The three dimensional carborane clusters exhibit exceptional thermal and chemical stability, tailorability, ambiphilic character, organomimic properties, and unusually low toxicity, which provide performance superior to that of conventional materials. Several publications appear about the unique reactivity, stability and possible application of these compounds, but there are only limited number of computational study. Recent PhD topic aims to investigate computationally different carborane based systems. During the PhD project a systematic theoretical investigation (DFT calculations) should be carried out on carborane containing systems (substituted boranes, carboranes, and their metal complexes) in order to get deeper insight into their stability, reactivity and different properties (photo, electronic etc.), which make these compounds suitable for different applications.
felvehető hallgatók száma: 1
Jelentkezési határidő: 2020-12-10
2024. IV. 17. ODT ülés Az ODT következő ülésére 2024. június 14-én, pénteken 10.00 órakor kerül sor a Semmelweis Egyetem Szenátusi termében (Bp. Üllői út 26. I. emelet).
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