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Physical Chemistry

Working Paper

Internal Conversion of the Anionic GFP Chromophore: In and Out of the I-twisted S1/S0 Conical Intersection Seam

Nanna Holmgaard List, Chey Marcel Jones, Todd J. Martínez

Version 1 posted 10 May 2021

430

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Theoretical and Computational Chemistry

Working Paper

Using diketopyrrolopyrroles to stabilize double excitation and control internal conversion

Mariana T. do Casal, Josene M. Toldo, Felix Plasser, Mario Barbatti

Version 1 posted 23 May 2022

198

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1

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Theoretical and Computational Chemistry

Working Paper

Serendipitous Triplet Harvesting in Donor-acceptor Dyads with Low Spin-orbit Coupling

Pijush Karak, Torsha Moitra, Ambar Banerjee, Kenneth Ruud, Swapan Chakrabarti

Version 2 posted 19 June 2023

334

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Physical Chemistry

Working Paper

Deciphering methylation effects on S2(pp*) internal conversion in the simplest linear alpha,beta-unsaturated carbonyl

Pratip Chakraborty, Rafael Couto, Nanna Holmgaard List

Version 1 posted 18 April 2023

133

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Theoretical and Computational Chemistry

Working Paper

Modelling the Fluorescence Quantum Yields of Aromatic Compounds: Benchmarking the Machinery to Compute Intersystem Crossing Rates

Koen Veys, Manon H. E. Bousquet, Denis Jacquemin, Daniel Escudero

Version 1 posted 28 June 2023

582

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1

Citations

Physical Chemistry

Working Paper

Role of Vibronic Couplings and Energy Gap in the Internal Conversion Process of a Molecule

Wataru Ota, Motoyuki Uejima, Tohru Sato

Version 1 posted 21 November 2022

318

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Physical Chemistry

Working Paper

Resolving the Ultrafast Dynamics of the Anionic Green Fluorescent Protein Chromophore in Water

Chey Jones, Nanna Holmgaard List, Todd J. Martínez

Version 1 posted 10 May 2021

271

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Theoretical and Computational Chemistry

Working Paper

Towards Prediction of Non-Radiative Decay Pathways in Organic Compounds I: The Case of Naphthalene Quantum Yields

Alexander Kohn, Zhou Lin, Troy Van Voorhis

Version 1 posted 08 February 2019

861

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Physical Chemistry

Working Paper

Theoretical Determination of Rate Constants from Excited-States: Application to Benzophenone

Katsuyuki Shizu, Hironori Kaji

Version 1 posted 24 May 2021

1,393

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Theoretical and Computational Chemistry

Working Paper

Evaluating the Anharmonicity Contributions to the Molecular Excited State Internal Conversion Rates with Finite Temperature TD-DMRG

Yuanheng Wang, Jiajun Ren, Zhigang Shuai

Version 2 posted 28 May 2021

403

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13 results in internal conversion in Keywords: internal conversion

Internal Conversion of the Anionic GFP Chromophore: In and Out of the I-twisted S1/S0 Conical Intersection Seam

Using diketopyrrolopyrroles to stabilize double excitation and control internal conversion

Serendipitous Triplet Harvesting in Donor-acceptor Dyads with Low Spin-orbit Coupling

Deciphering methylation effects on S2(pp*) internal conversion in the simplest linear alpha,beta-unsaturated carbonyl

Modelling the Fluorescence Quantum Yields of Aromatic Compounds: Benchmarking the Machinery to Compute Intersystem Crossing Rates

Role of Vibronic Couplings and Energy Gap in the Internal Conversion Process of a Molecule

Resolving the Ultrafast Dynamics of the Anionic Green Fluorescent Protein Chromophore in Water

Towards Prediction of Non-Radiative Decay Pathways in Organic Compounds I: The Case of Naphthalene Quantum Yields

Theoretical Determination of Rate Constants from Excited-States: Application to Benzophenone

Evaluating the Anharmonicity Contributions to the Molecular Excited State Internal Conversion Rates with Finite Temperature TD-DMRG

13 results in Keywords: internal conversion