Molecular and electronic structure of osmium complexes confined to Au(111) surfaces using a self-assembled molecular bridge
The molecular and electronic structure of Os(II) complexes covalently bonded to self-assembled monolayers (SAMs) on Au(111) surfaces was studied by means of polarization modulation infrared reflection absorption spectroscopy, photoelectron spectroscopies, scanning tunneling microscopy, scanning tunn...
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2015
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| Acceso en línea: | https://bibliotecadigital.exactas.uba.ar/collection/paper/document/paper_00219606_v143_n18_p_DeLaLlave http://hdl.handle.net/20.500.12110/paper_00219606_v143_n18_p_DeLaLlave |
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paper:paper_00219606_v143_n18_p_DeLaLlave2023-06-08T14:44:27Z Molecular and electronic structure of osmium complexes confined to Au(111) surfaces using a self-assembled molecular bridge Absorption spectroscopy Density functional theory Electronic structure Molecular orbitals Photoelectron spectroscopy Scanning tunneling microscopy Self assembled monolayers Au(111) surfaces Bipyridine ligands Covalently bonded Highest occupied molecular orbital Molecular bridges Osmium complexes Polarization modulation infrared reflection absorption spectroscopy Scanning tunneling spectroscopy Osmium compounds The molecular and electronic structure of Os(II) complexes covalently bonded to self-assembled monolayers (SAMs) on Au(111) surfaces was studied by means of polarization modulation infrared reflection absorption spectroscopy, photoelectron spectroscopies, scanning tunneling microscopy, scanning tunneling spectroscopy, and density functional theory calculations. Attachment of the Os complex to the SAM proceeds via an amide covalent bond with the SAM alkyl chain 40° tilted with respect to the surface normal and a total thickness of 26 Å. The highest occupied molecular orbital of the Os complex is mainly based on the Os(II) center located 2.2 eV below the Fermi edge and the LUMO molecular orbital is mainly based on the bipyridine ligands located 1.5 eV above the Fermi edge. © 2015 AIP Publishing LLC. 2015 https://bibliotecadigital.exactas.uba.ar/collection/paper/document/paper_00219606_v143_n18_p_DeLaLlave http://hdl.handle.net/20.500.12110/paper_00219606_v143_n18_p_DeLaLlave |
| institution |
Universidad de Buenos Aires |
| institution_str |
I-28 |
| repository_str |
R-134 |
| collection |
Biblioteca Digital - Facultad de Ciencias Exactas y Naturales (UBA) |
| topic |
Absorption spectroscopy Density functional theory Electronic structure Molecular orbitals Photoelectron spectroscopy Scanning tunneling microscopy Self assembled monolayers Au(111) surfaces Bipyridine ligands Covalently bonded Highest occupied molecular orbital Molecular bridges Osmium complexes Polarization modulation infrared reflection absorption spectroscopy Scanning tunneling spectroscopy Osmium compounds |
| spellingShingle |
Absorption spectroscopy Density functional theory Electronic structure Molecular orbitals Photoelectron spectroscopy Scanning tunneling microscopy Self assembled monolayers Au(111) surfaces Bipyridine ligands Covalently bonded Highest occupied molecular orbital Molecular bridges Osmium complexes Polarization modulation infrared reflection absorption spectroscopy Scanning tunneling spectroscopy Osmium compounds Molecular and electronic structure of osmium complexes confined to Au(111) surfaces using a self-assembled molecular bridge |
| topic_facet |
Absorption spectroscopy Density functional theory Electronic structure Molecular orbitals Photoelectron spectroscopy Scanning tunneling microscopy Self assembled monolayers Au(111) surfaces Bipyridine ligands Covalently bonded Highest occupied molecular orbital Molecular bridges Osmium complexes Polarization modulation infrared reflection absorption spectroscopy Scanning tunneling spectroscopy Osmium compounds |
| description |
The molecular and electronic structure of Os(II) complexes covalently bonded to self-assembled monolayers (SAMs) on Au(111) surfaces was studied by means of polarization modulation infrared reflection absorption spectroscopy, photoelectron spectroscopies, scanning tunneling microscopy, scanning tunneling spectroscopy, and density functional theory calculations. Attachment of the Os complex to the SAM proceeds via an amide covalent bond with the SAM alkyl chain 40° tilted with respect to the surface normal and a total thickness of 26 Å. The highest occupied molecular orbital of the Os complex is mainly based on the Os(II) center located 2.2 eV below the Fermi edge and the LUMO molecular orbital is mainly based on the bipyridine ligands located 1.5 eV above the Fermi edge. © 2015 AIP Publishing LLC. |
| title |
Molecular and electronic structure of osmium complexes confined to Au(111) surfaces using a self-assembled molecular bridge |
| title_short |
Molecular and electronic structure of osmium complexes confined to Au(111) surfaces using a self-assembled molecular bridge |
| title_full |
Molecular and electronic structure of osmium complexes confined to Au(111) surfaces using a self-assembled molecular bridge |
| title_fullStr |
Molecular and electronic structure of osmium complexes confined to Au(111) surfaces using a self-assembled molecular bridge |
| title_full_unstemmed |
Molecular and electronic structure of osmium complexes confined to Au(111) surfaces using a self-assembled molecular bridge |
| title_sort |
molecular and electronic structure of osmium complexes confined to au(111) surfaces using a self-assembled molecular bridge |
| publishDate |
2015 |
| url |
https://bibliotecadigital.exactas.uba.ar/collection/paper/document/paper_00219606_v143_n18_p_DeLaLlave http://hdl.handle.net/20.500.12110/paper_00219606_v143_n18_p_DeLaLlave |
| _version_ |
1768546052991877120 |