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Chiral polaritonics: cavity-mediated enantioselective excitation condensation
Rosario R. Riso, Matteo Castagnola, Enrico Ronca +1
Separation of the two mirror images of a chiral molecule, the enantiomers, is a historically complicated problem of major relevance for biological systems. Since chiral molecules a…
A comprehensive theory for relativistic polaritonic chemistry: a four components ab initio treatment of molecular systems coupled to quantum fields
Guillaume Thiam, Riccardo Rossi, Henrik Koch +2
We present a new ab initio approach to study molecules containing heavy atoms strongly interacting with quantum fields in optical devices. The theory has been derived from the rela…
Strong coupling electron-photon dynamics: a real-time investigation of energy redistribution in molecular polaritons
Matteo Castagnola, Marcus T. Lexander, Enrico Ronca +1
We analyze the real-time electron-photon dynamics in long-range polariton-mediated energy transfer using a real-time quantum electrodynamics coupled cluster (RT-QED-CC) model, whic…
Theory of magnetic properties in QED environments: application to molecular aromaticity
Alberto Barlini, Andrea Bianchi, Enrico Ronca +1
In this work, we present ab initio cavity QED methods which include interactions with a static magnetic field and nuclear spin degrees of freedom using different treatments of the…