18–20 Nov 2026
📍 IGFAE, Santiago de Compostela
Europe/Madrid timezone

Visualizing Thermally Activated Conical Intersections Governing Non-Radiative Triplet Decay in Ni(II) Porphyrin-Nanographene Conjugates

19 Nov 2026, 18:20
1h 10m
📍 IGFAE, Santiago de Compostela

📍 IGFAE, Santiago de Compostela

Rúa de Xoaquín Díaz de Rábago, 15705 Santiago de Compostela, A Coruña
Poster Poster + Beer

Speaker

Prof. Juan Cabanillas Gonzalez (IMDEA Nanociencia)

Description

Metalloporphyrins based on open-shell transition metals, such as Ni(II), exhibit typically fast excited-state relaxation. In this work, we shed light into the non radiative relaxation mechanism in a panchromatic nanographene-Ni(II) porphyrin conjugate. Variable temperature transient absorption spectroscopy (VTTAS) and global fit analysis are combined to produce a picture of the relaxation pathways.[1,2] The deciphered photophysical scenario comprises an intramolecular fast vibrational relaxation in 1.6 ps and subsequent intersystem crossing in 16 ps, bearing a short temporal window wherein singlets relax to the ground state, as confirmed by a short-lived NIR PL spanning from 850 to 1200 nm. Following intersystem crossing, fast relaxation of the triplet to the ground state proceeds in only 40 ps, almost an order of magnitude faster compared to Ni-based porphyrins. VTTAS combined with global analysis provide further information into this terminal relaxation stage. The results are interpreted in terms of a thermally induced population transfer from the lowest triplet energy level (a T(d,d) state according to DFT calculations) to a vibrationally excited ground state, enabled through a conical intersection of the respective ground and triplet potential energy surfaces. The findings presented herein showcase the remarkable potential of VTTAS in deciphering and quantifying rapid thermally activated relaxation phenomena.

Author

Prof. Juan Cabanillas Gonzalez (IMDEA Nanociencia)

Co-authors

Dr Saul García Orrit (IMDEA Nanociencia) Dr Victor Vega-Mayoral (IMDEA Nanociencia) Prof. Matteo Tommasini (Politecnico di Milano) Prof. Akimitsu Narita (University of Okinawa) Prof. Klaus Mullen (Max-Planck-Institute for Polymer Research)

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