Kerr nonlinearity in cavity-enhanced conical-intersection-driven singlet fission

Y Youhao Chang (School of Science, Hangzhou Dianzi University 1 , Hangzhou 310018,) K Kewei Sun M Maxim F. Gelin (School of Science, Hangzhou Dianzi University 1 , Hangzhou 310018,) Y Yang Zhao

Abstract

We theoretically investigate the impact of Kerr nonlinearity on the cavity-enhanced conical-intersection-driven singlet fission (SF) process using the numerically accurate multiple Davydov Ansatz method. Our results show that the Kerr effect significantly influences the SF dynamics. However, the enhancement of the SF yield requires concerted fine-tuning of the system and cavity parameters and also depends significantly on the initial preparation of the SF system. We argue that optimizing light–matter coupling, Kerr interaction, and initial photon pumping is promising for designing efficient cavity-controlled singlet fission systems for photovoltaic applications.

Article Details

Volume / Issue Vol. 163, Issue 2
Published July 14, 2025
ISSN 0021-9606
Publisher American Institute of Physics

Journal Info

The Journal of Chemical Physics

American Institute of Physics

ISSN: 0021-9606 Physical Sciences

Authors (4)

Y

Youhao Chang

School of Science, Hangzhou Dianzi University 1 , Hangzhou 310018,

K

Kewei Sun

M

Maxim F. Gelin

School of Science, Hangzhou Dianzi University 1 , Hangzhou 310018,

Y

Yang Zhao