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The Role of Electrical Anharmonicity in the Association Band in the Water Spectrum

The journal of physical chemistry. B, 2014-07, Vol.118 (28), p.8286-8294

McCoy, Anne B

2014

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Spectroscopic snapshots of the proton-transfer mechanism in water

Science (American Association for the Advancement of Science), 2016-12, Vol.354 (6316), p.1131-1135

2016

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Exploring the Origins of Spectral Signatures of Strong Hydrogen Bonding in Protonated Water Clusters

The journal of physical chemistry. A, Molecules, spectroscopy, kinetics, environment, & general theory, 2022-03, Vol.126 (8), p.1360-1368

2022

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Infrared-driven unimolecular reaction of CH₃CHOO Criegee intermediates to OH radical products

Science (American Association for the Advancement of Science), 2014-09, Vol.345 (6204), p.1596-1598

2014

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Beyond Badger’s Rule: The Origins and Generality of the Structure–Spectra Relationship of Aqueous Hydrogen Bonds

The journal of physical chemistry letters, 2019-03, Vol.10 (5), p.918-924

2019

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Coupling of torsion and OH-stretching in tert-butyl hydroperoxide. II. The OH-stretching fundamental and overtone spectra

The Journal of chemical physics, 2021-04, Vol.154 (16), p.164307-164307

2021

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Hidden role of intermolecular proton transfer in the anomalously diffuse vibrational spectrum of a trapped hydronium ion

Proceedings of the National Academy of Sciences - PNAS, 2017-06, Vol.114 (24), p.E4706-E4713

2017

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Coupling of torsion and OH-stretching in tert-butyl hydroperoxide. I. The cold and warm first OH-stretching overtone spectrum

The Journal of chemical physics, 2021-04, Vol.154 (16), p.164306-164306

2021

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Microhydration of Contact Ion Pairs in M2+OH–(H2O) n=1–5 (M = Mg, Ca) Clusters: Spectral Manifestations of a Mobile Proton Defect in the First Hydration Shell

The journal of physical chemistry. A, Molecules, spectroscopy, kinetics, environment, & general theory, 2014-09, Vol.118 (35), p.7590-7597

2014

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Vibrational manifestations of strong non-Condon effects in the H3O+ ·X3 (X = Ar, N2, CH4, H2O) complexes: A possible explanation for the intensity in the association band in the vibrational spectrum of water

Physical chemistry chemical physics : PCCP, 2012-01, Vol.14 (20), p.7205-7214

2012

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The Role of Tunneling in the Spectra of H5+ and D5+ up to 7300 cm-1

The journal of physical chemistry. A, Molecules, spectroscopy, kinetics, environment, & general theory, 2020-06, Vol.124 (22), p.4427-4439

2020

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Persistence of dual free internal rotation in NH4(+)(H2O)·Hen=0-3 ion-molecule complexes: expanding the case for quantum delocalization in He tagging

The journal of physical chemistry. A, Molecules, spectroscopy, kinetics, environment, & general theory, 2015-05, Vol.119 (18), p.4170-4176

2015

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Potential energy surfaces and properties of ICN− and ICN

International journal of quantum chemistry, 2013-02, Vol.113 (3), p.366-374

McCoy, Anne B.

2013

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Vibrational Spectroscopy of the Water–Nitrate Complex in the O–H Stretching Region

The journal of physical chemistry. A, Molecules, spectroscopy, kinetics, environment, & general theory, 2014-09, Vol.118 (37), p.8188-8197

2014

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Diffuse Vibrational Signature of a Single Proton Embedded in the Oxalate Scaffold, HO2CCO2

The journal of physical chemistry. A, Molecules, spectroscopy, kinetics, environment, & general theory, 2015-12, Vol.119 (52), p.13018-13024

2015

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Rate of Gas Phase Association of Hydroxyl Radical and Nitrogen Dioxide

Science (American Association for the Advancement of Science), 2010-10, Vol.330 (6004), p.646-649

2010

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Virtual Issue on New Tools and Methods in Physical Chemistry Research

The journal of physical chemistry. A, Molecules, spectroscopy, kinetics, environment, & general theory, 2020-06, Vol.124 (22), p.4323-4324

McCoy, Anne B.

2020

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An H/D Isotopic Substitution Study of the H5O2 +·Ar Vibrational Predissociation Spectra: Exploring the Putative Role of Fermi Resonances in the Bridging Proton Fundamentals

The journal of physical chemistry. B, 2008-01, Vol.112 (2), p.321-327

2008

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A flexible approach to vibrational perturbation theory using sparse matrix methods

The Journal of chemical physics, 2022-02, Vol.156 (5), p.054107-054107

2022

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How the Shape of an H-Bonded Network Controls Proton-Coupled Water Activation in HONO Formation

Science (American Association for the Advancement of Science), 2010-01, Vol.327 (5963), p.308-312

2010

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A wave function correction-based approach to the identification of resonances for vibrational perturbation theory

The Journal of chemical physics, 2022-10, Vol.157 (16), p.164113-164113

2022

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Infrared Spectrum of the Pyrene Anion in the CH Stretching Region

The journal of physical chemistry. A, Molecules, spectroscopy, kinetics, environment, & general theory, 2024-05, Vol.128 (21), p.4225-4232

2024

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Correlations between the Structures and Spectra of Protonated Water Clusters

The journal of physical chemistry. A, Molecules, spectroscopy, kinetics, environment, & general theory, 2024-02, Vol.128 (5), p.868-879

2024

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Fundamental Excitations of the Shared Proton in the H3O2 - and H5O2 + Complexes

The journal of physical chemistry. A, Molecules, spectroscopy, kinetics, environment, & general theory, 2005-03, Vol.109 (8), p.1487-1490

2005

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Exploring Expansions of the Potential and Dipole Surfaces Used for Vibrational Perturbation Theory

The journal of physical chemistry. A, Molecules, spectroscopy, kinetics, environment, & general theory, 2022-10, Vol.126 (40), p.7242-7249

2022

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The Role of Electrical Anharmonicity in the Association Band in the Water Spectrum

Spectroscopic snapshots of the proton-transfer mechanism in water

Exploring the Origins of Spectral Signatures of Strong Hydrogen Bonding in Protonated Water Clusters

Infrared-driven unimolecular reaction of CH₃CHOO Criegee intermediates to OH radical products

Beyond Badger’s Rule: The Origins and Generality of the Structure–Spectra Relationship of Aqueous Hydrogen Bonds

Coupling of torsion and OH-stretching in tert-butyl hydroperoxide. II. The OH-stretching fundamental and overtone spectra

Hidden role of intermolecular proton transfer in the anomalously diffuse vibrational spectrum of a trapped hydronium ion

Coupling of torsion and OH-stretching in tert-butyl hydroperoxide. I. The cold and warm first OH-stretching overtone spectrum

Microhydration of Contact Ion Pairs in M2+OH–(H2O) n=1–5 (M = Mg, Ca) Clusters: Spectral Manifestations of a Mobile Proton Defect in the First Hydration Shell

Vibrational manifestations of strong non-Condon effects in the H3O+ ·X3 (X = Ar, N2, CH4, H2O) complexes: A possible explanation for the intensity in the association band in the vibrational spectrum of water

The Role of Tunneling in the Spectra of H5+ and D5+ up to 7300 cm-1

Persistence of dual free internal rotation in NH4(+)(H2O)·Hen=0-3 ion-molecule complexes: expanding the case for quantum delocalization in He tagging

Potential energy surfaces and properties of ICN− and ICN

Vibrational Spectroscopy of the Water–Nitrate Complex in the O–H Stretching Region

Diffuse Vibrational Signature of a Single Proton Embedded in the Oxalate Scaffold, HO2CCO2

Rate of Gas Phase Association of Hydroxyl Radical and Nitrogen Dioxide

Virtual Issue on New Tools and Methods in Physical Chemistry Research

An H/D Isotopic Substitution Study of the H5O2 +·Ar Vibrational Predissociation Spectra: Exploring the Putative Role of Fermi Resonances in the Bridging Proton Fundamentals

A flexible approach to vibrational perturbation theory using sparse matrix methods

How the Shape of an H-Bonded Network Controls Proton-Coupled Water Activation in HONO Formation

A wave function correction-based approach to the identification of resonances for vibrational perturbation theory

Infrared Spectrum of the Pyrene Anion in the CH Stretching Region

Correlations between the Structures and Spectra of Protonated Water Clusters

Fundamental Excitations of the Shared Proton in the H3O2 - and H5O2 + Complexes

Exploring Expansions of the Potential and Dipole Surfaces Used for Vibrational Perturbation Theory

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