Computational Study of Extraframework Cu⁺ Sites in Ferrierite: Structure, Coordination, and Photoluminescence Spectra

This publication has 22 references indexed in Scilit:

• Coordination Change of Cu⁺ Sites in ZSM-5 on Excitation in the Triplet State: Understanding of the Photoluminescence Spectra
  The Journal of Physical Chemistry B, 2000
• The effect of hydration on structure and location of Ti-sites in Ti-silicalite catalysts. A computational study
  Physical Chemistry Chemical Physics, 2000
• Coordination and siting of Cu+ ions in ZSM-5: A combined quantum mechanics/interatomic potential function study
  Physical Chemistry Chemical Physics, 1999
• Coordination of Cu⁺ Ions to Zeolite Frameworks Strongly Enhances Their Ability To Bind NO₂. An ab Initio Density Functional Study
  Journal of the American Chemical Society, 1998
• Predicting Absolute and Site Specific Acidities for Zeolite Catalysts by a Combined Quantum Mechanics/Interatomic Potential Function Approach
  The Journal of Physical Chemistry B, 1997
• Structure and reactivity of silica and zeolite catalysts by a combined quantum mechanics[ndash ]shell-model potential approach based on DFT
  Faraday Discussions, 1997
• Identification of Cu Sites in ZSM-5 Active in NO Decomposition
  The Journal of Physical Chemistry, 1995
• A Synchrotron X-ray Diffraction, Neutron Diffraction, 29Si MAS-NMR, and Computational Study of the Siliceous Form of Zeolite Ferrierite
  Journal of the American Chemical Society, 1994
• Chemical and spectroscopic properties of copper containing zeolites
  The Journal of Physical Chemistry, 1977
• The crystal structure of the zeolite ferrierite
  Acta Crystallographica, 1966