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Use of DFT to achieve a rational understanding of acid?basic properties of ?-alumina surfaces

Journal of Catalysis · 2004 · Vol. 226(1) · pp. 54–68
Mathieu Digne
Electronic and Structural Properties of OxidesCopper-based nanomaterials and applicationsQuantum Dots Synthesis And PropertiesAdsorptionAb initioSurface (topology)PyridineMoleculeDensity functional theorySpinelInfrared spectroscopyComputational chemistryMaterials science
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Use of DFT to achieve a rational understanding of acid?basic properties of ?-alumina surfaces · Scinovex