001     153644
005     20221213131507.0
024 7 _ |a 10.1088/1367-2630/15/3/033017
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037 _ _ |a FZJ-2014-03149
082 _ _ |a 530
100 1 _ |a Willenbockel, M.
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245 _ _ |a Energy offsets within a molecular monolayer: the influence of the molecular environment
260 _ _ |a [Bad Honnef]
|c 2013
|b Dt. Physikalische Ges.
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520 _ _ |a The compressed 3,4,9,10-perylene tetracarboxylic dianhydride (PTCDA) herringbone monolayer structure on Ag(110) is used as a model system to investigate the role of molecule–molecule interactions at metal–organic interfaces. By means of the orbital tomography technique, we can not only distinguish the two inequivalent molecules in the unit cell but also resolve their different energy positions for the highest occupied and the lowest unoccupied molecular orbitals. Density functional theory calculations of a freestanding PTCDA layer identify the electrostatic interaction between neighboring molecules, rather than the adsorption site, as the main reason for the molecular level splitting observed experimentally.
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700 1 _ |a Stadtmüller, B.
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700 1 _ |a Schönauer, K.
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700 1 _ |a Posseik, Francois
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700 1 _ |a Lüftner, D.
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700 1 _ |a Reinisch, E. M.
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700 1 _ |a Ules, T.
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700 1 _ |a Koller, G.
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700 1 _ |a Kumpf, C.
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700 1 _ |a Subach, Sergey
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700 1 _ |a Puschnig, P.
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700 1 _ |a Ramsey, M. G.
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700 1 _ |a Tautz, Frank Stefan
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773 _ _ |a 10.1088/1367-2630/15/3/033017
|g Vol. 15, no. 3, p. 033017 -
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|t New journal of physics
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|x 1367-2630
856 4 _ |y Publishers version according to licensing conditions.
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856 4 _ |u https://juser.fz-juelich.de/record/153644/files/FZJ-2014-03149.pdf
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914 1 _ |y 2014
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