Photoinduced Electronic Band Dynamics and Defect-mediated Surface Potential Evolution in PdSe$_2$

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Main Authors: Abdul-Aziz, Omar, Tuniz, Manuel, Bronsch, Wibke, Parmigiani, Fulvio, Cilento, Federico, Wolverson, Daniel, Sayers, Charles J., Cerullo, Giulio, Dallera, Claudia, Carpene, Ettore, van Loosdrecht, Paul H. M., Hedayat, Hamoon
Format: Preprint
Published: 2025
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author Abdul-Aziz, Omar
Tuniz, Manuel
Bronsch, Wibke
Parmigiani, Fulvio
Cilento, Federico
Wolverson, Daniel
Sayers, Charles J.
Cerullo, Giulio
Dallera, Claudia
Carpene, Ettore
van Loosdrecht, Paul H. M.
Hedayat, Hamoon
author_facet Abdul-Aziz, Omar
Tuniz, Manuel
Bronsch, Wibke
Parmigiani, Fulvio
Cilento, Federico
Wolverson, Daniel
Sayers, Charles J.
Cerullo, Giulio
Dallera, Claudia
Carpene, Ettore
van Loosdrecht, Paul H. M.
Hedayat, Hamoon
contents We use time- and angle-resolved photoemission spectroscopy (TR-ARPES) combined with density functional theory to investigate ultrafast carrier dynamics in low-symmetry layered semiconducting PdSe$_2$. The indirect bandgap is determined to be 0.55~eV. Following photoexcitation above this gap, we resolve a valence band shift and broadening, both lasting less than a picosecond, consistent with bandgap renormalization and carrier scattering, indicative of strong many-body interactions. Subsequently, hot carriers populate the conduction band minimum and are captured by defect states. A surface photovoltage (SPV) of $\sim$ 67~meV emerges, persisting for over 50~ps, driven by defect-assisted charge separation. The formation of native vacancies, promoted by the low-symmetry lattice, likely gives rise to the mid-gap states responsible for this long-lived SPV response. Detailed analysis of TR-ARPES spectra disentangles the contributions of bandgap renormalization, carrier scattering, defect states, and SPV. These findings establish PdSe$_2$ as a prototypical layered quantum material exhibiting exotic photoresponses on ultrafast timescales.
format Preprint
id arxiv_https___arxiv_org_abs_2510_26011
institution arXiv
publishDate 2025
record_format arxiv
spellingShingle Photoinduced Electronic Band Dynamics and Defect-mediated Surface Potential Evolution in PdSe$_2$
Abdul-Aziz, Omar
Tuniz, Manuel
Bronsch, Wibke
Parmigiani, Fulvio
Cilento, Federico
Wolverson, Daniel
Sayers, Charles J.
Cerullo, Giulio
Dallera, Claudia
Carpene, Ettore
van Loosdrecht, Paul H. M.
Hedayat, Hamoon
Mesoscale and Nanoscale Physics
Strongly Correlated Electrons
We use time- and angle-resolved photoemission spectroscopy (TR-ARPES) combined with density functional theory to investigate ultrafast carrier dynamics in low-symmetry layered semiconducting PdSe$_2$. The indirect bandgap is determined to be 0.55~eV. Following photoexcitation above this gap, we resolve a valence band shift and broadening, both lasting less than a picosecond, consistent with bandgap renormalization and carrier scattering, indicative of strong many-body interactions. Subsequently, hot carriers populate the conduction band minimum and are captured by defect states. A surface photovoltage (SPV) of $\sim$ 67~meV emerges, persisting for over 50~ps, driven by defect-assisted charge separation. The formation of native vacancies, promoted by the low-symmetry lattice, likely gives rise to the mid-gap states responsible for this long-lived SPV response. Detailed analysis of TR-ARPES spectra disentangles the contributions of bandgap renormalization, carrier scattering, defect states, and SPV. These findings establish PdSe$_2$ as a prototypical layered quantum material exhibiting exotic photoresponses on ultrafast timescales.
title Photoinduced Electronic Band Dynamics and Defect-mediated Surface Potential Evolution in PdSe$_2$
topic Mesoscale and Nanoscale Physics
Strongly Correlated Electrons
url https://arxiv.org/abs/2510.26011