论文标题
石墨烯的结构和在rhenium(0001)表面生长的表面碳化物的结构
Structure of graphene and a surface carbide grown on the (0001) surface of rhenium
论文作者
论文摘要
过渡金属表面催化涉及含碳物种的热激活反应 - 从原子碳到小碳氢化合物或有机分子和聚合物。这些反应产生了分离良好的相位,例如石墨烯和金属表面,或相反的合金相,例如金属碳化物。在这里,我们研究了rhenium(0001)表面上的碳相,以前的相可以转化为后者。我们发现这种转化是随着退火时间的增加而发生的,因此不适合提高石墨烯的质量。我们的扫描隧道光谱和反射高能电子衍射分析表明,重复的短退火循环最适合增加结构相干石墨烯域的横向延伸。使用相同的技术并在密度函数理论计算的支持下,我们接下来在实际空间中揭示了自1970年代以来衍射观察到的rhenium表面碳化物的许多变体(两个六倍)的对称性,并最终提出了原子细节的模型。这些模型之一与显微镜观测非常匹配,由八个对齐的碳三聚体的平行行组成,其$(7 \ times \ sqrt {\ mathrm {19}})$单位单元相对于RE(0001)。
Transition metal surfaces catalyse a broad range of thermally-activated reactions involving carbon-containing-species -- from atomic carbon to small hydrocarbons or organic molecules, and polymers. These reactions yield well-separated phases, for instance graphene and the metal surface, or, on the contrary, alloyed phases, such as metal carbides. Here, we investigate carbon phases on a rhenium (0001) surface, where the former kind of phase can transform into the latter. We find that this transformation occurs with increasing annealing time, which is hence not suitable to increase the quality of graphene. Our scanning tunneling spectroscopy and reflection high-energy electron diffraction analysis reveal that repeated short annealing cycles are best suited to increase the lateral extension of the structurally coherent graphene domains. Using the same techniques and with the support of density functional theory calculations, we next unveil, in real space, the symmetry of the many variants (two six-fold families) of a rhenium surface carbide observed with diffraction since the 1970s, and finally propose models of the atomic details. One of these models, which nicely matches the microscopy observations, consists of parallel rows of eight aligned carbon trimers with a so-called $(7\times\sqrt{\mathrm{19}})$ unit cell with respect to Re(0001).