Cuko, Andy (Date of defense: 2018-09-24)
Properties of nanomaterials are known to be size dependent and generally are very different from those of the corresponding bulk. Such behaviour, which is strongly system and structure dependent, allows ...
Alcón Rovira, Isaac (Date of defense: 2018-03-14)
In this PhD thesis I have studied through state-of-the-art quantum simulations (mainly within the density functional theory approach, DFT) triarylmethyl (TAM) based systems with potential for future ...
Macià Escatllar, Antoni (Date of defense: 2020-09-04)
The research presented in this thesis contributes to the understanding of both titania and silicate nanosystems by providing new information on energetic stability and properties of nanometer sized ...