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Multi-level quantum Rabi model for anharmonic vibrational polaritons

The Journal of chemical physics, 2019-10, Vol.151 (14), p.144116-144116

2019

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The shape of the electric dipole function determines the sub-picosecond dynamics of anharmonic vibrational polaritons

The Journal of chemical physics, 2020-06, Vol.152 (23), p.234111-234111

2020

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Excited-state vibration-polariton transitions and dynamics in nitroprusside

Nature communications, 2021-01, Vol.12 (1), p.214-214, Article 214

2021

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Understanding the active role of water in laboratory chamber studies of reactions of the OH radical with alcohols of atmospheric relevance

Physical chemistry chemical physics : PCCP, 2024-04, Vol.26 (16), p.12745-12752

2024

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Triplet Generation Dynamics in Si- and Ge-Bridged Conjugated Copolymers

Journal of physical chemistry. C, 2022-01, Vol.126 (2), p.1036-1045

2022

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Water catalysis of the reaction between hydroxyl radicals and linear saturated alcohols (ethanol and n-propanol) at 294 K

Physical chemistry chemical physics : PCCP, 2018-11, Vol.20 (44), p.27885-27896

2018

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Indolocarbazole as a Platform for Concatenated Crystalline Rotors

Crystal growth & design, 2023-09, Vol.23 (9), p.6785-6794

2023

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Simulation of Impulsive Vibrational Spectroscopy

The journal of physical chemistry. A, Molecules, spectroscopy, kinetics, environment, & general theory, 2019-03, Vol.123 (10), p.2065-2072

2019

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Millimeter-Scale Zn(3-ptz)2 Metal–Organic Framework Single Crystals: Self-Assembly Mechanism and Growth Kinetics

ACS omega, 2021-07, Vol.6 (27), p.17289-17298

2021

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A Real-Time Time-Dependent Density Functional Tight-Binding Implementation for Semiclassical Excited State Electron–Nuclear Dynamics and Pump–Probe Spectroscopy Simulations

Journal of chemical theory and computation, 2020-07, Vol.16 (7), p.4454-4469

2020

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Experimentally Delineating the Catalytic Effect of a Single Water Molecule in the Photochemical Rearrangement of the Phenylperoxy Radical to the Oxepin-2(5 H )-one-5-yl Radical

Journal of the American Chemical Society, 2024-07

2024

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Multiconfigurational Calculations and Photodynamics Describe Norbornadiene Photochemistry

Journal of organic chemistry, 2023-05, Vol.88 (9), p.5311-5320

2023

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Water Catalysis of the Reaction between Methanol and OH at 294 K and the Atmospheric Implications

Angewandte Chemie International Edition, 2017-02, Vol.56 (8), p.2166-2170

2017

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Fully Atomistic Real-Time Simulations of Transient Absorption Spectroscopy

The journal of physical chemistry letters, 2018-08, Vol.9 (15), p.4355-4359

2018

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Competition between ultralong organic phosphorescence and thermally activated delayed fluorescence in dichloro derivatives of 9-benzoylcarbazole

Physical chemistry chemical physics : PCCP, 2022-12, Vol.24 (48), p.29437-2945

2022

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Excited state mechanisms in crystalline carbazole: the role of aggregation and isomeric defects

Journal of materials chemistry. C, Materials for optical and electronic devices, 2021-09, Vol.9 (35), p.11882-11892

2021

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H-bonded network rearrangements in the S0, S1 and D0 states of neutral and cationic p-cresol(H2O)(NH3) complexes

Physical chemistry chemical physics : PCCP, 2012-07, Vol.14 (25), p.8945-8955

2012

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Photochemical Fingerprinting Is a Sensitive Probe for the Detection of Synthetic Cannabinoid Receptor Agonists; toward Robust Point-of-Care Detection

Analytical chemistry (Washington), 2023-01, Vol.95 (2), p.703-713

2023

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Rate coefficient and mechanism of the OH-initiated degradation of cyclobutanol: A combined experimental and theoretical study

Atmospheric environment (1994), 2022-01, Vol.268, p.118821, Article 118821

2022

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Trapped Hydronium Radical Produced by Ultraviolet Excitation of Substituted Aromatic Molecule

The journal of physical chemistry. A, Molecules, spectroscopy, kinetics, environment, & general theory, 2015-12, Vol.119 (51), p.12730-12735

2015

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Conformational emissive states in dual-state emitters with benzotriazole acceptors

Matter, 2023-04, Vol.6 (4), p.1140-1159

2023

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Infrared Spectroscopy of OH··CH3OH: Hydrogen-Bonded Intermediate Along the Hydrogen Abstraction Reaction Path

The journal of physical chemistry. A, Molecules, spectroscopy, kinetics, environment, & general theory, 2015-07, Vol.119 (29), p.8125-8132

2015

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Mid-infrared signatures of hydroxyl containing water clusters: Infrared laser Stark spectroscopy of OH-H2O and OH(D2O)n (n = 1-3)

The Journal of chemical physics, 2015-10, Vol.143 (16), p.164304-164304

2015

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The dark side of cyclooctatetraene (COT): Photophysics in the singlet states of “self-healing” dyes

Chinese chemical letters, 2024-08, Vol.35 (8), p.109227, Article 109227

2024

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Water Catalysis of the Reaction between Methanol and OH at 294 K and the Atmospheric Implications

Angewandte Chemie, 2017-02, Vol.129 (8), p.2198-2202

2017

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Multi-level quantum Rabi model for anharmonic vibrational polaritons

The shape of the electric dipole function determines the sub-picosecond dynamics of anharmonic vibrational polaritons

Excited-state vibration-polariton transitions and dynamics in nitroprusside

Understanding the active role of water in laboratory chamber studies of reactions of the OH radical with alcohols of atmospheric relevance

Triplet Generation Dynamics in Si- and Ge-Bridged Conjugated Copolymers

Water catalysis of the reaction between hydroxyl radicals and linear saturated alcohols (ethanol and n-propanol) at 294 K

Indolocarbazole as a Platform for Concatenated Crystalline Rotors

Simulation of Impulsive Vibrational Spectroscopy

Millimeter-Scale Zn(3-ptz)2 Metal–Organic Framework Single Crystals: Self-Assembly Mechanism and Growth Kinetics

A Real-Time Time-Dependent Density Functional Tight-Binding Implementation for Semiclassical Excited State Electron–Nuclear Dynamics and Pump–Probe Spectroscopy Simulations

Experimentally Delineating the Catalytic Effect of a Single Water Molecule in the Photochemical Rearrangement of the Phenylperoxy Radical to the Oxepin-2(5 H )-one-5-yl Radical

Multiconfigurational Calculations and Photodynamics Describe Norbornadiene Photochemistry

Water Catalysis of the Reaction between Methanol and OH at 294 K and the Atmospheric Implications

Fully Atomistic Real-Time Simulations of Transient Absorption Spectroscopy

Competition between ultralong organic phosphorescence and thermally activated delayed fluorescence in dichloro derivatives of 9-benzoylcarbazole

Excited state mechanisms in crystalline carbazole: the role of aggregation and isomeric defects

H-bonded network rearrangements in the S0, S1 and D0 states of neutral and cationic p-cresol(H2O)(NH3) complexes

Photochemical Fingerprinting Is a Sensitive Probe for the Detection of Synthetic Cannabinoid Receptor Agonists; toward Robust Point-of-Care Detection

Rate coefficient and mechanism of the OH-initiated degradation of cyclobutanol: A combined experimental and theoretical study

Trapped Hydronium Radical Produced by Ultraviolet Excitation of Substituted Aromatic Molecule

Conformational emissive states in dual-state emitters with benzotriazole acceptors

Infrared Spectroscopy of OH··CH3OH: Hydrogen-Bonded Intermediate Along the Hydrogen Abstraction Reaction Path

Mid-infrared signatures of hydroxyl containing water clusters: Infrared laser Stark spectroscopy of OH-H2O and OH(D2O)n (n = 1-3)

The dark side of cyclooctatetraene (COT): Photophysics in the singlet states of “self-healing” dyes

Water Catalysis of the Reaction between Methanol and OH at 294 K and the Atmospheric Implications

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