A coupled cluster protocol rooted in damped response theory is presented for computing Resonant Inelastic X-ray Scattering spectra of molecules in gas-phase. Working equations are reported for both linear (i.e., equation-of-motion) and nonlinear parametrizations of the coupled-cluster wave function response. A simple scheme to compute nonresonant X-ray Emission Spectra is also proposed. Illustrative results are presented for water.
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Faber et al. (2018) studied this question.
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