Enhanced Magnetism through Oxygenation of FePc/Ag(110) Monolayer Phases

Iron phthalocyanines (FePc) adsorbed onto a Ag(110) substrate self-assemble into different monolayer phases going from rectangular to different oblique phases, with increasing molecular density. We have investigated the oxygen uptake capability of the different phases and their associated magneto-st...

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Detalles Bibliográficos
Autores: Bartolome, Elena|||0000-0001-5108-0977, Bartolomé, Juan, Sedona, Francesco|||0000-0002-7225-9498, Lobo-Checa, Jorge|||0000-0003-2698-2543, Forrer, Daniel|||0000-0002-1969-3842, Herrero-Albillos, Julia|||0000-0002-0901-8341, Piantek, Marten, Herrero-Martín, Javier|||0000-0003-1986-8128, Betto, Davide, Velez-Fort, Emilio|||0000-0002-0362-0366, García, Luis Miguel, Panighel, Mirco|||0000-0001-8413-5196, Mugarza, Aitor|||0000-0002-2698-885X, Sambi, Mauro|||0000-0002-7105-4001, Bartolomé, Fernando|||0000-0002-0047-1772
Tipo de recurso: artículo
Fecha de publicación:2020
País:España
Institución:Universitat Autònoma de Barcelona
Repositorio:Dipòsit Digital de Documents de la UAB
Idioma:inglés
OAI Identifier:oai:ddd.uab.cat:233986
Acceso en línea:https://ddd.uab.cat/record/233986
https://dx.doi.org/urn:doi:10.1021/acs.jpcc.0c01988
Access Level:acceso abierto
Palabra clave:Iron phthalocyanines
Local density of state
Molecular density
Oxygen intercalation
Phase molecules
Scanning tunneling microscopy and spectroscopy
Steric hindrances
X-ray magnetic circular dichroism
Descripción
Sumario:Iron phthalocyanines (FePc) adsorbed onto a Ag(110) substrate self-assemble into different monolayer phases going from rectangular to different oblique phases, with increasing molecular density. We have investigated the oxygen uptake capability of the different phases and their associated magneto-structural changes. Our study combines scanning tunneling microscopy and spectroscopy (STM/STS), X-ray magnetic circular dichroism (XMCD), and density functional theory (DFT) calculations. STM measurements reveal that the oxygenation reaction of the FePc/Ag(110) generally involves a displacement and a rotation of the molecules, which affects the electronic state of the Fe centers. The oxygen intercalation between FePc and the substrate is greatly obstructed by the steric hindrance in the high-density phases, to the point that a fraction of oblique phase molecules cannot change their position after oxidizing. Depending on the oxidation state and adsoption geometry, the STS spectra show clear differences in the Fe local density of states, which are mirrored in the XAS and XMCD experiments. Particularly, XMCD spectra of the oxidized phases reflect the distribution of FePc species (nonoxygenated, oxygenated-rotated, and oxygenated-unrotated) in the different cases. Sum rule analysis yields the effective spin (mseff) and orbital (mL) magnetic moments of Fe in the different FePc species. Upon oxygenation, the magnetic moment of FePc molecules increases about an order of magnitude, reaching mTOT ∼2.2 μB per Fe atom.