Arcos Gutiérrez, David (Date of defense: 2022-07-19)
Two-dimensional materials have a lot of applications in the electronic and photonic device design field, especially when they need to be flexible and transparent. In particular, high frequency applications, ...
Vispa, Alessandro (Date of defense: 2016-11-24)
Disordered systems are ubiquitous in nature and their study is complicated and often leads to controversial results. In any case, the important role of such systems in science and technological applications ...
Calvo Minguillón, Ausias March (Date of defense: 2021-07-09)
The underlying topic of this thesis is the study of the application of the Force Matching (FM) algorithm to parameterize ion-water Force Fields using ab-initio simulations as reference. In order to do ...
Tripathi, Pragya (Date of defense: 2016-11-17)
In this thesis we employ dielectric spectroscopy (in different implementations) to study the dielectric properties of different materials ranging from completely disordered supercooled liquids to ...
Henao Aristizábal, Andrés (Date of defense: 2016-09-23)
Many materials of scientific interest show a disordered phase, with their molecules presenting positional disorder, orientational disorder or both. Processes of interest to life also occur in these kind ...
Afa, Iduabo John (Date of defense: 2018-01-24)
Control is important for transferring theoretical scientific knowledge into practical technology for applications in numerous fields. This is why coherent control study is significant on every timescale ...
Ferré Porta, Guillem (Date of defense: 2017-09-16)
The main objective of the thesis is to study static and/or dynamic properties of a set of quantum fluids by means of quantum Monte Carlo techniques, mainly using the path integral formalism to obtain ...
Velasco Cruz, Jorge Enrique (Date of defense: 2019-06-28)
Metallic glasses are amorphous solids produced by rapid cooling, with disordered atomic structure and lacking long-range order. This structural disorder makes them to show mechanical properties different ...
Lu, Huixia (Date of defense: 2020-09-29)
The present Thesis is devoted to the study of the physical-chemical properties of selected small-molecules (such as amino-acids like tryptophan or hormones like melatonin) and proteins (such as KRAS-4B) ...
Tahat, Amani Naser (Date of defense: 2016-06-01)
This thesis aims at studying the microscopic physical-chemical properties of an excess proton in aqueous systems. From bulk water environments to narrow hydrophobic channels constructed with a double-layered ...