Multiple scattering approach to photoemmsion from adsorbed molecules on metal surfaces

  • Komiya Naoki
    Graduate School of Advanced Integration Science, Chiba University
  • Niki Kaori
    Graduate School of Advanced Integration Science, Chiba University

Bibliographic Information

Other Title
  • 多重散乱理論による金属基板上の分子からの光電子放出に関する研究

Description

In this work, we discuss the effect of Pd atoms on photoemission from the 4σ orbital of CO molecules on Pd(111), especially caused by the variation in initial state wave functions and scattering of photoelectrons.<br><br>The initial state wave functions are analysed by the quantum chemistry software "Gaussian" with using the effective core potential method.<br>We newly developed a program to compute photoemssion spectra with SCF calculation<br>results obtained by above Gaussian calculations.

Journal

Details 詳細情報について

  • CRID
    1390845713021364480
  • NII Article ID
    130007519020
  • DOI
    10.14886/sssj2008.2018.0_140
  • Text Lang
    ja
  • Data Source
    • JaLC
    • CiNii Articles
  • Abstract License Flag
    Disallowed

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