Jiménez Halla, José Óscar Carlos (Date of defense: 2009-10-16)
En aquesta tesi s'han estudiat mecanismes de reaccions de cicloanulació en carbens de Fischer a través de mètodes teòrics, concretament fent servir el nivell de teoria B3LYP/(Wachters' basis / 6-31G**). ...
Feixas Geronès, Ferran (Date of defense: 2011-02-04)
Interactions between electrons determine the structure and properties of matter from molecules to solids. Therefore, the understanding of the electronic structure of molecules will enable us to extract ...
Artigas Ruf, Albert (Date of defense: 2020-01-31)
Fullerenes are a group of spherical molecules with outstanding 2/1 physicochemical properties that make them important materials in a variety of fields, ranging from biomedicine to photovoltaics. ...
Dachs Soler, Anna (Date of defense: 2011-07-29)
The [2+2+2] cycloaddition reaction involves the formation of three carbon-carbon bonds in one single step using alkynes, alkenes, nitriles, carbonyls and other unsaturated reagents as reactants. This ...