A molecular perspective of water at metal interfaces

Dispersive interactions in water bilayers at metallic surfaces: A comparison of the PBE and RPBE functional including semiempirical dispersion corrections

(2012) Katrin Tonigold et al.   JOURNAL OF COMPUTATIONAL CHEMISTRY

Strain relief and disorder in commensurate water layers formed on Pd(111)

(2012) F McBride et al.   JOURNAL OF PHYSICS-CONDENSED MATTER

Water clusters on Cu(110): Chain versus cyclic structures

(2011) T. Kumagai et al.   JOURNAL OF CHEMICAL PHYSICS

The Energy of Hydroxyl Coadsorbed with Water on Pt(111)

(2011) Wanda Lew et al.   Journal of Physical Chemistry C

Hydrogen-bond imaging and engineering with a scanning tunnelling microscope

(2011) Hiroshi Okuyama et al.   JOURNAL OF PHYSICS D-APPLIED PHYSICS

Ab initiorandom structure searching

(2011) Chris J Pickard et al.   JOURNAL OF PHYSICS-CONDENSED MATTER

H-atom relay reactions in real space

(2011) T. Kumagai et al.   NATURE MATERIALS

Role of water in atomic resolution AFM in solutions

(2011) Matthew Watkins et al.   PHYSICAL CHEMISTRY CHEMICAL PHYSICS

Initial stages of salt crystal dissolution determined with ab initio molecular dynamics

(2011) Li-Min Liu et al.   PHYSICAL CHEMISTRY CHEMICAL PHYSICS

Reversible redox reaction and water configuration on a positively charged platinum surface: first principles molecular dynamics simulation

(2011) Tamio Ikeshoji et al.   PHYSICAL CHEMISTRY CHEMICAL PHYSICS

Adsorption and diffusion of water on graphene from first principles

(2011) Jie Ma et al.   PHYSICAL REVIEW B

To Wet or Not to Wet? Dispersion Forces Tip the Balance for Water Ice on Metals

(2011) Javier Carrasco et al.   PHYSICAL REVIEW LETTERS

Tailoring the Structure of Water at a Metal Surface: A Structural Analysis of the Water Bilayer Formed on an Alloy Template

(2011) Fiona McBride et al.   PHYSICAL REVIEW LETTERS

c(2×2)Water-Hydroxyl Layer on Cu(110): A Wetting Layer Stabilized by Bjerrum Defects

(2011) Matthew Forster et al.   PHYSICAL REVIEW LETTERS

Key to control and advance myriad technologies

(2011) J. T. Yates et al.   PROCEEDINGS OF THE NATIONAL ACADEMY OF SCIENCES OF THE UNITED STATES OF AMERICA

Quantum nature of the hydrogen bond

(2011) X.-Z. Li et al.   PROCEEDINGS OF THE NATIONAL ACADEMY OF SCIENCES OF THE UNITED STATES OF AMERICA

Water-hydroxyl phases on an open metal surface: breaking the ice rules

(2011) Matthew Forster et al.   Chemical Science

The role of substrate electrons in the wetting of a metal surface

(2010) T. Schiros et al.   JOURNAL OF CHEMICAL PHYSICS

Interpretation of high-resolution images of the best-bound wetting layers on Pt(111)

(2010) Peter J. Feibelman et al.   JOURNAL OF CHEMICAL PHYSICS

Cooperativity in Surface Bonding and Hydrogen Bonding of Water and Hydroxyl at Metal Surfaces

(2010) T. Schiros et al.   Journal of Physical Chemistry C

Surface energy and surface proton order of the ice Ih basal and prism surfaces

(2010) Ding Pan et al.   JOURNAL OF PHYSICS-CONDENSED MATTER

Direct mapping of the solid–liquid adhesion energy with subnanometre resolution

(2010) Kislon Voïtchovsky et al.   Nature Nanotechnology

Molecular structure of theH2Owetting layer on Pt(111)

(2010) Sebastian Standop et al.   PHYSICAL REVIEW B

Interaction of water with a metal surface: Importance of van der Waals forces

(2010) Ikutaro Hamada et al.   PHYSICAL REVIEW B

Structure and dynamics of liquid water on rutileTiO2(110)

(2010) Li-Min Liu et al.   PHYSICAL REVIEW B

Quantum Nature of the Proton in Water-Hydroxyl Overlayers on Metal Surfaces

(2010) Xin-Zheng Li et al.   PHYSICAL REVIEW LETTERS

Pentagons and Heptagons in the First Water Layer on Pt(111)

(2010) S. Nie et al.   PHYSICAL REVIEW LETTERS

The first wetting layer on a solid

(2010) Peter J. Feibelman   PHYSICS TODAY

Water distribution at solid/liquid interfaces visualized by frequency modulation atomic force microscopy

(2010) Takeshi Fukuma   SCIENCE AND TECHNOLOGY OF ADVANCED MATERIALS

Insight from first principles into the nature of the bonding between water molecules and 4d metal surfaces

(2009) Javier Carrasco et al.   JOURNAL OF CHEMICAL PHYSICS

Chemical bonding of water to metal surfaces studied with core-level spectroscopies

(2009) T. Schiros et al.   JOURNAL OF ELECTRON SPECTROSCOPY AND RELATED PHENOMENA

Metal- and Hydrogen-Bonding Competition during Water Adsorption on Pd(111) and Ru(0001)

(2009) Mous Tatarkhanov et al.   JOURNAL OF THE AMERICAN CHEMICAL SOCIETY

A one-dimensional ice structure built from pentagons

(2009) Javier Carrasco et al.   NATURE MATERIALS

Properties of metal–water interfaces studied from first principles

(2009) Sebastian Schnur et al.   NEW JOURNAL OF PHYSICS

Tunneling dynamics of a hydroxyl group adsorbed on Cu(110)

(2009) T. Kumagai et al.   PHYSICAL REVIEW B

Local Investigation of Femtosecond Laser Induced Dynamics of Water Nanoclusters on Cu(111)

(2009) Michael Mehlhorn et al.   PHYSICAL REVIEW LETTERS

Water adsorption and the wetting of metal surfaces

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

Concluding remarks

(2008) Peter J. Feibelman   FARADAY DISCUSSIONS

Order and disorder in the wetting layer on Ru(0001)

(2008) Mark Gallagher et al.   FARADAY DISCUSSIONS

Water growth on metals and oxides: binding, dissociation and role of hydroxyl groups

(2008) M. Salmeron et al.   FARADAY DISCUSSIONS

The structure of mixed H2O–OH monolayer films on Ru(0001)

(2008) M. Tatarkhanov et al.   JOURNAL OF CHEMICAL PHYSICS

On the accuracy of density-functional theory exchange-correlation functionals for H bonds in small water clusters. II. The water hexamer and van der Waals interactions

(2008) Biswajit Santra et al.   JOURNAL OF CHEMICAL PHYSICS

Wetting of mixed OH∕H2O layers on Pt(111)

(2008) Georgina Zimbitas et al.   JOURNAL OF CHEMICAL PHYSICS

Hydroxyl Chain Formation on the Cu(110) Surface: Watching Water Dissociation

(2008) Junseok Lee et al.   Journal of Physical Chemistry C

In situ x-ray photoelectron spectroscopy studies of water on metals and oxides at ambient conditions

(2008) S Yamamoto et al.   JOURNAL OF PHYSICS-CONDENSED MATTER

Water Confined in Nanotubes and between Graphene Sheets:  A First Principle Study

(2008) Giancarlo Cicero et al.   JOURNAL OF THE AMERICAN CHEMICAL SOCIETY

Density Oscillations in a Nanoscale Water Film on Salt: Insight from Ab Initio Molecular Dynamics

(2008) Limin Liu et al.   JOURNAL OF THE AMERICAN CHEMICAL SOCIETY

Probing Properties of Water under Confinement: Infrared Spectra

(2008) Manu Sharma et al.   NANO LETTERS

Growth of multilayer ice films and the formation of cubic ice imaged with STM

(2008) Konrad Thürmer et al.   PHYSICAL REVIEW B

Direct Observation of Hydrogen-Bond Exchange within a Single Water Dimer

(2008) T. Kumagai et al.   PHYSICAL REVIEW LETTERS

Nucleation-Limited Dewetting of Ice Films on Pt(111)

(2008) Konrad Thürmer et al.   PHYSICAL REVIEW LETTERS

Surface Energy and Surface Proton Order of IceIh

(2008) Ding Pan et al.   PHYSICAL REVIEW LETTERS

Manipulation and Control of Hydrogen Bond Dynamics in Absorbed Ice Nanoclusters

(2008) Heiko Gawronski et al.   PHYSICAL REVIEW LETTERS

Proton order in the ice crystal surface

(2008) V. Buch et al.   PROCEEDINGS OF THE NATIONAL ACADEMY OF SCIENCES OF THE UNITED STATES OF AMERICA

Vibrational study of water dimers on Pt(111) using a scanning tunneling microscope

(2008) K. Motobayashi et al.   SURFACE SCIENCE