12–14 Aug 2024
Albano Building 2
Europe/Stockholm timezone

Recent advances in ab initio modeling of molecular polaritons

12 Aug 2024, 17:30
30m
Albano 2: A2301 - Auditorium 3 (104 seats) (Albano Building 2)

Albano 2: A2301 - Auditorium 3 (104 seats)

Albano Building 2

Albanovägen 20, 114 19 Stockholm
Invited Talk Monday Afternoon

Speaker

Prof. Henrik Koch (Norwegian University of Science and Technology, Trondheim, Norway)

Description

Polaritonic and plasmonic chemistry is an interdisciplinary emerging field that presents several challenges and opportunities in chemistry, physics, and engineering. Cavities offer non-invasive ways to modulate and control molecular properties – and study unique states of matter (polaritons). In this talk, I will discuss our recent advances in the theoretical and computational modeling of molecules interacting strongly with quantum fields in optical cavities and metallic nanostructures. I will focus on the new time-dependent implementation that can be used to simulate energy transfer between molecules and up- and down-conversion of photons. If time permits, I will also show our simulations of chiral cavities that open the possibility of controlling enantioselectivity and introducing asymmetry in chemical reactions.

Primary author

Prof. Henrik Koch (Norwegian University of Science and Technology, Trondheim, Norway)

Presentation materials

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