Odd-electron molecular theory of graphene hydrogenation

Structure-sensitive mechanism of nanographene failure

(2011) E. F. Sheka et al.   JOURNAL OF EXPERIMENTAL AND THEORETICAL PHYSICS

C60-based composites in view of topochemical reactions

(2011) E. F. Sheka et al.   JOURNAL OF MATERIALS CHEMISTRY

Mechanochemical Reaction in Graphane under Uniaxial Tension

(2011) N. A. Popova et al.   Journal of Physical Chemistry C

Spin waves in zigzag graphene nanoribbons and the stability of edge ferromagnetism

(2011) F J Culchac et al.   NEW JOURNAL OF PHYSICS

Third conformer of graphane: A first-principles density functional theory study

(2011) A. Bhattacharya et al.   PHYSICAL REVIEW B

Perspectives on the 2010 Nobel Prize in Physics for Graphene

(2010) Mildred S. Dresselhaus et al.   ACS Nano

Functionalization of Graphene via 1,3-Dipolar Cycloaddition

(2010) Mildred Quintana et al.   ACS Nano

Vacancy Clusters in Graphane as Quantum Dots

(2010) Abhishek K. Singh et al.   ACS Nano

Properties of graphene: a theoretical perspective

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

Magnetic properties in graphene-graphane superlattices

(2010) Joo-Hyoung Lee et al.   APPLIED PHYSICS LETTERS

The response of mechanical and electronic properties of graphane to the elastic strain

(2010) M. Topsakal et al.   APPLIED PHYSICS LETTERS

Structural and electronic properties of H-passivated graphene

(2010) A.Z. AlZahrani et al.   APPLIED SURFACE SCIENCE

The ultimate diamond slab: GraphAne versus graphEne

(2010) Enrique Muñoz et al.   DIAMOND AND RELATED MATERIALS

Graphene-Carbon Nanotube Composites

(2010) E. F. Sheka et al.   Journal of Computational and Theoretical Nanoscience

Broken spin symmetry approach to chemical reactivity and magnetism of graphenium species

(2010) E. F. Sheka et al.   JOURNAL OF EXPERIMENTAL AND THEORETICAL PHYSICS

Stepwise computational synthesis of fullerene C60 derivatives. Fluorinated fullerenes C60F2k

(2010) E. F. Sheka   JOURNAL OF EXPERIMENTAL AND THEORETICAL PHYSICS

The chemistry of graphene

(2010) Kian Ping Loh et al.   JOURNAL OF MATERIALS CHEMISTRY

Computational synthesis of hydrogenated fullerenes from C60 to C60H60

(2010) Elena F. Sheka   JOURNAL OF MOLECULAR MODELING

A tricotage-like failure of nanographene

(2010) Elena F. Sheka et al.   JOURNAL OF MOLECULAR MODELING

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

Bandgap opening in graphene induced by patterned hydrogen adsorption

(2010) Richard Balog et al.   NATURE MATERIALS

Giant Faraday rotation in single- and multilayer graphene

(2010) Iris Crassee et al.   Nature Physics

Tunable edge magnetism at graphene/graphane interfaces

(2010) Manuel J. Schmidt et al.   PHYSICAL REVIEW B

Electronic and magnetic properties of graphane nanoribbons

(2010) H. Şahin et al.   PHYSICAL REVIEW B

Reversible fluorination of graphene: Evidence of a two-dimensional wide bandgap semiconductor

(2010) S.-H. Cheng et al.   PHYSICAL REVIEW B

First-principles investigation of graphene fluoride and graphane

(2010) O. Leenaerts et al.   PHYSICAL REVIEW B

First-Principles Prediction of Doped Graphane as a High-Temperature Electron-Phonon Superconductor

(2010) G. Savini et al.   PHYSICAL REVIEW LETTERS

Strong Charge-Transfer Excitonic Effects and the Bose-Einstein Exciton Condensate in Graphane

(2010) Pierluigi Cudazzo et al.   PHYSICAL REVIEW LETTERS

Graphene Fluoride: A Stable Stoichiometric Graphene Derivative and its Chemical Conversion to Graphene

(2010) Radek Zbořil et al.   Small

Fluorographene: A Two-Dimensional Counterpart of Teflon

(2010) Rahul R. Nair et al.   Small

Thermal desorption of hydrogen from graphane

(2010) L. A. Openov et al.   TECHNICAL PHYSICS LETTERS

A study of the relationships between unpaired electron density, spin-density and cumulant matrices

(2010) Luis Lain et al.   THEORETICAL CHEMISTRY ACCOUNTS

A molecular dynamics study of the mechanical properties of hydrogen functionalized graphene

(2009) Q.X. Pei et al.   CARBON

Spontaneous regeneration of an atomically sharp graphene/graphane interface under thermal disordering

(2009) L. A. Openov et al.   JETP LETTERS

Understanding adsorption of hydrogen atoms on graphene

(2009) Simone Casolo et al.   JOURNAL OF CHEMICAL PHYSICS

Ferromagnetism in Semihydrogenated Graphene Sheet

(2009) J. Zhou et al.   NANO LETTERS

Graphene to graphane: a theoretical study

(2009) M Z S Flores et al.   NANOTECHNOLOGY

Control of Graphene's Properties by Reversible Hydrogenation: Evidence for Graphane

(2009) D. C. Elias et al.   SCIENCE

Molecular Dynamics Simulation of the Chemical Interaction between Hydrogen Atom and Graphene

(2008) Atsushi Ito et al.   JOURNAL OF THE PHYSICAL SOCIETY OF JAPAN

Imaging and dynamics of light atoms and molecules on graphene

(2008) Jannik C. Meyer et al.   NATURE