Sfoglia Chimica per Autore "Cavallo, Luigi"

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    • A molecular dymanics view of structure and reactivity 

      Ragone, Francesco (Universita degli studi di Salerno, 2011-02-21)
      The eld of computer simulations has developed into a very important branch of science providing a guess at the interactions between molecules to obtain predictions of properties as accurate as required, subject to ...

    • Towards the rational design of new catalysts for organic transformations 

      Falivene, Laura (Universita degli studi di Salerno, 2014-02-28)
      The main goal of this PhD thesis has been providing a computational support to the development of new or better performing catalysts, leading to the synthesis of new materials. In this context, it is worth remembering ...