芳香分子在沸石表面的自组装:原子力显微镜和半经验研究

Supramolecular Science Pub Date : 1998-10-01 Epub Date: 1999-02-16 DOI:10.1016/S0968-5677(98)00092-3
Masaharu Komiyama, Takemi Shimaguchi, Minming Gu , Hai-Ming Wu
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引用次数: 2

摘要

用原子力显微镜(AFM)观察了吡啶碱分子吡啶和b-吡啶在天然沸石、黄榴石和静沸石表面的自组装。原子力显微镜(AFM)图像显示自组装层的分子阵列结构为有序的二维(准)六边形晶格结构。利用原子力显微镜(AFM)图像估计了二维层内分子的取向,并利用半经验分子轨道法计算了分子的能量。
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Self-assembly of aromatic molecules over zeolite (0 1 0) surfaces: An AFM and semiempirical study

Self-assembly of pyridine base molecules, pyridine and b-picoline, were observed by atomic force microscopy (AFM) on (0 1 0) surfaces of natural zeolites, heulandite and stilbite, respectively. The molecular array structures of the self-assembled adlayers were determined from the AFM images, and they showed well-ordered, two-dimensional (quasi-) hexagonal lattice structures. Orientations of the molecules within the 2D adlayers were also estimated from the AFM images, and their energetics were calculated by means of a semiempirical molecular orbital method.

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