Exploring ultra-fast charge transfer and vibronic coupling with N 1s RIXS maps of an aromatic molecule coupled to a semiconductor

We present for the first time two-dimensional resonant inelastic x-ray scattering (RIXS) maps of multilayer and monolayer biisonicotinic acid adsorbed on the rutile TiO2(110) single crystal surface. This enables the elastic channel to be followed over the lowest unoccupied molecular orbitals resonan...

Full description

Bibliographic Details
Main Authors: O'Shea, James N., Handrup, Karsten, Temperton, Robert H., Gibson, Andrew J., Nicolaou, Alessandro, Jaouen, Nicolas
Format: Article
Published: American Institute of Physics 2017
Online Access:https://eprints.nottingham.ac.uk/47208/
_version_ 1848797490194677760
author O'Shea, James N.
Handrup, Karsten
Temperton, Robert H.
Gibson, Andrew J.
Nicolaou, Alessandro
Jaouen, Nicolas
author_facet O'Shea, James N.
Handrup, Karsten
Temperton, Robert H.
Gibson, Andrew J.
Nicolaou, Alessandro
Jaouen, Nicolas
author_sort O'Shea, James N.
building Nottingham Research Data Repository
collection Online Access
description We present for the first time two-dimensional resonant inelastic x-ray scattering (RIXS) maps of multilayer and monolayer biisonicotinic acid adsorbed on the rutile TiO2(110) single crystal surface. This enables the elastic channel to be followed over the lowest unoccupied molecular orbitals resonantly excited at the N 1s absorption edge. The data also reveals ultra-fast intramolecular vibronic coupling, particularly during excitation into the LUMO-derived resonance. Both elastic scattering and the vibronic coupling loss features are expected to contain the channel in which the originally excited electron is directly involved in the core-hole decay process. This allows RIXS data for a molecule coupled to a wide bandgap semiconductor to be considered in the same way as the core-hole clock implementation of resonant photoemission spectroscopy (RPES). However, contrary to RPES measurements, we find no evidence for depletion of the participator channel under the conditions of ultra-fast charge transfer from the molecule to the substrate densities of states, on the timescale of the core-hole lifetime. These results suggest that the radiative core-hole decay processes in RIXS are not significantly modified by charge transfer on the femtosecond timescale in this system.
first_indexed 2025-11-14T20:04:42Z
format Article
id nottingham-47208
institution University of Nottingham Malaysia Campus
institution_category Local University
last_indexed 2025-11-14T20:04:42Z
publishDate 2017
publisher American Institute of Physics
recordtype eprints
repository_type Digital Repository
spelling nottingham-472082020-05-04T19:11:05Z https://eprints.nottingham.ac.uk/47208/ Exploring ultra-fast charge transfer and vibronic coupling with N 1s RIXS maps of an aromatic molecule coupled to a semiconductor O'Shea, James N. Handrup, Karsten Temperton, Robert H. Gibson, Andrew J. Nicolaou, Alessandro Jaouen, Nicolas We present for the first time two-dimensional resonant inelastic x-ray scattering (RIXS) maps of multilayer and monolayer biisonicotinic acid adsorbed on the rutile TiO2(110) single crystal surface. This enables the elastic channel to be followed over the lowest unoccupied molecular orbitals resonantly excited at the N 1s absorption edge. The data also reveals ultra-fast intramolecular vibronic coupling, particularly during excitation into the LUMO-derived resonance. Both elastic scattering and the vibronic coupling loss features are expected to contain the channel in which the originally excited electron is directly involved in the core-hole decay process. This allows RIXS data for a molecule coupled to a wide bandgap semiconductor to be considered in the same way as the core-hole clock implementation of resonant photoemission spectroscopy (RPES). However, contrary to RPES measurements, we find no evidence for depletion of the participator channel under the conditions of ultra-fast charge transfer from the molecule to the substrate densities of states, on the timescale of the core-hole lifetime. These results suggest that the radiative core-hole decay processes in RIXS are not significantly modified by charge transfer on the femtosecond timescale in this system. American Institute of Physics 2017-10-06 Article PeerReviewed O'Shea, James N., Handrup, Karsten, Temperton, Robert H., Gibson, Andrew J., Nicolaou, Alessandro and Jaouen, Nicolas (2017) Exploring ultra-fast charge transfer and vibronic coupling with N 1s RIXS maps of an aromatic molecule coupled to a semiconductor. Journal of Chemical Physics, 147 (13). 134705/1-134705/6. ISSN 1089-7690 http://dx.doi.org/10.1063/1.4999135 doi:10.1063/1.4999135 doi:10.1063/1.4999135
spellingShingle O'Shea, James N.
Handrup, Karsten
Temperton, Robert H.
Gibson, Andrew J.
Nicolaou, Alessandro
Jaouen, Nicolas
Exploring ultra-fast charge transfer and vibronic coupling with N 1s RIXS maps of an aromatic molecule coupled to a semiconductor
title Exploring ultra-fast charge transfer and vibronic coupling with N 1s RIXS maps of an aromatic molecule coupled to a semiconductor
title_full Exploring ultra-fast charge transfer and vibronic coupling with N 1s RIXS maps of an aromatic molecule coupled to a semiconductor
title_fullStr Exploring ultra-fast charge transfer and vibronic coupling with N 1s RIXS maps of an aromatic molecule coupled to a semiconductor
title_full_unstemmed Exploring ultra-fast charge transfer and vibronic coupling with N 1s RIXS maps of an aromatic molecule coupled to a semiconductor
title_short Exploring ultra-fast charge transfer and vibronic coupling with N 1s RIXS maps of an aromatic molecule coupled to a semiconductor
title_sort exploring ultra-fast charge transfer and vibronic coupling with n 1s rixs maps of an aromatic molecule coupled to a semiconductor
url https://eprints.nottingham.ac.uk/47208/
https://eprints.nottingham.ac.uk/47208/
https://eprints.nottingham.ac.uk/47208/