How water's properties are encoded in its molecular structure and energies

E Brini, CJ Fennell, M Fernandez-Serra… - Chemical …, 2017 - ACS Publications
How are water's material properties encoded within the structure of the water molecule? This
is pertinent to understanding Earth's living systems, its materials, its geochemistry and …

Vibrational spectral signature of the proton defect in the three-dimensional H+(H2O)21 cluster

JA Fournier, CJ Johnson, CT Wolke, GH Weddle… - Science, 2014 - science.org
The way in which a three-dimensional network of water molecules accommodates an
excess proton is hard to discern from the broad vibrational spectra of dilute acids. The …

[PDF][PDF] Theory vs experiment: what is the surface charge of water

M Chaplin - Water, 2009 - academia.edu
There is considerable disagreement over whether the gas/liquid surface of water is positive
due to the presence of surface-active hydrogen ions or negative due to the presence of …

Infrared photodissociation spectroscopy of H+(H 2 O) 6· M m (M= Ne, Ar, Kr, Xe, H 2, N 2, and CH 4): messenger-dependent balance between H 3 O+ and H 5 O 2+ …

K Mizuse, A Fujii - Physical Chemistry Chemical Physics, 2011 - pubs.rsc.org
Although messenger mediated spectroscopy is a widely-used technique to study gas phase
ionic species, effects of messengers themselves are not necessarily clear. In this study, we …

Infrared spectroscopic studies on hydrogen-bonded water networks in gas phase clusters

A Fujii, K Mizuse - International Reviews in Physical Chemistry, 2013 - Taylor & Francis
Size-selective infrared (IR) spectroscopy of gas phase water-containing clusters is
performed to probe microscopic natures of hydrogen-bonded water networks. Size-selective …

Structure Dynamics of the Proton in Liquid Water Probed<? format?> with Terahertz Time-Domain Spectroscopy

KJ Tielrooij, RLA Timmer, HJ Bakker, M Bonn - Physical review letters, 2009 - APS
We study the hydration of protons in liquid water using terahertz time-domain spectroscopy
and polarization-resolved femtosecond midinfrared pump-probe spectroscopy. We observe …

Infrared Spectra and Hydrogen‐Bonded Network Structures of Large Protonated Water Clusters H+(H2O)n (n=20–200)

K Mizuse, N Mikami, A Fujii - … Chemie International Edition, 2010 - Wiley Online Library
Because H-bonding causes unique properties of water, structures of H-bonded water
networks are of fundamental interest. For molecular-level understanding of H-bonded …

Structure-dependent dissociation of water on cobalt oxide

M Schwarz, F Faisal, S Mohr, C Hohner… - The Journal of …, 2018 - ACS Publications
Understanding the correlation between structure and reactivity of oxide surfaces is vital for
the rational design of catalytic materials. In this work, we demonstrate the exceptional …

[HTML][HTML] IRPD spectroscopy and ensemble measurements: effects of different data acquisition and analysis methods

JS Prell, JT O'Brien, ER Williams - Journal of the American Society for Mass …, 2010 - Elsevier
Three different commonly used infrared photodissociation (IRPD) spectroscopy acquisition
and analysis methods are described, and results from these methods are compared using …

Disentangling the Complex Vibrational Spectrum of the Protonated Water Trimer, H+(H2O)3, with Two-Color IR-IR Photodissociation of the Bare Ion and …

CH Duong, O Gorlova, N Yang… - The journal of …, 2017 - ACS Publications
Vibrational spectroscopy of the protonated water trimer provides a stringent constraint on the
details of the potential energy surface (PES) and vibrational dynamics governing excess …