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首页> 外文期刊>The journal of physical chemistry, C. Nanomaterials and interfaces >Self-Metalation of Phthalocyanine Molecules with Silver Surface Atoms by Adsorption on Ag(110)
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Self-Metalation of Phthalocyanine Molecules with Silver Surface Atoms by Adsorption on Ag(110)

机译:通过吸附于Ag(110)的银表面原子与银表面原子的酞菁分子的自熔融化(110)

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摘要

We report that metal-free phthalocyanine (H2PC) Molecules with a central cavity are able to incorporate Ag atoms from an Ag(110) surfaCe thus creating silver phthalocyanine (AgPc). The reaction was investigated by means of scanning tunneling microscopy (STM) under ultrahigh vacuum, and the metalation of H2Pc at the interface was confirmed with X-ray photoelectron spectrokopy.Three different kinds of molecules were found on the surface that are aS.signect to H2Pc, the corresponding dehydrogenated molecules,(Pc), and AgPc. The relativ e amounts of Pc and AgPc increase with increasirig annealing temperature. We suggest that the reaction with Ag atoms from the steps of the surface occurs favorably orily for,already dehydrogenated molecules; thts, the metalation of H2Pc is likely limited by the heatinduced dehydrogenation. DenSity functional theory simutations of the reaction path are presented to corroborate this hypothesis.
机译:我们认为具有中心腔的无金属酞菁(H2PC)分子能够从Ag(110)表面中掺入Ag原子,从而产生银酞菁(AGPC)。 通过在超高真空下扫描隧道显微镜(STM)来研究反应,并用X射线光电子光谱确认界面处的H2PC的金属化。在依泻的表面上发现了不同种类的分子。 H2PC,相应的脱氢分子,(PC)和AGPC。 REDATIV E量的PC和AGPC随着CASSOLIVIG的退火温度而增加。 我们表明,来自表面的步骤的与Ag原子的反应有利地发生了荒谬的分子; THTS,H2PC的金属化可能受散热脱氢的限制。 提出了反应路径的密度函数理论模拟以证实该假设。

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