Vibrational spectroscopy and dynamics of water

F Perakis, L De Marco, A Shalit, F Tang… - Chemical …, 2016 - ACS Publications
We present an overview of recent static and time-resolved vibrational spectroscopic studies
of liquid water from ambient conditions to the supercooled state, as well as of crystalline and …

Vibrational spectroscopy as a probe of structure and dynamics in liquid water

HJ Bakker, JL Skinner - Chemical reviews, 2010 - ACS Publications
Water is, of course, a fascinating and important substance. For such a simple molecule, its
condensed phase properties are surprisingly complex. Here we might mention the many …

Aqueous basic solutions: hydroxide solvation, structural diffusion, and comparison to the hydrated proton

D Marx, A Chandra, ME Tuckerman - Chemical reviews, 2010 - ACS Publications
Many hydrogen-bonded liquids, molecular solids, and lowdimensional systems support
anomalous diffusion mechanisms of topological charge defects created by the addition or …

Hydrogen bonds in liquid water are broken only fleetingly

JD Eaves, JJ Loparo, CJ Fecko… - Proceedings of the …, 2005 - National Acad Sciences
Although it is widely accepted that the local structure of liquid water has tetrahedral
arrangements of molecules ordered by hydrogen bonds, the mechanism by which water …

Infrared and Raman Line Shapes of Dilute HOD in Liquid H2O and D2O from 10 to 90 °C

SA Corcelli, JL Skinner - The Journal of Physical Chemistry A, 2005 - ACS Publications
A combined electronic structure/molecular dynamics approach was used to calculate
infrared and isotropic Raman spectra for the OH or OD stretches of dilute HOD in D2O or …

Testing the core/shell model of nanoconfined water in reverse micelles using linear and nonlinear IR spectroscopy

IR Piletic, DE Moilanen, DB Spry… - The Journal of …, 2006 - ACS Publications
A core/shell model has often been used to describe water confined to the interior of reverse
micelles. The validity of this model for water encapsulated in AOT/isooctane reverse micelles …

Analysis of water in confined geometries and at interfaces

MD Fayer, NE Levinger - Annual review of analytical chemistry, 2010 - annualreviews.org
The properties of water depend on its extended hydrogen bond network and the continual
picosecond–time scale structural evolution of the network. Water molecules in confined …

Pronounced non-Condon effects in the ultrafast infrared spectroscopy of water

JR Schmidt, SA Corcelli, JL Skinner - The Journal of chemical physics, 2005 - pubs.aip.org
In the context of vibrational spectroscopy in liquids, non-Condon effects refer to the
dependence of the vibrational transition dipole moment of a particular molecule on the …

On the orientational relaxation of HDO in liquid water

YLA Rezus, HJ Bakker - The Journal of chemical physics, 2005 - pubs.aip.org
We use femtosecond mid-infrared pump-probe spectroscopy to study the orientational
relaxation of HDO molecules dissolved in H 2 O⁠. In order to obtain a reliable anisotropy …

The properties of water: Insights from quantum simulations

F Paesani, GA Voth - The Journal of Physical Chemistry B, 2009 - ACS Publications
The properties of water play a central role in many phenomena of relevance to different
areas of science, including physics, chemistry, biology, geology, and climate research …