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- W2029503865 abstract "The two-hole final-state binding energies for the major Auger transitions in CO and ${mathrm{CO}}_{2}$ are calculated with the use of the self-consistent-field $Xensuremath{alpha}$ multiple-scattering (SCF-$Xensuremath{alpha}$-MS) method. A simple modification of Slater's transition-state approach is used, and the results give essentially the same degree of agreement with experiment as more first-principles Hartree-Fock methods. The relative transition intensities for the $mathrm{C}(mathrm{KVV})$ and the $mathrm{O}(mathrm{KVV})$ spectra are calculated and compared both with experimental measurements and Hartree-Fock calculations. The utility of the method lies in the ease to which it can be applied to more-complex systems such as large molecules and clusters of atoms simulating molecules absorbed on surfaces." @default.
- W2029503865 created "2016-06-24" @default.
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- W2029503865 date "1984-01-01" @default.
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- W2029503865 title "Analysis of the major Auger transitions in CO and<mml:math xmlns:mml=http://www.w3.org/1998/Math/MathML display=inline><mml:mrow><mml:msub><mml:mrow><mml:mi mathvariant=normal>CO</mml:mi></mml:mrow><mml:mrow><mml:mn>2</mml:mn></mml:mrow></mml:msub></mml:mrow></mml:math>with the use of the self-consistent-field<mml:math xmlns:mml=http://www.w3.org/1998/Math/MathML display=inline><mml:mi>X</mml:mi><mml:mi>α</mml:mi></mml:math>multiple-scattering method" @default.
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- W2029503865 doi "https://doi.org/10.1103/physreva.29.23" @default.
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