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. 2011 Jun 21;2:357. doi: 10.1038/ncomms1359

Figure 5. DFT prediction of energy profile.

Figure 5

The energies for removal of chemisorbed carbon species on BaO/Ni(1 1 1) are relative to gas-phase H2O and an adsorbed carbon species on BaO/Ni(1 1 1). '* denotes an adsorbed species on the surface. TS, transition state.