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How does tetraphenylethylene relax from its excited states?

Physical chemistry chemical physics : PCCP, 2016, Vol.18 (17), p.11606-11609

2016

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Direct Observation of Aggregation‐Induced Emission Mechanism

Angewandte Chemie (International ed.), 2020-08, Vol.59 (35), p.14903-14909

International ed. in English, 2020

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Rationalizing fluorescence quenching in meso-BODIPY dyes

Physical chemistry chemical physics : PCCP, 2016, Vol.18 (48), p.32668-32672

2016

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A Rising Star: Truxene as a Promising Hole Transport Material in Perovskite Solar Cells

Journal of physical chemistry. C, 2017-10, Vol.121 (39), p.21729-21739

2017

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Fluorescence Quenching in BODIPY Dyes: The Role of Intramolecular Interactions and Charge Transfer

Helvetica chimica acta, 2017-06, Vol.100 (6), p.e1700093

2017

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Getting the Right Twist: Influence of Donor–Acceptor Dihedral Angle on Exciton Kinetics and Singlet–Triplet Gap in Deep Blue Thermally Activated Delayed Fluorescence Emitter

Journal of physical chemistry. C, 2019-11, Vol.123 (45), p.27778-27784

2019

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Qualitatively Incorrect Features in the TDDFT Spectrum of Thiophene-Based Compounds

The journal of physical chemistry letters, 2015-01, Vol.6 (1), p.13-21

2015

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Intramolecular symmetry-adapted perturbation theory with a single-determinant wavefunction

The Journal of chemical physics, 2015-12, Vol.143 (22), p.224107-224107

2015

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How does alkyl chain length modify the properties of triphenylamine-based hole transport materials?

Journal of materials chemistry. C, Materials for optical and electronic devices, 2018, Vol.6 (5), p.960-965

2018

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Rationalizing fluorescence quenching in meso-BODIPY dyes

Physical chemistry chemical physics : PCCP, 2016-12, Vol.18 (48), p.32668-32672

2016

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Fluorescence Quenching in BODIPY Dyes: The Role of Intramolecular Interactions and Charge Transfer

Helvetica chimica acta, 2017-06, Vol.100 (6), p.n/a

2017

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Direct Observation of Aggregation‐Induced Emission Mechanism

Angewandte Chemie, 2020-08, Vol.132 (35), p.15013-15019

2020

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Deciphering the Influence of Ground-State Distributions on the Calculation of Photolysis Observables

The journal of physical chemistry. A, Molecules, spectroscopy, kinetics, environment, & general theory, 2023-09, Vol.127 (35), p.7400-7409

2023

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A Theoretical Perspective on the Actinic Photochemistry of 2‑Hydroperoxypropanal

The journal of physical chemistry. A, Molecules, spectroscopy, kinetics, environment, & general theory, 2022-08, Vol.126 (32), p.5420-5433

2022

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Low-Lying pi pi States of Heteroaromatic Molecules: A Challenge for Excited State Methods

Journal of chemical theory and computation, 2016-06, Vol.12 (6), p.2652-2660

2016

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Low-Lying ππ States of Heteroaromatic Molecules: A Challenge for Excited State Methods

Journal of chemical theory and computation, 2016-06, Vol.12 (6), p.2652-2660

2016

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Mechanisms of fluorescence quenching in prototypical aggregation-induced emission systems: excited state dynamics with TD-DFTB

Physical chemistry chemical physics : PCCP, 2019, Vol.21 (18), p.9026-9035

2019

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Rationalizing fluorescence quenching in meso-BODIPY dyesElectronic supplementary information (ESI) available. See DOI: 10.1039/c6cp06799a

2016-12

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On the Theoretical Determination of Photolysis Properties for Atmospheric Volatile Organic Compounds

The journal of physical chemistry letters, 2020-07, Vol.11 (14), p.5418-5425

2020

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How does tetraphenylethylene relax from its excited states?Electronic supplementary information (ESI) available: Computational details, method assessment and additional mechanistic analysis. See DOI: 10.1039/c5cp04546k

2016-04

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Caveat when using ADC(2) for studying the photochemistry of carbonyl-containing molecules

Physical chemistry chemical physics : PCCP, 2021-06, Vol.23 (23), p.12945-12949

2021

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Semiclassical Approach to Photophysics Beyond Kasha’s Rule and Vibronic Spectroscopy Beyond the Condon Approximation. The Case of Azulene

Journal of chemical theory and computation, 2020-04, Vol.16 (4), p.2617-2626

2020

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Timescales of N-H bond dissociation in pyrrole: a nonadiabatic dynamics study

Physical chemistry chemical physics : PCCP, 2015-07, Vol.17 (29), p.19012-19020

2015

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Photochemistry of 1‐ and 2‐Naphthols and Their Water Clusters: The Role of 1ππ(La) Mediated Hydrogen Transfer to Carbon Atoms

Chemistry : a European journal, 2017-06, Vol.23 (34), p.8244-8251

2017

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Photochemistry of 1- and 2-Naphthols and Their Water Clusters: The Role of 1[pi][pi](La) Mediated Hydrogen Transfer to Carbon Atoms

Chemistry : a European journal, 2017-06, Vol.23 (34), p.8244

2017

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How does tetraphenylethylene relax from its excited states?

Direct Observation of Aggregation‐Induced Emission Mechanism

Rationalizing fluorescence quenching in meso-BODIPY dyes

A Rising Star: Truxene as a Promising Hole Transport Material in Perovskite Solar Cells

Fluorescence Quenching in BODIPY Dyes: The Role of Intramolecular Interactions and Charge Transfer

Getting the Right Twist: Influence of Donor–Acceptor Dihedral Angle on Exciton Kinetics and Singlet–Triplet Gap in Deep Blue Thermally Activated Delayed Fluorescence Emitter

Qualitatively Incorrect Features in the TDDFT Spectrum of Thiophene-Based Compounds

Intramolecular symmetry-adapted perturbation theory with a single-determinant wavefunction

How does alkyl chain length modify the properties of triphenylamine-based hole transport materials?

Rationalizing fluorescence quenching in meso-BODIPY dyes

Fluorescence Quenching in BODIPY Dyes: The Role of Intramolecular Interactions and Charge Transfer

Direct Observation of Aggregation‐Induced Emission Mechanism

Deciphering the Influence of Ground-State Distributions on the Calculation of Photolysis Observables

A Theoretical Perspective on the Actinic Photochemistry of 2‑Hydroperoxypropanal

Low-Lying pi pi States of Heteroaromatic Molecules: A Challenge for Excited State Methods

Low-Lying ππ States of Heteroaromatic Molecules: A Challenge for Excited State Methods

Mechanisms of fluorescence quenching in prototypical aggregation-induced emission systems: excited state dynamics with TD-DFTB

Rationalizing fluorescence quenching in meso-BODIPY dyesElectronic supplementary information (ESI) available. See DOI: 10.1039/c6cp06799a

On the Theoretical Determination of Photolysis Properties for Atmospheric Volatile Organic Compounds

How does tetraphenylethylene relax from its excited states?Electronic supplementary information (ESI) available: Computational details, method assessment and additional mechanistic analysis. See DOI: 10.1039/c5cp04546k

Caveat when using ADC(2) for studying the photochemistry of carbonyl-containing molecules

Semiclassical Approach to Photophysics Beyond Kasha’s Rule and Vibronic Spectroscopy Beyond the Condon Approximation. The Case of Azulene

Timescales of N-H bond dissociation in pyrrole: a nonadiabatic dynamics study

Photochemistry of 1‐ and 2‐Naphthols and Their Water Clusters: The Role of 1ππ(La) Mediated Hydrogen Transfer to Carbon Atoms

Photochemistry of 1- and 2-Naphthols and Their Water Clusters: The Role of 1[pi][pi](La) Mediated Hydrogen Transfer to Carbon Atoms

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