Surface processes on interstellar amorphous solid water: Adsorption, diffusion, tunneling reactions, and nuclear-spin conversion

T Hama, N Watanabe - Chemical reviews, 2013 - ACS Publications
Since we intend to review experimental and theoretical studies of physicochemical
processes occurring on cosmic dust grains in very cold regions in space, we start with a brief …

Cold physics and chemistry: Collisions, ionization and reactions inside helium nanodroplets close to zero K

A Mauracher, O Echt, AM Ellis, S Yang, DK Bohme… - Physics Reports, 2018 - Elsevier
This review provides a comprehensive overview of the applications of helium nanodroplets
in the study of ensembles of atoms and molecules, ie clusters and complexes. These …

Development of a “first principles” water potential with flexible monomers: Dimer potential energy surface, VRT spectrum, and second virial coefficient

V Babin, C Leforestier, F Paesani - Journal of chemical theory and …, 2013 - ACS Publications
The development of a “first principles” water potential with flexible monomers (MB-pol) for
molecular simulations of water systems from gas to condensed phases is described. MB-pol …

[HTML][HTML] Communication: Determination of the bond dissociation energy (D) of the water dimer,(H2O) 2, by velocity map imaging

BE Rocher-Casterline, LC Ch'ng, AK Mollner… - The Journal of …, 2011 - pubs.aip.org
The bond dissociation energy (D 0) of the water dimer is determined by using state-to-state
vibrational predissociation measurements following excitation of the bound OH stretch …

Local statistical interpretation for water structure

Q Sun - Chemical Physics Letters, 2013 - Elsevier
In this Letter, Raman spectroscopy is employed to study supercooled water down to a
temperature of 248K at ambient pressure. Based on our interpretation of the Raman OH …

Computing excited OH stretch states of water dimer in 12D using contracted intermolecular and intramolecular basis functions

XG Wang, T Carrington - The Journal of Chemical Physics, 2023 - pubs.aip.org
Due to the ubiquity and importance of water, water dimer has been intensively studied.
Computing the (ro-) vibrational spectrum of water dimer is challenging. The potential has …

Vibrational spectroscopy of the water dimer at jet-cooled and atmospheric temperatures

E Vogt, HG Kjaergaard - Annual Review of Physical Chemistry, 2022 - annualreviews.org
The vibrational spectroscopy of the water dimer provides an understanding of basic
hydrogen bonding in water clusters, and with about one water dimer for every 1,000 water …

Water vapour self-continuum and water dimers: 1. Analysis of recent work

IV Ptashnik, KP Shine, AA Vigasin - Journal of Quantitative Spectroscopy …, 2011 - Elsevier
Recent laboratory observations and advances in theoretical quantum chemistry allow a
reappraisal of the fundamental mechanisms that determine the water vapour self-continuum …

Changes of water hydrogen bond network with different externalities

L Zhao, K Ma, Z Yang - International journal of molecular sciences, 2015 - mdpi.com
It is crucial to uncover the mystery of water cluster and structural motif to have an insight into
the abundant anomalies bound to water. In this context, the analysis of influence factors is …

Vibrational Spectra of Highly Anharmonic Water Clusters: Molecular Dynamics and Harmonic Analysis Revisited with Constrained Nuclear-Electronic Orbital Methods

Y Zhang, Y Wang, X Xu, Z Chen… - Journal of Chemical …, 2023 - ACS Publications
Vibrational spectroscopy is widely used to gain insights into structural and dynamic
properties of chemical, biological, and materials systems. Thus, an efficient and accurate …