Fig. 2 | Nature Communications

Fig. 2

From: Direct dioxygen evolution in collisions of carbon dioxide with surfaces

Fig. 2

Kinematics and velocity analysis of CO2+ scattering on Au. a Experimental exit energies of CO2+, O2+, O2, CO+, CO, and O ions from CO2/Au collisions as a function of CO2+ incidence energy. All points represent the peak of the respective energy distribution obtained from Gaussian fitting of the experimental data. All solid lines represent one-parameter linear fittings with BCT-derived slopes. No fittings are shown for O2+ and CO+ data because of overlap with their negative ion counterparts. b Experimental velocity distributions of select scattered product ions for E0 = 56.4 ± 2.5 eV. c Calculated exit energies of CO2+, O2+, O2, CO+, CO, and O ions from MD simulations of CO2/Au collisions as a function of CO2+ incidence energy; slopes and intercepts listed in the inset are two-parameter best-fittings. The error bars represent one standard deviation across 10 samples of 2000 trajectories each from the ensemble of molecular dynamics trajectories. d Calculated velocity distributions from MD simulations for select scattered ion products at E0 = 56.4 eV. Vertical dashed lines in (b) and (d) indicate alignment with respect to the CO2+ (dashed black line) and O2 (dashed blue line) peaks

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