Hydrogen bonding and molecular orientation at the liquid–vapour interface of water

Aqueous Heterogeneity at the Air/Water Interface Revealed by 2D-HD-SFG Spectroscopy

(2014) Cho-Shuen Hsieh et al.   ANGEWANDTE CHEMIE-INTERNATIONAL EDITION

The molecular structure of the interface between water and a hydrophobic substrate is liquid-vapor like

(2014) Adam P. Willard et al.   JOURNAL OF CHEMICAL PHYSICS

Nature of the Asymmetry in the Hydrogen-Bond Networks of Hexagonal Ice and Liquid Water

(2014) Thomas D. Kühne et al.   JOURNAL OF THE AMERICAN CHEMICAL SOCIETY

Structure and Dynamics of Interfacial Water Studied by Heterodyne-Detected Vibrational Sum-Frequency Generation

(2013) Satoshi Nihonyanagi et al.   Annual Review of Physical Chemistry

Electronically coarse-grained molecular dynamics using quantum Drude oscillators

(2013) A.P. Jones et al.   MOLECULAR PHYSICS

Electronically Coarse-Grained Model for Water

(2013) A. Jones et al.   PHYSICAL REVIEW LETTERS

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

Electronic signature of the instantaneous asymmetry in the first coordination shell of liquid water

(2013) Thomas D. Kühne et al.   Nature Communications

Structure and Dynamics of Liquid Water from ab Initio Molecular Dynamics—Comparison of BLYP, PBE, and revPBE Density Functionals with and without van der Waals Corrections

(2012) I-Chun Lin et al.   Journal of Chemical Theory and Computation

Surface of Liquid Water: Three-Body Interactions and Vibrational Sum-Frequency Spectroscopy

(2011) Piotr A. Pieniazek et al.   JOURNAL OF THE AMERICAN CHEMICAL SOCIETY

Instantaneous Liquid Interfaces

(2010) Adam P. Willard et al.   JOURNAL OF PHYSICAL CHEMISTRY B

New Insights into the Structure of the Vapor/Water Interface from Large-Scale First-Principles Simulations

(2010) Thomas D. Kühne et al.   Journal of Physical Chemistry Letters

Vibrational sum-frequency spectroscopy of the liquid/vapor interface for dilute HOD in D2O

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