Zobrazeno 1 - 10
of 34
pro vyhledávání: '"Enrico Ronca"'
Publikováno v:
Physical Review Research, Vol 6, Iss 3, p 033283 (2024)
We analyze the real-time electron-photon dynamics in long- and short-range energy transfer using a real-time quantum electrodynamics coupled cluster model, which allows for spatial and temporal visualization of transport processes. We compute the tim
Externí odkaz:
https://doaj.org/article/155abe26261d4486a6f2587fdb3fae3c
Publikováno v:
Nature Communications, Vol 13, Iss 1, Pp 1-9 (2022)
Hybridization of dark optical cavity modes with vibrational states of molecules can alter chemical reactions. Here, the authors use ab-initio methods to shine light on the associated mechanism and highlight the role of the optical mode to redistribut
Externí odkaz:
https://doaj.org/article/f02e829e1da9478b8db15009c9585099
Publikováno v:
Nature Communications, Vol 13, Iss 1, Pp 1-8 (2022)
Theoretical description of light-matter coupling in the strong-coupling regime is challenging. Here the authors introduce a fully consistent ab-initio method of molecular orbital theory applicable to material systems in quantum electrodynamics enviro
Externí odkaz:
https://doaj.org/article/93601d985bc94e52ab1e0f2e3ad20b7d
Publikováno v:
Physical Review X, Vol 13, Iss 3, p 031002 (2023)
The development of efficient techniques to distinguish mirror images of chiral molecules (enantiomers) is very important in both chemistry and physics. Enantiomers share most molecular properties except, for instance, the absorption of circularly pol
Externí odkaz:
https://doaj.org/article/f1038f5fd9084332ab30587afceb661f
Publikováno v:
Physical Review X, Vol 10, Iss 4, p 041043 (2020)
We present an ab initio correlated approach to study molecules that interact strongly with quantum fields in an optical cavity. Quantum electrodynamics coupled cluster theory provides a nonperturbative description of cavity-induced effects in ground
Externí odkaz:
https://doaj.org/article/31bced94075a48868f5f35d03c6e0f6b
Autor:
Marco Romanelli, Rosario Roberto Riso, Tor S. Haugland, Enrico Ronca, Stefano Corni, Henrik Koch
Publikováno v:
Nano Letters.
Strong coupling between molecules and quantized fields has emerged as an effective methodology to engineer molecular properties. New hybrid states are formed when molecules interact with quantized fields. Since the properties of these states can be m
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_dedup___::ea6b54255e60604661b74f59b02271fd
https://doi.org/10.1021/acs.nanolett.3c00735
https://doi.org/10.1021/acs.nanolett.3c00735
The development of efficient techniques to distinguish mirror images of chiral molecules (enantiomers) is very important in both chemistry and physics. Enantiomers share most molecular properties except, for instance, the absorption of circularly pol
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_dedup___::6ecc15d23fe79734c17c51c39c57df01
Geometries to reproduce the calculations in the supporting information of "Riso, R. R., Haugland, T. S., Ronca, E., & Koch, H. (2022). On the characteristic features of ionization in QED environments.arXiv preprint arXiv:2203.06050." The field is ori
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_dedup___::63a9a33df9bcb9acfaa679df966cea8a
The ionization of molecular systems is important in many chemical processes such as electron transfer and hot electron injection. Strong coupling between molecules and quantized fields (e.g. inside optical cavities) represents a new promising way to
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_dedup___::18d0a2e05fe9f06b447c91f4582cbdc6
http://arxiv.org/abs/2203.06050
http://arxiv.org/abs/2203.06050
Publikováno v:
Nature Communications
Coupling between molecules and vacuum photon fields inside an optical cavity has proven to be an effective way to engineer molecular properties, in particular reactivity. To ease the rationalization of cavity induced effects we introduce an ab initio
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_dedup___::568f6b4bf96f922e8946334e7968dd73
https://hdl.handle.net/11250/3047972
https://hdl.handle.net/11250/3047972