Browsing Τμήμα Χημείας / Department of Chemistry by Author "Wallenborn, E. -U"

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    • Article  

      Normal and defective perylene substitution sites in alkane crystals 

      Leontidis, Epameinondas; Heinz, H.; Palewska, K.; Wallenborn, E. -U; Suter, U. W. (2001)
      The substitution nature of perylene in polycrystalline solid alkane matrices was examined. Low temperature excitation-emission matrix spectroscopy was used to determine substitution sites in alkane matrices from hexane to ...
    • Article  

      The Shpol'skii system perylene in n-hexane: A computational study of inclusion sites 

      Wallenborn, E. -U; Leontidis, Epameinondas; Palewska, K.; Suter, U. W.; Wild, U. P. (2000)
      We present a combined quantum mechanics/molecular mechanics study of the Shpol'skii system perylene/n-hexane. The system was modeled utilizing a customized pcff-derived force field optimized with a balanced set of optimization ...