Polar nanoregions in water: A study of the dielectric properties of TIP4P/2005, TIP4P/2005f and TTM3F

Polarizable Water Models from Mixed Computational and Empirical Optimization

(2013) Philipp Tröster et al.   JOURNAL OF PHYSICAL CHEMISTRY B

Systematic Improvement of a Classical Molecular Model of Water

(2013) Lee-Ping Wang et al.   JOURNAL OF PHYSICAL CHEMISTRY B

Strongly Anisotropic Dielectric Relaxation of Water at the Nanoscale

(2013) Cui Zhang et al.   Journal of Physical Chemistry Letters

Long-range protein-water dynamics in hyperactive insect antifreeze proteins

(2013) K. Meister et al.   PROCEEDINGS OF THE NATIONAL ACADEMY OF SCIENCES OF THE UNITED STATES OF AMERICA

Long-range orientation correlation in liquids

(2012) David P. Shelton   JOURNAL OF CHEMICAL PHYSICS

Simple Liquid Models with Corrected Dielectric Constants

(2012) Christopher J. Fennell et al.   JOURNAL OF PHYSICAL CHEMISTRY B

Site-dipole field and vortices in confined water

(2012) Allison N. Dickey et al.   PHYSICAL REVIEW E

On the accurate calculation of the dielectric constant from molecular dynamics simulations: The case of SPC/E and SWM4-DP water

(2011) Orsolya Gereben et al.   CHEMICAL PHYSICS LETTERS

Molecular dynamics simulation of the dielectric constant of water: The effect of bond flexibility

(2011) Gabriele Raabe et al.   JOURNAL OF CHEMICAL PHYSICS

A flexible model for water based on TIP4P/2005

(2011) Miguel A. González et al.   JOURNAL OF CHEMICAL PHYSICS

A Polarizable Water Model for Intramolecular and Intermolecular Vibrational Spectroscopies

(2011) Taisuke Hasegawa et al.   JOURNAL OF PHYSICAL CHEMISTRY B

A non-polarizable model of water that yields the dielectric constant and the density anomalies of the liquid: TIP4Q

(2011) José Alejandre et al.   PHYSICAL CHEMISTRY CHEMICAL PHYSICS

Simulating water with rigid non-polarizable models: a general perspective

(2011) Carlos Vega et al.   PHYSICAL CHEMISTRY CHEMICAL PHYSICS

A second generation distributed point polarizable water model

(2010) Revati Kumar et al.   JOURNAL OF CHEMICAL PHYSICS

Annealing effects on hydrogen ordering in KOD-doped ice observed using neutron diffraction

(2010) Masashi Arakawa et al.   JOURNAL OF MOLECULAR STRUCTURE

Slow dielectric response of Debye-type in water and other hydrogen bonded liquids

(2010) Helén Jansson et al.   JOURNAL OF MOLECULAR STRUCTURE

Ferroelectric Hydration Shells around Proteins: Electrostatics of the Protein−Water Interface

(2010) David N. LeBard et al.   JOURNAL OF PHYSICAL CHEMISTRY B

Ferroelectric mobile water

(2010) Yoshimichi Nakamura et al.   PHYSICAL CHEMISTRY CHEMICAL PHYSICS

Long-distance correlations in molecular orientations of liquid water and shape-dependent hydrophobic force

(2010) J. Maruthi Pradeep Kanth et al.   PHYSICAL REVIEW E

Hidden Slow Dynamics in Water

(2010) Helén Jansson et al.   PHYSICAL REVIEW LETTERS

Composition-Dependent Dielectric Properties of DMF-Water Mixtures by Molecular Dynamics Simulations

(2009) Guo-Zhu Jia et al.   INTERNATIONAL JOURNAL OF MOLECULAR SCIENCES

Development of transferable interaction potentials for water. V. Extension of the flexible, polarizable, Thole-type model potential (TTM3-F, v. 3.0) to describe the vibrational spectra of water clusters and liquid water

(2008) George S. Fanourgakis et al.   JOURNAL OF CHEMICAL PHYSICS

GROMACS 4:  Algorithms for Highly Efficient, Load-Balanced, and Scalable Molecular Simulation

(2008) Berk Hess et al.   Journal of Chemical Theory and Computation

Ferroelectric Ordering in Ice Nanotubes Confined in Carbon Nanotubes

(2008) Chuanfu Luo et al.   NANO LETTERS

Macroscopically ordered water in nanopores

(2008) J. Kofinger et al.   PROCEEDINGS OF THE NATIONAL ACADEMY OF SCIENCES OF THE UNITED STATES OF AMERICA