In this study, we employ a combination of various in-situ surface analysis techniques to investigate the thermally induced degradation processes in MAPbI3 perovskite solar cells (PeSCs) as a function of temperature under air-free conditions (no moisture and oxygen). Through a comprehensive approach that combines in-situ grazing-incidence wide-angle X-ray diffraction (GIWAXD) and high-resolution X-ray photoelectron spectroscopy (HR-XPS) measurements, we confirm that the surface structure of MAPbI3 perovskite film changes to an intermediate phase and decomposes to CH3I, NH3, and PbI2 after both a short (20 min) exposure to heat stress at 100 °C and a long exposure (>1 hour) at 80 °C. Moreover, we observe clearly the changes in the orientation of CH3NH3
+ organic cations with respect to the substrate in the intermediate phase, which might be linked directly to the thermal degradation processes in MAPbI3 perovskites. These results provide important progress towards improved understanding of the thermal degradation mechanisms in perovskite materials and will facilitate improvements in the design and fabrication of perovskite solar cells with better thermal stability.
Graphene
nanoribbons (GNRs) have recently emerged as alternative
2D semiconductors owing to their fascinating electronic properties
that include tunable band gaps and high charge-carrier mobilities.
Identifying the atomic-scale edge structures of GNRs through structural
investigations is very important to fully understand the electronic
properties of these materials. Herein, we report an atomic-scale analysis
of GNRs using simulated X-ray photoelectron spectroscopy (XPS) and
Raman spectroscopy. Tetracene with zigzag edges and chrysene with
armchair edges were selected as initial model structures, and their
XPS and Raman spectra were analyzed. Structurally expanded nanoribbons
based on tetracene and chrysene, in which zigzag and armchair edges
were combined in various ratios, were then simulated. The edge structures
of chain-shaped nanoribbons composed only of either zigzag edges or
armchair edges were distinguishable by XPS and Raman spectroscopy,
depending on the edge type. It was also possible to distinguish planar
nanoribbons consisting of both zigzag and armchair edges with zigzag/armchair
ratios of 4:1 or 1:4, indicating that it is possible to analyze normally
synthesized GNRs because their zigzag to armchair edge ratios are
usually greater than 4 or less than 0.25. Our study on the precise
identification of GNR edge structures by XPS and Raman spectroscopy
provides the groundwork for the analysis of GNRs.
We have investigated the effects of a buffer layer insertion on the performance of the pentacene based thin film transistor with a bottom contact structure. When the pentacene molecules have a standing up coordination on the Au surface that is modified by the benzenethiol or methanethiol, the transition region in the pentacene thin film is removed along the boundary between the Au and silicon oxide region, and the hole-injection barrier decreases by 0.4eV. Pentacene on various surfaces showed that the highly occupied molecular level is 0.2–0.4eV lower in the standing up coordination than in the lying down coordination.
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