Figure 1: Schematic images of concept for design of solid frustrated Lewis pairs in CeO2 crystal structure. | Nature Communications

Figure 1: Schematic images of concept for design of solid frustrated Lewis pairs in CeO2 crystal structure.

From: Solid frustrated-Lewis-pair catalysts constructed by regulations on surface defects of porous nanorods of CeO2

Figure 1

(a) Optimized structure of ideal CeO2(110). (b) Optimized structure of CeO2(110) with one oxygen vacancy. (c) Optimized structure of CeO2(110) with two adjacent oxygen vacancies. (d) Electron-density isosurface of ideal CeO2(110). (e) Electron-density isosurface of CeO2(110) with one oxygen vacancy. (f) Electron-density isosurface of CeO2(110) with two oxygen vacancies. The electron-density isosurfaces are plotted at 0.01 e bohr−3. The colour bar represents the electrostatic potential scale.

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