{"title":"Modeling entanglement dynamics of molecules interacting with entangled photons through Lindblad master equation approach.","authors":"Sajal Kumar Giri, George C Schatz","doi":"10.1063/5.0254272","DOIUrl":null,"url":null,"abstract":"<p><p>This work presents a new approach for simulating the interaction between molecular aggregate systems and multi-modal energy-time entangled light by solving the Lindblad master equation. The density matrix that describes both molecular and photonic states is propagated on a time grid, with excited-state dephasing included via the Lindblad superoperator. Molecular exciton entanglement, induced by entangled photons, is analyzed from the time-evolved density matrix. The calculations are based on a model of a molecular dimer introduced by Bittner et al. [J. Chem. Phys. 152, 071101 (2020)], along with entangled light that is approximated by a finite number of modes. Our results demonstrate that photonic entanglement plays a significant role in influencing molecular exciton entanglement, highlighting the interplay between the photonic and excitonic subsystems in such interactions.</p>","PeriodicalId":15313,"journal":{"name":"Journal of Chemical Physics","volume":"162 11","pages":""},"PeriodicalIF":3.1000,"publicationDate":"2025-03-21","publicationTypes":"Journal Article","fieldsOfStudy":null,"isOpenAccess":false,"openAccessPdf":"","citationCount":"0","resultStr":null,"platform":"Semanticscholar","paperid":null,"PeriodicalName":"Journal of Chemical Physics","FirstCategoryId":"92","ListUrlMain":"https://doi.org/10.1063/5.0254272","RegionNum":2,"RegionCategory":"化学","ArticlePicture":[],"TitleCN":null,"AbstractTextCN":null,"PMCID":null,"EPubDate":"","PubModel":"","JCR":"Q3","JCRName":"CHEMISTRY, PHYSICAL","Score":null,"Total":0}
引用次数: 0
Abstract
This work presents a new approach for simulating the interaction between molecular aggregate systems and multi-modal energy-time entangled light by solving the Lindblad master equation. The density matrix that describes both molecular and photonic states is propagated on a time grid, with excited-state dephasing included via the Lindblad superoperator. Molecular exciton entanglement, induced by entangled photons, is analyzed from the time-evolved density matrix. The calculations are based on a model of a molecular dimer introduced by Bittner et al. [J. Chem. Phys. 152, 071101 (2020)], along with entangled light that is approximated by a finite number of modes. Our results demonstrate that photonic entanglement plays a significant role in influencing molecular exciton entanglement, highlighting the interplay between the photonic and excitonic subsystems in such interactions.
期刊介绍:
The Journal of Chemical Physics publishes quantitative and rigorous science of long-lasting value in methods and applications of chemical physics. The Journal also publishes brief Communications of significant new findings, Perspectives on the latest advances in the field, and Special Topic issues. The Journal focuses on innovative research in experimental and theoretical areas of chemical physics, including spectroscopy, dynamics, kinetics, statistical mechanics, and quantum mechanics. In addition, topical areas such as polymers, soft matter, materials, surfaces/interfaces, and systems of biological relevance are of increasing importance.
Topical coverage includes:
Theoretical Methods and Algorithms
Advanced Experimental Techniques
Atoms, Molecules, and Clusters
Liquids, Glasses, and Crystals
Surfaces, Interfaces, and Materials
Polymers and Soft Matter
Biological Molecules and Networks.