☆ 4.8 Article

Probing Interfacial Effects on Ionization Energies: The Surprising Banality of Anion-Water Hydrogen Bonding at the Air/Water Interface

JOURNAL OF THE AMERICAN CHEMICAL SOCIETY (2021)

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Article Chemistry, Multidisciplinary

The effects of dissolved halide anions on hydrogen bonding in liquid water

Jared D. Smith et al.

JOURNAL OF THE AMERICAN CHEMICAL SOCIETY (2007)

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Article Chemistry, Analytical

Redox free energies and one-electron energy levels in density functional theory based ab initio molecular dynamics

Joost VandeVondele et al.

JOURNAL OF ELECTROANALYTICAL CHEMISTRY (2007)

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Review Biochemistry & Molecular Biology

Ions in water: Characterizing the forces that control chemical processes and biological structure

Kim D. Collins et al.

BIOPHYSICAL CHEMISTRY (2007)

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Article Chemistry, Physical

Observation of hydronium ions at the air -: Aqueous acid interface:: Vibrational spectroscopic studies of aqueous HCI, HBr, and HI

Lori M. Levering et al.

JOURNAL OF PHYSICAL CHEMISTRY C (2007)

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Letter Chemistry, Physical

Oriented thiocyanate anions at the air-electrolyte interface and its implications on interfacial water - A vibrational sum frequency spectroscopy study

P. Viswanath et al.

JOURNAL OF PHYSICAL CHEMISTRY C (2007)

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Article Chemistry, Multidisciplinary

Spectroscopic studies of solvated hydrogen and hydroxide ions at aqueous surfaces

Teresa L. Tarbuck et al.

JOURNAL OF THE AMERICAN CHEMICAL SOCIETY (2006)

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Article Chemistry, Physical

Simulation of Ca2+ and Mg2+ solvation using polarizable atomic multipole potential

Dian Jiao et al.

JOURNAL OF PHYSICAL CHEMISTRY B (2006)

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Article Physics, Multidisciplinary

Theory of defect levels and the band gap problem in silicon

Peter A. Schultz

PHYSICAL REVIEW LETTERS (2006)

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Review Chemistry, Multidisciplinary

Photoemission from liquid aqueous solutions

B Winter et al.

CHEMICAL REVIEWS (2006)

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Review Chemistry, Multidisciplinary

Specific ion effects at the air/water interface

P Jungwirth et al.

CHEMICAL REVIEWS (2006)

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Article Chemistry, Physical

Mechanistic insights into NO3• induced self-terminating radical oxygenations, Part 1:: A computational study on NO3• and its addition to alkynes

U Wille et al.

JOURNAL OF PHYSICAL CHEMISTRY A (2006)

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Article Chemistry, Physical

Ansatz for the evaluation of the relativistic contributions to core ionization energies in complex molecules involving heavy atoms

J Maruani et al.

INTERNATIONAL JOURNAL OF QUANTUM CHEMISTRY (2005)

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Article Chemistry, Physical

Density functional theory based molecular-dynamics study of aqueous iodide solvation

JM Heuft et al.

JOURNAL OF CHEMICAL PHYSICS (2005)

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Article Chemistry, Multidisciplinary

Chemical hardness and density functional theory

RG Pearson

JOURNAL OF CHEMICAL SCIENCES (2005)

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Article Chemistry, Physical

Enhanced concentration of polarizable anions at the liquid water surface: SHG spectroscopy and MD simulations of sodium thiocyanide

PB Petersen et al.

JOURNAL OF PHYSICAL CHEMISTRY B (2005)

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Article Chemistry, Physical

Unified molecular picture of the surfaces of aqueous acid, base, and salt solutions

M Mucha et al.

JOURNAL OF PHYSICAL CHEMISTRY B (2005)

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Article Chemistry, Physical

Evidence for an enhanced hydronium concentration at the liquid water surface

PB Petersen et al.

JOURNAL OF PHYSICAL CHEMISTRY B (2005)

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Article Multidisciplinary Sciences

Electron spectroscopy of aqueous solution interfaces reveals surface enhancement of halides

S Ghosal et al.

SCIENCE (2005)

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Article Multidisciplinary Sciences

Porous semiconductor chalcogenide aerogels

JL Mohanan et al.

SCIENCE (2005)

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Article Chemistry, Physical

Surface solvation for an ion in a water cluster

DH Herce et al.

JOURNAL OF CHEMICAL PHYSICS (2005)

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Article Chemistry, Physical

Probing the molecular structure and bonding of the surface of aqueous salt solutions

EA Raymond et al.

JOURNAL OF PHYSICAL CHEMISTRY B (2004)

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Article Chemistry, Physical

Photoemission from aqueous alkali-metal-iodide salt solutions using EUV synchrotron radiation

R Weber et al.

JOURNAL OF PHYSICAL CHEMISTRY B (2004)

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Article Chemistry, Physical

Full valence band photoemission from liquid water using EUV synchrotron radiation

B Winter et al.

JOURNAL OF PHYSICAL CHEMISTRY A (2004)

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Article Chemistry, Physical

Size dependent ion hydration, its asymmetry, and convergence to macroscopic behavior

S Rajamani et al.

JOURNAL OF CHEMICAL PHYSICS (2004)

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Article Chemistry, Physical

Vibrational Spectroscopy of aqueous sodium halide solutions and air-liquid interfaces: Observation of increased interfacial depth

DF Liu et al.

JOURNAL OF PHYSICAL CHEMISTRY B (2004)

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Article Chemistry, Physical

Temperature and pressure dependence of the AMOEBA water model

PY Ren et al.

JOURNAL OF PHYSICAL CHEMISTRY B (2004)

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Article Chemistry, Physical

Confirmation of enhanced anion concentration at the liquid water surface

PB Petersen et al.

CHEMICAL PHYSICS LETTERS (2004)

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Review Chemistry, Multidisciplinary

Ion solvation thermodynamics from simulation with a polarizable force field

A Grossfield et al.

JOURNAL OF THE AMERICAN CHEMICAL SOCIETY (2003)

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Article Multidisciplinary Sciences

Direct observations of North Pacific ventilation: Brine rejection in the Okhotsk Sea

AY Shcherbina et al.

SCIENCE (2003)

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Review Chemistry, Multidisciplinary

The tropospheric chemistry of sea salt: A molecular-level view of the chemistry of NaCl and NaBr

BJ Finlayson-Pitts

CHEMICAL REVIEWS (2003)

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Article Multidisciplinary Sciences

Reactions at interfaces as a source of sulfate formation in sea-salt particles

A Laskin et al.

SCIENCE (2003)

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Review Chemistry, Physical

Polarizable atomic multipole water model for molecular mechanics simulation

PY Ren et al.

JOURNAL OF PHYSICAL CHEMISTRY B (2003)

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Article Multidisciplinary Sciences

The hydration structure of guanidinium and thiocyanate ions: Implications for protein stability in aqueous solution

PE Mason et al.

PROCEEDINGS OF THE NATIONAL ACADEMY OF SCIENCES OF THE UNITED STATES OF AMERICA (2003)

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Article Chemistry, Physical

Polarizability and aqueous solvation of the sulfate dianion

P Jungwirth et al.

CHEMICAL PHYSICS LETTERS (2003)

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Article Chemistry, Physical

Polarizability of the nitrate anion and its solvation at the air/water interface

P Salvador et al.

PHYSICAL CHEMISTRY CHEMICAL PHYSICS (2003)

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Article Biochemistry & Molecular Biology

Dynamic hydration numbers for biologically important ions

MY Kiriukhin et al.

BIOPHYSICAL CHEMISTRY (2002)

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Review Chemistry, Physical

Ions at the air/water interface

P Jungwirth et al.

JOURNAL OF PHYSICAL CHEMISTRY B (2002)

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Article Chemistry, Physical

Chloride anion on aqueous clusters, at the air-water interface, and in liquid water:: Solvent effects on Cl- polarizability

P Jungwirth et al.

JOURNAL OF PHYSICAL CHEMISTRY A (2002)

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Article Chemistry, Physical

An ab initio study of water molecules in the bromide ion solvation shell

S Raugei et al.

JOURNAL OF CHEMICAL PHYSICS (2002)

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Letter Chemistry, Physical

Molecular structure of salt solutions: A new view of the interface with implications for heterogeneous atmospheric chemistry

P Jungwirth et al.

JOURNAL OF PHYSICAL CHEMISTRY B (2001)

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Article Multidisciplinary Sciences

Dynamics of water molecules in aqueous solvation shells

MF Kropman et al.

SCIENCE (2001)

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Review Chemistry, Physical

Physical chemistry of airborne sea salt particles and their components

BJ Finlayson-Pitts et al.

JOURNAL OF PHYSICAL CHEMISTRY A (2000)

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Article Chemistry, Physical

A detailed study on the symmetry breaking and its effect on the potential surface of NO3

W Eisfeld et al.

JOURNAL OF CHEMICAL PHYSICS (2000)

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Article Multidisciplinary Sciences

Experiments and simulations of ion-enhanced interfacial chemistry on aqueous NaCl aerosols

EM Knipping et al.

SCIENCE (2000)

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Article Multidisciplinary Sciences

Atmospheric chemistry - Meeting at the interface

JH Seinfeld

SCIENCE (2000)

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