ICP2023

Presentation information

Contributed Oral

New Concepts and Methods in Theoretical Photochemistry

S8-2,3

Fri. Jul 28, 2023 11:25 AM - 11:55 AM RoomD (RoomD)

Chair:Yasutaka Kitagawa

11:25 AM - 11:40 AM

[S8-02-CL] Modeling ultrafast charge-transfer in organic photovoltaic materials from first-principles: the role of quantum vibrations, environment disorder and light pulse shape

*Elisa Palacino Gonzalez1, Thomas la Cour Jansen1 (1. University of Groningen (Netherlands))

Keywords:functional energy materials, theoretical spectroscopy, first-principles modeling, charge-transfer, quantum dynamics

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