Two-dimensional delocalized states in organometallic bis-acetylide networks on Ag(111)

The electronic structure of surface-supported organometallic networks with Ag-bis-acetylide bonds that are intermediate products in the bottom-up synthesis of graphdiyne and graphdiyne-like networks were studied. Scanning tunneling microscopy (STM) and spectroscopy (STS) reveal a frontier, unoccupie...

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Veröffentlicht in:Nanoscale 2018-02, Vol.10 (8), p.3769-3776
Hauptverfasser: Yang, Zechao, Gebhardt, Julian, Schaub, Tobias A, Sander, Tim, Schönamsgruber, Jörg, Soni, Himadri, Görling, Andreas, Kivala, Milan, Maier, Sabine
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container_end_page 3776
container_issue 8
container_start_page 3769
container_title Nanoscale
container_volume 10
creator Yang, Zechao
Gebhardt, Julian
Schaub, Tobias A
Sander, Tim
Schönamsgruber, Jörg
Soni, Himadri
Görling, Andreas
Kivala, Milan
Maier, Sabine
description The electronic structure of surface-supported organometallic networks with Ag-bis-acetylide bonds that are intermediate products in the bottom-up synthesis of graphdiyne and graphdiyne-like networks were studied. Scanning tunneling microscopy (STM) and spectroscopy (STS) reveal a frontier, unoccupied electronic state that is delocalized along the entire organometallic network and proves the covalent nature of the Ag-bis-acetylide bonds. Density-functional theory (DFT) calculations corroborate the spatial distribution of the observed delocalized state and attribute it to band mixing of carbon and silver atoms combined with n-doping of the metal surface. The metal-bis-acetylide bonds are typical metal-organic bonds with mixed character containing covalent and strong ionic contributions. Moreover, the organometallic networks exhibit a characteristic graphene-like band structure with linear band dispersion at each K point.
doi_str_mv 10.1039/c7nr08238j
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source Royal Society Of Chemistry Journals 2008-
subjects Bonding strength
Chemical bonds
Density functional theory
Electron states
Electronic structure
Networks
Silver
Spatial distribution
title Two-dimensional delocalized states in organometallic bis-acetylide networks on Ag(111)
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