The different adsorption mechanism of methane molecule onto a boron nitride and a graphene flakes

Electronic properties of graphene nano-flakes: Energy gap, permanent dipole, termination effect, and Raman spectroscopy

(2014) Sandeep Kumar Singh et al.   JOURNAL OF CHEMICAL PHYSICS

Van der Waals heterostructures

(2013) A. K. Geim et al.   NATURE

Epitaxial growth of single-domain graphene on hexagonal boron nitride

(2013) Wei Yang et al.   NATURE MATERIALS

Computational study of ammonia adsorption on the perfect and rippled graphene sheet

(2013) Seyedeh Mozhgan Seyed-Talebi et al.   PHYSICA B-CONDENSED MATTER

Graphite and Hexagonal Boron-Nitride have the Same Interlayer Distance. Why?

(2012) Oded Hod   Journal of Chemical Theory and Computation

Lattice thermal conductivity of graphene with conventionally isotopic defects

(2012) Vadym Adamyan et al.   JOURNAL OF PHYSICS-CONDENSED MATTER

Two-dimensional phonon transport in graphene

(2012) Denis L Nika et al.   JOURNAL OF PHYSICS-CONDENSED MATTER

Strain-Engineering of Band Gaps in Piezoelectric Boron Nitride Nanoribbons

(2012) Jingshan Qi et al.   NANO LETTERS

Improved gas sensing activity in structurally defected bilayer graphene

(2012) Y Hajati et al.   NANOTECHNOLOGY

Optoelectronic properties of ABC-stacked trilayer graphene

(2012) Y. M. Xiao et al.   PHYSICA STATUS SOLIDI B-BASIC SOLID STATE PHYSICS

Induced polarization and electronic properties of carbon-doped boron nitride nanoribbons

(2012) J. Beheshtian et al.   PHYSICAL REVIEW B

Methane molecule over the defected and rippled graphene sheet

(2012) F. Shayeganfar et al.   SOLID STATE COMMUNICATIONS

Density functional theory studies of interactions of graphene with its environment: Substrate, gate dielectric and edge effects

(2012) Priyamvada Jadaun et al.   SOLID STATE COMMUNICATIONS

Dispersion Interactions with Density-Functional Theory: Benchmarking Semiempirical and Interatomic Pairwise Corrected Density Functionals

(2011) Noa Marom et al.   Journal of Chemical Theory and Computation

Friction Anisotropy-Driven Domain Imaging on Exfoliated Monolayer Graphene

(2011) J. S. Choi et al.   SCIENCE

Methane adsorption on graphene from first principles including dispersion interaction

(2011) C. Thierfelder et al.   SURFACE SCIENCE

Applications and validations of the Minnesota density functionals

(2010) Yan Zhao et al.   CHEMICAL PHYSICS LETTERS

Frictional Characteristics of Atomically Thin Sheets

(2010) C. Lee et al.   SCIENCE

The stabilities of boron nitride nanoribbons with different hydrogen-terminated edges

(2009) Yi Ding et al.   APPLIED PHYSICS LETTERS

Magnetic Properties of Fully Bare and Half-Bare Boron Nitride Nanoribbons

(2009) Lin Lai et al.   Journal of Physical Chemistry C

Friction and Dissipation in Epitaxial Graphene Films

(2009) T. Filleter et al.   PHYSICAL REVIEW LETTERS

Adsorption ofH2O,NH3, CO,NO2, and NO on graphene: A first-principles study

(2008) O. Leenaerts et al.   PHYSICAL REVIEW B

Half metallicity along the edge of zigzag boron nitride nanoribbons

(2008) Fawei Zheng et al.   PHYSICAL REVIEW B