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Spectroscopic studies of clusters of atmospheric relevance
NC Frederiks, A Hariharan… - Annual Review of …, 2023 - annualreviews.org
Atmospheric aerosols exert a significant but highly uncertain effect on the global climate,
and roughly half of these particles originate as small clusters formed by collisions between …
and roughly half of these particles originate as small clusters formed by collisions between …
Demystifying the diffuse vibrational spectrum of aqueous protons through cold cluster spectroscopy
The ease with which the pH is routinely determined for aqueous solutions masks the fact that
the cationic product of Arrhenius acid dissolution, the hydrated proton, or H+ (aq), is a …
the cationic product of Arrhenius acid dissolution, the hydrated proton, or H+ (aq), is a …
Snapshots of proton accommodation at a microscopic water surface: Understanding the vibrational spectral signatures of the charge defect in cryogenically cooled H+ …
We review the role that gas-phase, size-selected protonated water clusters, H+ (H2O) n,
have played in unraveling the microscopic mechanics responsible for the spectroscopic …
have played in unraveling the microscopic mechanics responsible for the spectroscopic …
Site-specific vibrational spectral signatures of water molecules in the magic H3O+(H2O)20 and Cs+(H2O)20 clusters
Theoretical models of proton hydration with tens of water molecules indicate that the excess
proton is embedded on the surface of clathrate-like cage structures with one or two water …
proton is embedded on the surface of clathrate-like cage structures with one or two water …
Hidden role of intermolecular proton transfer in the anomalously diffuse vibrational spectrum of a trapped hydronium ion
SM Craig, FS Menges, CH Duong, JK Denton… - Proceedings of the …, 2017 - pnas.org
We report the vibrational spectra of the hydronium and methyl-ammonium ions captured in
the C3 v binding pocket of the 18-crown-6 ether ionophore. Although the NH stretching …
the C3 v binding pocket of the 18-crown-6 ether ionophore. Although the NH stretching …
Capturing intrinsic site-dependent spectral signatures and lifetimes of isolated OH oscillators in extended water networks
The extremely broad infrared spectrum of water in the OH stretching region is a
manifestation of how profoundly a water molecule is distorted when embedded in its …
manifestation of how profoundly a water molecule is distorted when embedded in its …
Two-Dimensional infrared spectroscopy of isolated molecular ions
Two-dimensional infrared (2D IR) spectroscopy of mass-selected, cryogenically cooled
molecular ions is presented. Nonlinear response pathways, encoded in the time-domain …
molecular ions is presented. Nonlinear response pathways, encoded in the time-domain …
Stability and structure of potentially atmospherically relevant glycine ammonium bisulfate clusters
A Hariharan, CJ Bready, JG Ajello… - The Journal of …, 2024 - ACS Publications
New particle formation (NPF) is the process by which trace atmospheric acids and bases
cluster and grow into particles that ultimately impact climate. Sulfuric acid concentration …
cluster and grow into particles that ultimately impact climate. Sulfuric acid concentration …
Origins of the diffuse shared proton vibrational signatures in proton-coupled electron transfer model dyad complexes
Phenol-benzimidazole and phenol-pyridine dyad complexes have served as popular model
systems for the study of proton-coupled electron transfer (PCET) kinetics in solution-phase …
systems for the study of proton-coupled electron transfer (PCET) kinetics in solution-phase …
The competition between hydrogen, halogen, and covalent bonding in atmospherically relevant ammonium iodate clusters
NC Frederiks, DD Heaney, JJ Kreinbihl… - Journal of the …, 2023 - ACS Publications
Iodine-containing clusters are expected to be central to new particle formation (NPF) events
in polar and midlatitude coastal regions. Iodine oxoacids and iodine oxides are observed in …
in polar and midlatitude coastal regions. Iodine oxoacids and iodine oxides are observed in …