articleJournal of CatalysisJun 11, 2004Closed access

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

MDMathieu Digne

École Normale Supérieure de Lyon · Institut Français · +1 more institution

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Topics & keywords

Topics
Keywords
  • Adsorption
  • Ab initio
  • Surface (topology)
  • Pyridine
  • Molecule
  • Density functional theory
  • Spinel
  • Infrared spectroscopy
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