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Figure 3
Comparison of the experimental photoelectron spectra of glycine in the outer valence space with the simulated spectra using the OVGF/TZVP model (bottom, Δ = 0.20 eV) and the SAOP/et-pVQZ model (top, Δ = −0.42 eV). The simulated spectra are convoluted with a FWHM of 0.70 eV.

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SYNCHROTRON
RADIATION
ISSN: 1600-5775
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