Tesis

2025

Linda Sheila Medondjio

First-principles simulations of amorphous GeSe compounds for memory selectors

2024

Jose Maria Castillo Robles

Advanced Corrosion Modelling: an Atomistic Approach to Describe the Corrosion Inhibition Process

Pol Febrer

New techniques to simulate electrified solid-liquid interfaces better and faster

2023

Nils Wittemeier

First-Principles Computational Methods for Quantum Materials

Jiahui Jia

Defect and strain engineering for modulating structure and magnetism in perovskites

2022

Arsalan Akhtar

Computational schemes for defects energetics

2021

Juan Dilson

Influencia de las vacancies de oxígeno en la estructura electrónica de manzanitas ferromagnético-metálicas

2019

Ionel-Bogdan Guster

A bird’s-eye view of charge and spin density wave from first principles calculations

2017

Desanka Boskovic

Electronic properties of organic semiconductors and low-dimensional materials

2015

José A. Silva

Theoretical study of the electronic properties of 2D materials

2013

Miguel Angel Pérez Osorio

Development and application of ab initio methods for the study of electronic excitations in molecules and extended solids: GW approximation and constrained DFT.