Driving enhanced exciton transfer by automatic differentiation

Abstract We model and study the processes of excitation, absorption, and transfer in various networks. The model consists of a harmonic oscillator representing a single-mode radiation field, a two-level system acting as an antenna, a network through which the excitation propagates, and another two-level system at the end serving as a sink. We investigate how off-resonant excitations can be optimally absorbed and transmitted through the network. Three strategies are considered: optimising network energies, adjusting the couplings between the radiation field, the antenna, and the network, or introducing and optimising driving fields at the start and end of the network. These strategies are tested on three different types of network with increasing complexity: nearest-neighbour and star configurations, and one associated with the Fenna–Matthews–Olson complex. The results show that, among the various strategies, the introduction of driving fields is the most effective, leading to a significant increase in the probability of reaching the sink in a given time. This result remains stable across networks of varying dimensionalities and types, and the driving process requires only a few parameters to be effective.

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Publication Details

Journal
Machine Learning Science and Technology
Published
2025-04-29
DOI
https://doi.org/10.1088/2632-2153/add23b
Citations
1
Primary Topic
Photoreceptor and optogenetics research
Type
article
Field-Weighted Citation Impact
0.91

Funders

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article

Driving enhanced exciton transfer by automatic differentiation

Mauro Paternostro, Sandro Donadi, Andrea Smirne, Fabio Anselmi et al.
1 citations
Machine Learning Science and Technology
Photoreceptor and optogenetics research
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article

Driving enhanced exciton transfer by automatic differentiation

Mauro Paternostro, Sandro Donadi, Andrea Smirne, Fabio Anselmi, Diana Chisholm, Emanuele Ballarin
article en
1 citations

Abstract

Abstract We model and study the processes of excitation, absorption, and transfer in various networks. The model consists of a harmonic oscillator representing a single-mode radiation field, a two-level system acting as an antenna, a network through which the excitation propagates, and another two-level system at the end serving as a sink. We investigate how off-resonant excitations can be optimally absorbed and transmitted through the network. Three strategies are considered: optimising network energies, adjusting the couplings between the radiation field, the antenna, and the network, or introducing and optimising driving fields at the start and end of the network. These strategies are tested on three different types of network with increasing complexity: nearest-neighbour and star configurations, and one associated with the Fenna–Matthews–Olson complex. The results show that, among the various strategies, the introduction of driving fields is the most effective, leading to a significant increase in the probability of reaching the sink in a given time. This result remains stable across networks of varying dimensionalities and types, and the driving process requires only a few parameters to be effective.

Machine Learning Science and TechnologyVol. 6(2)
Queen's University Belfast (GB), University of Trieste (IT), University of Milan (IT), IIT@MIT (US), Istituto Nazionale di Fisica Nucleare, Sezione di Milano (IT), Istituto Nazionale di Fisica Nucleare, Sezione di Trieste (IT), University of Palermo (IT)
UK Research and Innovation, Department for the Economy, HORIZON EUROPE Framework Programme, Engineering and Physical Sciences Research Council
Openalex Percentile: Top 28%
Photoreceptor and optogenetics research
0.91
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