Please use this identifier to cite or link to this item: https://doi.org/10.1063/1.2730787
Title: Resonant processes and Coulomb interactions in (C59 N)2
Authors: Schulte, K.
Wang, L. 
Moriarty, P.J.
Prassides, K.
Tagmatarchis, N.
Issue Date: 2007
Citation: Schulte, K., Wang, L., Moriarty, P.J., Prassides, K., Tagmatarchis, N. (2007). Resonant processes and Coulomb interactions in (C59 N)2. Journal of Chemical Physics 126 (18) : -. ScholarBank@NUS Repository. https://doi.org/10.1063/1.2730787
Abstract: We have determined the on-site molecular Coulomb interaction energy U of a (C59 N)2 bulk film and find values ranging from 1.10±0.10 eV for the highest occupied molecular orbital to 1.35±0.10 eV for the deeper lying orbitals, comparable to values found in C60. The on-site Coulomb interaction between a carbon core hole and valence electrons, Uc, is, however, substantially lower than in C60 at 1.35±0.07 eV. Resonant photoemission (RESPES) results show a weakened participator decay channel, especially around the N 1s threshold, where resonance of the highest occupied molecular orbital shoulder is absent. Near-edge x-ray absorption fine structure and constant initial state measurements, taken in parallel with the RESPES data, indicate, however, that matrix element effects cannot be ruled out. © 2007 American Institute of Physics.
Source Title: Journal of Chemical Physics
URI: http://scholarbank.nus.edu.sg/handle/10635/97814
ISSN: 00219606
DOI: 10.1063/1.2730787
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