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  • 1
    Electronic Resource
    Electronic Resource
    Springer
    Journal of computer-aided materials design 3 (1996), S. 210-212 
    ISSN: 1573-4900
    Keywords: Zeolites ; Catalysts ; Ion exchange ; Density functional theory
    Source: Springer Online Journal Archives 1860-2000
    Topics: Mechanical Engineering, Materials Science, Production Engineering, Mining and Metallurgy, Traffic Engineering, Precision Mechanics
    Notes: Summary Recent progress in the modelling of exchanged Cu sites and their interactions with small molecules, based on DFT cluster calculations, is briefly reviewed.
    Type of Medium: Electronic Resource
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