Hybridization and bond-orbital components in site-specific X-ray photoelectron spectra of rutile TiO2.
نویسندگان
چکیده
We have determined the Ti and O components of the rutile TiO2 valence band using the method of site-specific x-ray photoelectron spectroscopy. Comparisons with calculations based on pseudopotentials within the local density approximation reveal the hybridization of the Ti 3d, 4s, and 4p states, and the O 2s and 2p states on each site. These chemical effects are observed due to the large differences between the angular-momentum dependent matrix elements of the photoelectron process.
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ورودعنوان ژورنال:
- Physical review letters
دوره 89 7 شماره
صفحات -
تاریخ انتشار 2002