Role of preferential weak hybridization between the surface-state of a metal and the oxygen atom in the chemical adsorption mechanism.

نویسندگان

  • Yong Su Kim
  • Sang Ho Jeon
  • Aaron Bostwick
  • Eli Rotenberg
  • Philip N Ross
  • Andrew L Walter
  • Young Jun Chang
  • Vojislav R Stamenkovic
  • Nenad M Markovic
  • Tae Won Noh
  • Seungwu Han
  • Bongjin Simon Mun
چکیده

We report on the chemical adsorption mechanism of atomic oxygen on the Pt(111) surface using angle-resolved-photoemission spectroscopy (ARPES) and density functional calculations. The detailed band structure of Pt(111) from ARPES reveals that most of the bands near the Fermi level are surface-states. By comparing band maps of Pt and O/Pt, we identify that dxz (dyz) and dz(2) orbitals are strongly correlated in the surface-states around the symmetry point M and K, respectively. Additionally, we demonstrate that the s- or p-orbital of oxygen atoms hybridizes preferentially with the dxz (dyz) orbital near the M symmetry point. This weak hybridization occurs with minimal charge transfer.

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عنوان ژورنال:
  • Physical chemistry chemical physics : PCCP

دوره 15 43  شماره 

صفحات  -

تاریخ انتشار 2013