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Adsorption Behavior of Nonplanar Phthalocyanines: Competition of Different Adsorption Conformations

[Image: see text] Using density functional theory augmented with state-of-the-art van der Waals corrections, we studied the geometric and electronic properties of nonplanar chlorogallium-phthalocyanine GaClPc molecules adsorbed on Cu(111). Comparing these results with published experimental data for...

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Wedi'i Gadw mewn:
Manylion Llyfryddiaeth
Cyhoeddwyd yn:J Phys Chem C Nanomater Interfaces
Prif Awduron: Wruss, Elisabeth, Hofmann, Oliver T., Egger, David A., Verwüster, Elisabeth, Gerlach, Alexander, Schreiber, Frank, Zojer, Egbert
Fformat: Artigo
Iaith:Inglês
Cyhoeddwyd: American Chemical Society 2016
Mynediad Ar-lein:https://ncbi.nlm.nih.gov/pmc/articles/PMC4819946/
https://ncbi.nlm.nih.gov/pubmed/27066160
https://ncbi.nlm.nih.govhttp://dx.doi.org/10.1021/acs.jpcc.6b00312
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