• 文献标题:   Why graphene growth is very different on the C face than on the Si face of SiC: Insights from surface equilibria and the (3 x 3)-3C-SiC((1)over-bar(1)over-bar(1)over-bar) reconstruction
  • 文献类型:   Article
  • 作  者:   NEMEC L, LAZAREVIC F, RINKE P, SCHEFFLER M, BLUM V
  • 作者关键词:  
  • 出版物名称:   PHYSICAL REVIEW B
  • ISSN:   1098-0121 EI 1550-235X
  • 通讯作者地址:   Max Planck Gesell
  • 被引频次:   6
  • DOI:   10.1103/PhysRevB.91.161408
  • 出版年:   2015

▎ 摘  要

We address the stability of the surface phases that occur on the C side of 3C-SiC((1) over bar(1) over bar(1) over bar) at the onset of graphene formation. In this growth range, experimental reports reveal a coexistence of several surface phases. This coexistence can be explained by a Si-rich model for the unknown (3 x 3) reconstruction, the known (2 x 2)(C) adatom phase, and the graphene-covered (2 x 2)(C) phase. By constructing an ab initio surface phase diagram using a van der Waals corrected density functional, we show that the formation of a well defined interface structure like the "buffer layer" on the Si side is blocked by Si-rich surface reconstructions.