Browsing by Subject "Diazanaphthalene dimers"
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MP2, DFT and DFT–D study of the dimers of diazanaphthalenes: a comparative study of their structures, stabilisation and binding energies
(Taylor & Francis, 2014)Diazanaphthalenes (DAPs) are a broad class of N-heteroaromatic compounds with several technological and biological applications. Some of these applications are attributed to the ability of DAP molecules to form associated ...