Structure and dynamics of water at water–graphene and water–hexagonal boron-nitride sheet interfaces revealed by ab initio sum-frequency generation spectroscopy

Definition of Free O–H Groups of Water at the Air–Water Interface

(2017) Fujie Tang et al.   Journal of Chemical Theory and Computation

Chemisorbed and Physisorbed Water at the TiO2/Water Interface

(2017) Saman Hosseinpour et al.   Journal of Physical Chemistry Letters

The interfacial structure of water droplets in a hydrophobic liquid

(2017) Nikolay Smolentsev et al.   Nature Communications

Phase reference in phase-sensitive sum-frequency vibrational spectroscopy

(2016) Shumei Sun et al.   JOURNAL OF CHEMICAL PHYSICS

How Osmolyte and Denaturant Affect Water at the Air–Water Interface and in Bulk: A Heterodyne-Detected Vibrational Sum Frequency Generation (HD-VSFG) and Hydration Shell Spectroscopic Study

(2016) Mohammed Ahmed et al.   Journal of Physical Chemistry C

Both Inter- and Intramolecular Coupling of O–H Groups Determine the Vibrational Response of the Water/Air Interface

(2016) Jan Schaefer et al.   Journal of Physical Chemistry Letters

Orientational Dynamics of Water at an Extended Hydrophobic Interface

(2016) Shunhao Xiao et al.   JOURNAL OF THE AMERICAN CHEMICAL SOCIETY

On the Mechanism of Hydrophilicity of Graphene

(2016) Guo Hong et al.   NANO LETTERS

Doping-Induced Tunable Wettability and Adhesion of Graphene

(2016) Ali Ashraf et al.   NANO LETTERS

Molecular Structure and Dynamics of Water at the Water-Air Interface Studied with Surface-Specific Vibrational Spectroscopy

(2015) Mischa Bonn et al.   ANGEWANDTE CHEMIE-INTERNATIONAL EDITION

Development of single-channel heterodyne-detected sum frequency generation spectroscopy and its application to the water/vapor interface

(2015) Shoichi Yamaguchi   JOURNAL OF CHEMICAL PHYSICS

Accurate determination of complex χ(2) spectrum of the air/water interface

(2015) Aniruddha Adhikari   JOURNAL OF CHEMICAL PHYSICS

Toward ab initio molecular dynamics modeling for sum-frequency generation spectra; an efficient algorithm based on surface-specific velocity-velocity correlation function

(2015) Tatsuhiko Ohto et al.   JOURNAL OF CHEMICAL PHYSICS

Lipid Carbonyl Groups Terminate the Hydrogen Bond Network of Membrane-Bound Water

(2015) Tatsuhiko Ohto et al.   Journal of Physical Chemistry Letters

Water desalination using nanoporous single-layer graphene

(2015) Sumedh P. Surwade et al.   Nature Nanotechnology

Enhanced ordering of water at hydrophobic surfaces

(2014) Simona Strazdaite et al.   JOURNAL OF CHEMICAL PHYSICS

Friction of Water on Graphene and Hexagonal Boron Nitride from Ab Initio Methods: Very Different Slippage Despite Very Similar Interface Structures

(2014) Gabriele Tocci et al.   NANO LETTERS

Imaging atomic-level random walk of a point defect in graphene

(2014) Jani Kotakoski et al.   Nature Communications

Ab initio and classical molecular dynamics studies of the structural and dynamical behavior of water near a hydrophobic graphene sheet

(2013) Malay Kumar Rana et al.   JOURNAL OF CHEMICAL PHYSICS

What Is the Contact Angle of Water on Graphene?

(2013) Fereshte Taherian et al.   LANGMUIR

Mechanism of vibrational energy dissipation of free OH groups at the air-water interface

(2013) C.-S. Hsieh et al.   PROCEEDINGS OF THE NATIONAL ACADEMY OF SCIENCES OF THE UNITED STATES OF AMERICA

Reversible Dewetting of a Molecularly Thin Fluid Water Film in a Soft Graphene–Mica Slit Pore

(2012) Nikolai Severin et al.   NANO LETTERS

Wetting transparency of graphene

(2012) Javad Rafiee et al.   NATURE MATERIALS

Water structure and charge transfer phenomena at the liquid–graphene interface

(2012) Luisa D'Urso et al.   PHYSICAL CHEMISTRY CHEMICAL PHYSICS

Hydrogen bonding at the water surface revealed by isotopic dilution spectroscopy

(2011) Igor V. Stiopkin et al.   NATURE

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

Wettability and Surface Free Energy of Graphene Films

(2009) Shiren Wang et al.   LANGMUIR

Intrinsic and extrinsic corrugation of monolayer graphene deposited onSiO2

(2009) V. Geringer et al.   PHYSICAL REVIEW LETTERS

Integration or Segregation: How Do Molecules Behave at Oil/Water Interfaces?

(2008) F. G. Moore et al.   ACCOUNTS OF CHEMICAL RESEARCH

Transparent, Conductive, and Superhydrophobic Films from Stabilized Carbon Nanotube/Silane Sol Mixture Solution

(2008) Joong Tark Han et al.   ADVANCED MATERIALS

IR and Raman spectra of liquid water: Theory and interpretation

(2008) B. M. Auer et al.   JOURNAL OF CHEMICAL PHYSICS

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

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

Structure of water adsorbed on a single graphene sheet

(2008) M. C. Gordillo et al.   PHYSICAL REVIEW B

Measurement of the Elastic Properties and Intrinsic Strength of Monolayer Graphene

(2008) C. Lee et al.   SCIENCE