Prévot Geoffroy, Hogan Conor, Leoni Thomas, Bernard Romain, Moyen Eric, Masson Laurence
Sorbonne Universités, UPMC Université Paris 06, CNRS-UMR 7588, Institut des NanoSciences de Paris, F-75005 Paris, France.
CNR-Istituto di Struttura della Materia, Via Fosso del Cavaliere 100, 00133 Rome, Italy and Dipartimento di Fisica, Università di Rome "Tor Vergata," Via della Ricerca Scientifica 1, 00133 Rome, Italy.
Phys Rev Lett. 2016 Dec 30;117(27):276102. doi: 10.1103/PhysRevLett.117.276102. Epub 2016 Dec 28.
We report a combined grazing incidence x-ray diffraction (GIXD), scanning tunneling microscopy (STM), and density-functional theory (DFT) study which clearly elucidates the atomic structure of the Si nanoribbons grown on the missing-row reconstructed Ag(110) surface. Our study allows us to discriminate between the theoretical models published in the literature, including the most stable atomic configurations and those based on a missing-row reconstructed Ag(110) surface. GIXD measurements unambiguously validate the pentamer model grown on the reconstructed surface, obtained from DFT. This pentamer atomistic model accurately matches the high-resolution STM images of the Si nanoribbons adsorbed on Ag(110). Our study closes the long-debated atomic structure of the Si nanoribbons grown on Ag(110) and definitively excludes a honeycomb structure similar to that of freestanding silicene.
我们报告了一项结合掠入射X射线衍射(GIXD)、扫描隧道显微镜(STM)和密度泛函理论(DFT)的研究,该研究清晰地阐明了在缺失行重构的Ag(110)表面上生长的硅纳米带的原子结构。我们的研究使我们能够区分文献中发表的理论模型,包括最稳定的原子构型以及基于缺失行重构的Ag(110)表面的模型。GIXD测量明确验证了从DFT获得的在重构表面上生长的五聚体模型。这个五聚体原子模型与吸附在Ag(110)上的硅纳米带的高分辨率STM图像精确匹配。我们的研究解决了长期以来关于在Ag(110)上生长的硅纳米带的原子结构的争论,并明确排除了类似于独立硅烯的蜂窝状结构。