Systematic Coarse Graining of Environments for the Nonperturbative Simulation of Open Quantum Systems
Conducting precise electronic-vibrational dynamics simulations of molecular systems poses significant challenges when dealing with realistic environments composed of numerous vibrational modes. Here, we introduce a technique for the construction of effective phonon spectral densities that capture accurately open-system dynamics over a finite time interval of interest. When combined with existing nonperturbative simulation tools, our approach can reduce significantly the computational costs associated with many-body open-system dynamics.
| Medienart: |
E-Artikel |
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| Erscheinungsjahr: |
2024 |
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| Erschienen: |
2024 |
| Enthalten in: |
Zur Gesamtaufnahme - volume:132 |
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| Enthalten in: |
Physical review letters - 132(2024), 10 vom: 08. März, Seite 100403 |
| Sprache: |
Englisch |
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| Beteiligte Personen: |
Lorenzoni, Nicola [VerfasserIn] |
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| Links: |
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| Anmerkungen: |
Date Revised 22.03.2024 published: Print Citation Status PubMed-not-MEDLINE |
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| doi: |
10.1103/PhysRevLett.132.100403 |
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| funding: |
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| Förderinstitution / Projekttitel: |
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| PPN (Katalog-ID): |
NLM370078675 |
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| 520 | |a Conducting precise electronic-vibrational dynamics simulations of molecular systems poses significant challenges when dealing with realistic environments composed of numerous vibrational modes. Here, we introduce a technique for the construction of effective phonon spectral densities that capture accurately open-system dynamics over a finite time interval of interest. When combined with existing nonperturbative simulation tools, our approach can reduce significantly the computational costs associated with many-body open-system dynamics | ||
| 650 | 4 | |a Journal Article | |
| 700 | 1 | |a Cho, Namgee |e verfasserin |4 aut | |
| 700 | 1 | |a Lim, James |e verfasserin |4 aut | |
| 700 | 1 | |a Tamascelli, Dario |e verfasserin |4 aut | |
| 700 | 1 | |a Huelga, Susana F |e verfasserin |4 aut | |
| 700 | 1 | |a Plenio, Martin B |e verfasserin |4 aut | |
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