Substitutional doping of graphene: The role of carbon divacancies

Phosphorus-doped graphene and (8, 0) carbon nanotube: Structural, electronic, magnetic properties, and chemical reactivity

(2013) Hong-mei Wang et al.   APPLIED SURFACE SCIENCE

Formation, Stabilities, and Electronic and Catalytic Performance of Platinum Catalyst Supported on Non-Metal-Doped Graphene

(2013) Yanan Tang et al.   Journal of Physical Chemistry C

Formation and properties of graphane superstructures

(2013) Orestis G Ziogos et al.   JOURNAL OF PHYSICS-CONDENSED MATTER

Dynamics of Single Fe Atoms in Graphene Vacancies

(2013) Alex W. Robertson et al.   NANO LETTERS

Hydrogen adsorption capacity of adatoms on double carbon vacancies of graphene: A trend study from first principles

(2013) K. M. Fair et al.   PHYSICAL REVIEW B

Introduction of nitrogen with controllable configuration into graphene via vacancies and edges

(2013) Bin Wang et al.   Journal of Materials Chemistry A

Hydrogen uptake by graphene and nucleation of graphane

(2012) Leonidas Tsetseris et al.   JOURNAL OF MATERIALS SCIENCE

Structural evolution of single-layer films during deposition of silicon on silver: a first-principles study

(2012) D Kaltsas et al.   JOURNAL OF PHYSICS-CONDENSED MATTER

Towards new graphene materials: Doped graphene sheets and nanoribbons

(2012) Ruitao Lv et al.   MATERIALS LETTERS

Defects and doping and their role in functionalizing graphene

(2012) Sokrates T. Pantelides et al.   MRS BULLETIN

Carrier-mediated long-range ferromagnetism in electron-doped Fe-C4and Fe-N4incorporated graphene

(2012) Alex Taekyung Lee et al.   PHYSICAL REVIEW B

Molecular doping of graphene with ammonium groups

(2012) L. Tsetseris et al.   PHYSICAL REVIEW B

Direct Determination of the Chemical Bonding of Individual Impurities in Graphene

(2012) Wu Zhou et al.   PHYSICAL REVIEW LETTERS

Accurate Measurement of Electron Beam Induced Displacement Cross Sections for Single-Layer Graphene

(2012) Jannik C. Meyer et al.   PHYSICAL REVIEW LETTERS

The role of defects and doping in 2D graphene sheets and 1D nanoribbons

(2012) Humberto Terrones et al.   REPORTS ON PROGRESS IN PHYSICS

Spatial control of defect creation in graphene at the nanoscale

(2012) Alex W. Robertson et al.   Nature Communications

Doped Graphene as a Material for Oxygen Reduction Reaction in Hydrogen Fuel Cells: A Computational Study

(2012) M. Kaukonen et al.   ACS Catalysis

Sulfur-Doped Graphene as an Efficient Metal-free Cathode Catalyst for Oxygen Reduction

(2011) Zhi Yang et al.   ACS Nano

Graphene nano-ribbon formation through hydrogen-induced unzipping of carbon nanotubes

(2011) L. Tsetseris et al.   APPLIED PHYSICS LETTERS

Trapping of metal atoms in the defects on graphene

(2011) Yanan Tang et al.   JOURNAL OF CHEMICAL PHYSICS

Graphene modified LiFePO4 cathode materials for high power lithium ion batteries

(2011) Xufeng Zhou et al.   JOURNAL OF MATERIALS CHEMISTRY

Doping Monolayer Graphene with Single Atom Substitutions

(2011) Hongtao Wang et al.   NANO LETTERS

Enhanced role of Al or Ga-doped graphene on the adsorption and dissociation of N2O under electric field

(2011) Yong-an Lv et al.   PHYSICAL CHEMISTRY CHEMICAL PHYSICS

Structural, magnetic, and transport properties of substitutionally doped graphene nanoribbons from first principles

(2011) E. Cruz-Silva et al.   PHYSICAL REVIEW B

Properties of graphene: a theoretical perspective

(2010) D.S.L. Abergel et al.   ADVANCES IN PHYSICS

Band gap opening of monolayer and bilayer graphene doped with aluminium, silicon, phosphorus, and sulfur

(2010) Pablo A. Denis   CHEMICAL PHYSICS LETTERS

Ion and electron irradiation-induced effects in nanostructured materials

(2010) A. V. Krasheninnikov et al.   JOURNAL OF APPLIED PHYSICS

Modulating the electronic and magnetic structures of P-doped graphene by molecule doping

(2010) Jiayu Dai et al.   JOURNAL OF PHYSICS-CONDENSED MATTER

Electronic structure of substitutionally Mn-doped graphene

(2010) M Wu et al.   NEW JOURNAL OF PHYSICS

First-principles study of substitutional metal impurities in graphene: structural, electronic and magnetic properties

(2010) E J G Santos et al.   NEW JOURNAL OF PHYSICS

Adsorption of molecular oxygen on doped graphene: Atomic, electronic, and magnetic properties

(2010) Jiayu Dai et al.   PHYSICAL REVIEW B

Migration and Localization of Metal Atoms on Strained Graphene

(2010) Ovidiu Cretu et al.   PHYSICAL REVIEW LETTERS

First-principles studies of HF molecule adsorption on intrinsic graphene and Al-doped graphene

(2010) Yuanyuan Sun et al.   SOLID STATE COMMUNICATIONS

Gas adsorption on graphene doped with B, N, Al, and S: A theoretical study

(2009) Jiayu Dai et al.   APPLIED PHYSICS LETTERS

Al doped graphene: A promising material for hydrogen storage at room temperature

(2009) Z. M. Ao et al.   JOURNAL OF APPLIED PHYSICS

Adsorbate-Induced Defect Formation and Annihilation on Graphene and Single-Walled Carbon Nanotubes

(2009) Leonidas Tsetseris et al.   JOURNAL OF PHYSICAL CHEMISTRY B

Molecular adsorption in graphene with divacancy defects

(2009) Biplab Sanyal et al.   PHYSICAL REVIEW B

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

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

Adatom complexes and self-healing mechanisms on graphene and single-wall carbon nanotubes

(2008) L. Tsetseris et al.   CARBON

Enhancement of CO detection in Al doped graphene

(2008) Z.M. Ao et al.   CHEMICAL PHYSICS LETTERS

Switching on magnetism in Ni-doped graphene: Density functional calculations

(2008) E. J. G. Santos et al.   PHYSICAL REVIEW B