Influence of water on the electronic structure of metal-supported graphene: Insights from van der Waals density functional theory

On the physisorption of water on graphene: a CCSD(T) study

(2011) Elena Voloshina et al.   PHYSICAL CHEMISTRY CHEMICAL PHYSICS

Adsorption and diffusion of water on graphene from first principles

(2011) Jie Ma et al.   PHYSICAL REVIEW B

Van der Waals density functionals applied to solids

(2011) Jiří Klimeš et al.   PHYSICAL REVIEW B

Nonlocal Screening of Plasmons in Graphene by Semiconducting and Metallic Substrates: First-Principles Calculations

(2011) Jun Yan et al.   PHYSICAL REVIEW LETTERS

Graphene on ferromagnetic surfaces and its functionalization with water and ammonia

(2011) Stefan Böttcher et al.   Nanoscale Research Letters

Nucleation and growth of nickel nanoclusters on graphene Moiré on Rh(111)

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

Orientation-dependent work function of graphene on Pd(111)

(2010) Y. Murata et al.   APPLIED PHYSICS LETTERS

First-principles study of metal–graphene interfaces

(2010) Cheng Gong et al.   JOURNAL OF APPLIED PHYSICS

A consistent and accurate ab initio parametrization of density functional dispersion correction (DFT-D) for the 94 elements H-Pu

(2010) Stefan Grimme et al.   JOURNAL OF CHEMICAL PHYSICS

Interface structure and mechanics between graphene and metal substrates: a first-principles study

(2010) Zhiping Xu et al.   JOURNAL OF PHYSICS-CONDENSED MATTER

Electronic and magnetic properties of the graphene–ferromagnet interface

(2010) Yu S Dedkov et al.   NEW JOURNAL OF PHYSICS

Benchmark calculations of water–acene interaction energies: Extrapolation to the water–graphene limit and assessment of dispersion–corrected DFT methods

(2010) Glen R. Jenness et al.   PHYSICAL CHEMISTRY CHEMICAL PHYSICS

Metal adatoms on graphene and hexagonal boron nitride: Towards rational design of self-assembly templates

(2010) Oleg V. Yazyev et al.   PHYSICAL REVIEW B

Comparative van der Waals density-functional study of graphene on metal surfaces

(2010) Ikutaro Hamada et al.   PHYSICAL REVIEW B

Tunable Bandgap in Graphene by the Controlled Adsorption of Water Molecules

(2010) Fazel Yavari et al.   Small

Highly Ordered, Millimeter-Scale, Continuous, Single-Crystalline Graphene Monolayer Formed on Ru (0001)

(2009) Yi Pan et al.   ADVANCED MATERIALS

First-principles investigation on bonding formation and electronic structure of metal-graphene contacts

(2009) Qiushi Ran et al.   APPLIED PHYSICS LETTERS

Nano-ice on Boron Nitride Nanomesh: Accessing Proton Disorder

(2009) Haifeng Ma et al.   CHEMPHYSCHEM

Structure and Stability of the Water−Graphite Complexes

(2009) Miroslav Rubeš et al.   Journal of Physical Chemistry C

Chemical accuracy for the van der Waals density functional

(2009) Jiří Klimeš et al.   JOURNAL OF PHYSICS-CONDENSED MATTER

Growth of Semiconducting Graphene on Palladium

(2009) Soon-Yong Kwon et al.   NANO LETTERS

Water on graphene: Hydrophobicity and dipole moment using density functional theory

(2009) O. Leenaerts et al.   PHYSICAL REVIEW B

Calculation of the lattice constant of solids with semilocal functionals

(2009) Philipp Haas et al.   PHYSICAL REVIEW B

First-principles study of the interaction and charge transfer between graphene and metals

(2009) P. A. Khomyakov et al.   PHYSICAL REVIEW B

Comparison of electronic structure and template function of single-layer graphene and a hexagonal boron nitride nanomesh on Ru(0001)

(2009) Thomas Brugger et al.   PHYSICAL REVIEW B

Efficient Implementation of a van der Waals Density Functional: Application to Double-Wall Carbon Nanotubes

(2009) Guillermo Román-Pérez et al.   PHYSICAL REVIEW LETTERS

Formation of quasi-free graphene on the Ni(111) surface with intercalated Cu, Ag, and Au layers

(2009) A. M. Shikin et al.   PHYSICS OF THE SOLID STATE

Graphene on metal surfaces

(2009) J. Wintterlin et al.   SURFACE SCIENCE

Water adsorption and the wetting of metal surfaces

(2009) A. Hodgson et al.   SURFACE SCIENCE REPORTS

First-principles studies of water adsorption on graphene: The role of the substrate

(2008) Tim O. Wehling et al.   APPLIED PHYSICS LETTERS

The environment of graphene probed by electrostatic force microscopy

(2008) J. Moser et al.   APPLIED PHYSICS LETTERS

Bridge structure for the graphene/Ni(111) system: A first principles study

(2008) Miguel Fuentes-Cabrera et al.   PHYSICAL REVIEW B

Doping Graphene with Metal Contacts

(2008) G. Giovannetti et al.   PHYSICAL REVIEW LETTERS