Trapped-ion quantum simulation of electron transfer models with tunable dissipation

Electron transfer is at the heart of many fundamental physical, chemical, and biochemical processes essential for life. The exact simulation of these reactions is often hindered by the large number of degrees of freedom and by the essential role of quantum effects. Here, we experimentally simulate a paradigmatic model of molecular electron transfer using a multispecies trapped-ion crystal, where the donor-acceptor gap, the electronic and vibronic couplings, and the bath relaxation dynamics can all be controlled independently. By manipulating both the ground-state and optical qubits, we observe the real-time dynamics of the spin excitation, measuring the transfer rate in several regimes of adiabaticity and relaxation dynamics. Our results provide a testing ground for increasingly rich models of molecular excitation transfer processes that are relevant for molecular electronics and light-harvesting systems.

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Publication Details

Journal
Science Advances
Published
2024-12-20
DOI
https://doi.org/10.1126/sciadv.ads8011
Citations
17
Primary Topic
Spectroscopy and Quantum Chemical Studies
Type
article
Field-Weighted Citation Impact
5.74

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Trapped-ion quantum simulation of electron transfer models with tunable dissipation

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Science Advances
Spectroscopy and Quantum Chemical Studies
5.74
article

Trapped-ion quantum simulation of electron transfer models with tunable dissipation

Han Pu, Midhuna Duraisamy Suganthi, Peter G. Wolynes, José N. Onuchic, Visal So, Anup Menon, Guido Pagano, Roman Zhuravel, Mingjian Zhu
article en
17 citations

Abstract

Electron transfer is at the heart of many fundamental physical, chemical, and biochemical processes essential for life. The exact simulation of these reactions is often hindered by the large number of degrees of freedom and by the essential role of quantum effects. Here, we experimentally simulate a paradigmatic model of molecular electron transfer using a multispecies trapped-ion crystal, where the donor-acceptor gap, the electronic and vibronic couplings, and the bath relaxation dynamics can all be controlled independently. By manipulating both the ground-state and optical qubits, we observe the real-time dynamics of the spin excitation, measuring the transfer rate in several regimes of adiabaticity and relaxation dynamics. Our results provide a testing ground for increasingly rich models of molecular excitation transfer processes that are relevant for molecular electronics and light-harvesting systems.

Science AdvancesVol. 10(51)
Center for Theoretical Biological Physics (US), Rice University (US)
National Science Foundation, U.S. Department of Energy, Rice University, Office of Science, Center for Theoretical Biological Physics, Office of Naval Research, Nuclear Physics, Army Research Office
Peace, Justice and strong institutions
Openalex Percentile: Top 3%
Spectroscopy and Quantum Chemical Studies
5.74
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