Peak shape analysis of core level photoelectron spectra using UNIFIT for WINDOWS

Abstract

Several approaches used in the peak shape analysis of core level spectra for the purpose of modelling of both peak shapes and background profiles will be discussed. A universal program is presented, which combines options for adequate modelling of the peak shapes and background, implementation of a successful numerical algorithm for an iterative non-linear parameter estimation procedure, and a flexible as well as convenient data handling. The performance of this program code is demonstrated by fitting a synthesized model spectrum. An example for analysis of a complex experimental spectrum is presented, too. An S 2p spectrum recorded from a MBT-treated pyrite surface is successfully analyzed using the presented software and is found to be characterized by five different S 2p contributions.