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First principle calculations of core-level binding energy a..:

Olovsson, Weine ; Marten, Tobias ; Holmström, Erik..
Journal of Electron Spectroscopy and Related Phenomena.  178-179 (2010)  - p. 88-99 , 2010
Link: https://doi.org/10.1016/j.elspec.2009.10.007