Metal Cluster Support Interactions in the Cu/ZnO System: A QM/MM Study

This publication has 70 references indexed in Scilit:

• From CO2 to Methanol by Hybrid QM/MM Embedding
  Angewandte Chemie, 2001
• The prediction of metastable impact electronic spectra (MIES): perfect and defective MgO(001) surfaces by state-of-the-art methods
  Surface Science, 2000
• New insights into methanol synthesis catalysts from X-ray absorption spectroscopy
  Catalysis Today, 1999
• Density Functional Theory Study of Copper Clusters
  The Journal of Physical Chemistry B, 1999
• First principles study of adsorbed Cun (n=1–4) microclusters on MgO(100): Structural and electronic properties
  The Journal of Chemical Physics, 1998
• Electron spin resonance properties of ZnO microcrystallites
  Materials Letters, 1998
• Oxidation of ultrathin copper layers on zinc oxide polar surfaces: unoccupied electronic states
  Journal of Physics: Condensed Matter, 1997
• Importance of Madelung potential in quantum chemical modeling of ionic surfaces
  Journal of Computational Chemistry, 1997
• Hydrogen Dissociation on Reconstructed ZnO Surfaces
  The Journal of Physical Chemistry, 1996
• Incorporation of Monovalent Ions in ZnO and Their Influence on Varistor Degradation
  Journal of the American Ceramic Society, 1993