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Advanced functional materials v.28 no.28, 2018년, pp.1800716 -   

Dynamic Photoswitching of Electron Energy Levels at Hybrid ZnO/Organic Photochromic Molecule Junctions

Wang, Qiankun (Institut für Physik & IRIS Adlershof, Humboldt‐Universität zu Berlin, Brook‐Taylor‐Str. 6, 12489, Berlin, Germany ) ; Ligorio, Giovanni (Institut für Physik, Institut für Chemie & IRIS Adlershof, Humboldt‐Universität zu Berlin, Brook‐Taylor‐Str. 6, 12489, Berlin, Germany ) ; Diez‐Cabanes, Valentin (Laboratory for Chemistry of Novel Materials, University of Mons, Place du Parc 20, B‐7000, Mons, Belgium ) ; Cornil, David (Laboratory for Chemistry of Novel Materials, University of Mons, Place du Parc 20, B‐7000, Mons, Belgium ) ; Kobin, Björn (Department of Chemistry & IRIS Adlershof, Humboldt‐Universität zu Berlin, Brook‐Taylor‐Str. 2, 12489, Berlin, Germany ) ; Hildebrandt, Jana (Department of Chemistry & IRIS Adlershof, Humboldt‐Universität zu Berlin, Brook‐Taylor‐Str ) ; Nardi, Marco Vittorio ; Timpel, Melanie ; Hecht, Stefan ; Cornil, Jérôme ; List‐Kratochvil, Emil J. W. ; Koch, Norbert ;
  • 초록  

    Abstract The functionality of interfaces in hybrid inorganic/organic (opto)electronic devices is determined by the alignment of the respective frontier energy levels at both sides of the heterojunctions. Controlling the interface electronic landscape is a key element for achieving favourable level alignment for energy and charge transfer processes. Here, it is shown that the electronic properties of polar ZnO surfaces can be reversibly modified using organic photochromic switches. By employing a range of surface characterization techniques combined with density functional theory calculations, it is demonstrated that self‐assembled monolayers (SAMs) of photochromic phosphonic acid diarylethenes (PA‐DAEs) can be employed to reversibly change the electronic properties of polar ZnO/SAM structures by light stimuli. The highest occupied molecular orbital level of PA‐DAE is raised by 0.7 eV and the lowest unoccupied one lowered by 0.9 eV, respectively, upon illumination by ultraviolet light and the levels shift back to their original position upon illumination by green light. The results thus provide a pathway to tailor hybrid interface electronic properties in a dynamic manner upon simple light illumination, which can be exploited to reversibly tune the electrical properties of photoswitchable (opto)electronic devices.


  • 주제어

    density functional theory .   energy level alignment .   photochromic switches .   self‐assembled monolayers .   ZnO.  

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