Irene Burghardt

14PUBLICATIONS
15CO-AUTHORS
Computational methods in fluid flow, heat and mass transfer (incl. computational fluid dynamics)Quantum computationEnergy generation, conversion and storage (excl. chemical and electrical)Fluid-structure interaction and aeroacousticsRadiation and matter
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Publications (14)

|Apr 16, 2021
Multi-layer Gaussian-based multi-configuration time-dependent Hartree (ML-GMCTDH) simulations of ultrafast charge separation in a donor-acceptor complex.

Francesco Di Maiolo, Graham A Worth, Irene Burghardt

|Nov 14, 2020
Quantum dynamical simulations of intra-chain exciton diffusion in an oligo (para-phenylene vinylene) chain at finite temperature.

Francesco Di Maiolo, Dominik Brey, Robert Binder

|Jun 04, 2020
First-principles description of intra-chain exciton migration in an oligo(para-phenylene vinylene) chain. I. Generalized Frenkel-Holstein Hamiltonian.

Robert Binder, Matteo Bonfanti, David Lauvergnat

|Jun 04, 2020
First-principles description of intra-chain exciton migration in an oligo(para-phenylene vinylene) chain. II. ML-MCTDH simulations of exciton dynamics at a torsional defect.

Robert Binder, Irene Burghardt

|Jul 01, 2019
Vibronic coupling models for donor-acceptor aggregates using an effective-mode scheme: Application to mixed Frenkel and charge-transfer excitons in oligothiophene aggregates.

Wjatscheslaw Popp, Matthias Polkehn, Keith H Hughes

|Jun 17, 2019
Open system dynamics using Gaussian-based multiconfigurational time-dependent Hartree wavefunctions: Application to environment-modulated tunneling.

David Picconi, Irene Burghardt

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Frequent Collaborators

3 joint publications

David Picconi

2 joint publications

Matteo Bonfanti

2 joint publications

Rocco Martinazzo

2 joint publications

Jeffrey A Cina