Electronic Structure of Titanylphthalocyanine Layers on Ag(111)

We have investigated the electronic structures of axially oxo functionalized titanylphthalocyanine (TiOPc) on Ag(111) by X-ray and ultraviolet photoelectron spectroscopies, two-photon photoemission, X-ray absorption spectroscopy, and X-ray magnetic circular dichroism. Furthermore, we use complementa...

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Detalles Bibliográficos
Autores: Lerch, A., Fernández, L., Ilyn, Maxim|||0000-0002-4052-7275, Gastaldo, Michele|||0000-0002-8900-8257, Paradinas, Markos|||0000-0003-1006-9506, Valbuena, Miguel Ángel|||0000-0002-0585-5636, Mugarza, Aitor|||0000-0002-2698-885X, Ibrahim, A. B. M., Sundermeyer, J., Höfer, U., Schiller, Frederik|||0000-0003-1727-3542
Tipo de recurso: artículo
Fecha de publicación:2017
País:España
Institución:Universitat Autònoma de Barcelona
Repositorio:Dipòsit Digital de Documents de la UAB
Idioma:inglés
OAI Identifier:oai:ddd.uab.cat:225315
Acceso en línea:https://ddd.uab.cat/record/225315
https://dx.doi.org/urn:doi:10.1021/acs.jpcc.7b09147
Access Level:acceso abierto
Palabra clave:Comparative analysis
Copper phthalocyanine
Lowest unoccupied molecular orbital
Metal interactions
Parallel orientation
Two-photon photoemission
Ultraviolet photoemission spectroscopy
X-ray magnetic circular dichroism
Descripción
Sumario:We have investigated the electronic structures of axially oxo functionalized titanylphthalocyanine (TiOPc) on Ag(111) by X-ray and ultraviolet photoelectron spectroscopies, two-photon photoemission, X-ray absorption spectroscopy, and X-ray magnetic circular dichroism. Furthermore, we use complementary data of TiOPc on graphite and planar copper phthalocyanine (CuPc) on Ag(111) for a comparative analysis. Both molecules adsorb on Ag(111) in a parallel orientation to the surface, for TiOPc with an oxygen-up configuration. The interaction of nitrogen and carbon atoms with the substrate is similar for both molecules, while the bonding of the titanium atom to Ag(111) in the monolayer is found to be slightly more pronounced than in the CuPc case. Ultraviolet photoemission spectroscopy reveals an occupation of the lowest unoccupied molecular orbital (LUMO) level in monolayer thick TiOPc on Ag(111) related to the interaction of the molecules and the silver substrate. This molecule-metal interaction also causes an upward shift of the Ag(111) Shockley state that is transformed into an unoccupied interface state with energies of 0.23 and 0.33 eV for the TiOPc monolayer and bilayer, respectively, at the Brillouin zone center.