED SURFACE SCIENCE
- Adsorption of hydrogen on boron-doped graphene: A first-principles prediction
- (2009) Y. G. Zhou et al. JOURNAL OF APPLIED PHYSICS
- Chemical Reactivity Indices as a Tool for Understanding the Support-Effect in Supported Metal Oxide Catalysts
- (2009) Tim Fievez et al. Journal of Physical Chemistry C
- Active Sites in Graphene and the Mechanism of CO2Formation in Carbon Oxidation
- (2009) Ljubisa R. Radovic JOURNAL OF THE AMERICAN CHEMICAL SOCIETY
- Improving gas sensing properties of graphene by introducing dopants and defects: a first-principles study
- (2009) Yong-Hui Zhang et al. NANOTECHNOLOGY
- Nitrogen-Doped Carbon Nanotube Arrays with High Electrocatalytic Activity for Oxygen Reduction
- (2009) K. Gong et al. SCIENCE
- A Special Issue on Nanoscale Heat Transfer
- (2008) Gang Chen et al. Journal of Computational and Theoretical Nanoscience
- Characterizing the Interaction of Pt and PtRu Clusters with Boron-Doped, Nitrogen-Doped, and Activated Carbon: Density Functional Theory Calculations and Parameterization
- (2008) Chethan K. Acharya et al. Journal of Physical Chemistry C
- Langmuir−Blodgett Assembly of Graphite Oxide Single Layers
- (2008) Laura J. Cote et al. JOURNAL OF THE AMERICAN CHEMICAL SOCIETY
- Synthesis and Solid-State NMR Structural Characterization of 13C-Labeled Graphite Oxide
- (2008) W. Cai et al. SCIENCE
- Measurement of the Elastic Properties and Intrinsic Strength of Monolayer Graphene
- (2008) C. Lee et al. SCIENCE
- Ultrahigh electron mobility in suspended graphene
- (2008) K.I. Bolotin et al. SOLID STATE COMMUNICATIONS
- Scanning probe microscopy study of exfoliated oxidized graphene sheets
- (2008) D. Pandey et al. SURFACE SCIENCE
Find Funding. Review Successful Grants.
Explore over 25,000 new funding opportunities and over 6,000,000 successful grants.
ExploreAsk a Question. Answer a Question.
Quickly pose questions to the entire community. Debate answers and get clarity on the most important issues facing researchers.
Get Started