Abstract
The sudden approximation is used to calculate the position and intensity of satellites accompanying core ionization in a series of molecules utilizing wavefunctions calculated in the INDO approximation. The results show semi-quantitative agreement with experiment and allow the assignment of various satellites to particular excitations accompanying primary ionization (shake-up). It is shown that in the case of degenerate hole states a localized hole state approximation is needed in order to interpret the satellites.
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Schedule a callMore From: Journal of the Chemical Society, Faraday Transactions 2
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