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Michael A Robb

9PUBLICATIONS

10CO-AUTHORS

Theoretical quantum chemistryReaction kinetics and dynamicsRadiation and matterElectrical energy generation (incl. renewables, excl. photovoltaics)Nonlinear optics and spectroscopy

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Publications (9)

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|Jan 11, 2025

Coherent Excitation of the CH Stretching Vibrations in C<sub>2</sub>H<sub>4</sub> <sup>+</sup>: The Role of the Derivative Coupling Studied by the Quantum Ehrenfest Method.

Thierry Tran, Graham A Worth, Michael A Robb

|Nov 27, 2024

Real-Time CASSCF (Ehrenfest) Modeling of Electron Dynamics in Organic Semiconductors. Dynamics Reaction Paths Driven by Quantum Coherences. Application to a Radical Organic Semiconductor.

Mercè Deumal, Jordi Ribas-Ariño, Cristina Roncero

|Jun 25, 2024

Controlling Electronic Coherences and the Curvature Induced by the Derivative Coupling at a Conical Intersection: A Quantum Ehrenfest (QuEh) Protocol for Reaction Path Following Application to "Channel 3" Benzene Photochemistry.

Graham A Worth, Michael A Robb

|Jun 26, 2023

Coherent Mixing of Singlet and Triplet States in Acrolein and Ketene: A Computational Strategy for Simulating the Electron-Nuclear Dynamics of Intersystem Crossing.

Don Danilov, Andrew J Jenkins, Michael J Bearpark

|Jan 25, 2023

Control of nuclear dynamics in the benzene cation by electronic wavepacket composition.

Thierry Tran, Graham A Worth, Michael A Robb

|Jul 01, 2022

How electronic superpositions drive nuclear motion following the creation of a localized hole in the glycine radical cation.

Don Danilov, Thierry Tran, Michael J Bearpark

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Frequent Collaborators

6 joint publications

Graham A Worth

3 joint publications

Thierry Tran

2 joint publications

Don Danilov

1 joint publications

K Eryn Spinlove

1 joint publications

Gareth W Richings

1 joint publications

Massimo Olivucci

1 joint publications

Michael J Bearpark

1 joint publications

Jon P Marangos

1 joint publications

Andrew J Jenkins

1 joint publications

Mercè Deumal

Frequent Collaborators

6 joint publications

Graham A Worth

3 joint publications

Thierry Tran

2 joint publications

Don Danilov

1 joint publications

K Eryn Spinlove

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