Supervised theses (20) Theses supervised by group members

2023

  1. Molecular descriptors and big data analysis to extrapolate materials properties

    DE ARMAS MOREJÓN, CARLOS MANUEL

    Supervised by Ángel Rubio Secades

2021

  1. Density functional theory for steady-state thermoelectric transport with applications to strongly correlated systems

    SOBRINO COLL, NAHUAL CARLOS

    Supervised by Roberto D'agosta y Stefan Kurth

2020

  1. Molecular assembly and reactions on surfaces characterized by low-temperature scanning probe techniques

    BARRAGAN DURAN, ANA ISABEL

    Supervised by Lucia Vitali

2017

  1. Quantum Electrodynamical time-dependent density functional theory

    PELLEGRINI, CAMILLA

    Supervised by Ángel Rubio Secades y Ilya Tokatly
  2. Propiedades estructurales y electrónicas de las aleaciones bidimensionales de GdAg2/Ag(111) y de GdAu2/Au(111)

    CORREA ARISTIZABAL, ALEXANDER

    Supervised by Lucia Vitali
  3. Modelling of polymer-carbon nanotube heterojunctions for photovoltaic applications

    GLANZMANN, LIVIA NOEMI

    Supervised by Ángel Rubio Secades
  4. Modeling linear and non-linear light-matter interactions: from classical to atomistic nanoplasmonics

    VARAS BARBOZA, ALEJANDRO JAVIER

    Supervised by Ángel Rubio Secades

2016

  1. Modeling and analysis of thermoelectric energy conversion efficiency in nanostructures.

    YANG, KAIKE

    Supervised by Roberto D'agosta y Ángel Rubio Secades
  2. Analysis and control of transient spectra using time-dependent density functional theory.

    WALKENHORST, JESSICA

    Supervised by Ángel Rubio Secades
  3. Modelling thermo-electric transport and excited states in low dimensional systems

    BIELE, ROBERT

    Supervised by Ángel Rubio Secades y Roberto D'agosta
  4. Theoretical study on the photoswitching mechanism of negative reversibly photoswitchable fluorescent proteins

    TORCAL EMBEITA, BRUNO

    Supervised by Ángel Rubio Secades

2015

  1. Density-potential mapping in the standard and quantum electrodynamical time-dependent density functional theory

    Farzanehpour ---, Mehdi

    Supervised by Ilya Tokatly y Ángel Rubio Secades
  2. Spectroscopic analysis of atoms and molecules

    Crawford Uranga, Alison-Ainara

    Supervised by Ángel Rubio Secades y Stefan Kurth
  3. Optimisation of the first principle code Octopus for massive parallel architectures: application to light harvesting complexes

    Alberdi-Rodríguez, Joséba

    Supervised by Ángel Rubio Secades y Javier Muguerza Rivero

2013

  1. Theoretical description of the optical properties of nanostructures within time dependent density functional theory

    ESPINOSA LEAL, LEONARDO ANDRES

    Supervised by Ángel Rubio Secades
  2. Static and time-dependent density functionals for non-linear processes

    FUKS ---, JOHANNA ILDEMAR

    Supervised by Ángel Rubio Secades

2012

  1. Development and aplications of time - dependent density matrix functional theory

    AKBARI, ALI

    Supervised by Ángel Rubio Secades

2011

  1. Improving simulation of biological molecules: refining mathematical, physical and computational tools

    GARCIA RISUEÑO, PABLO

    Supervised by Ángel Rubio Secades

2010

  1. Linear and non-linear response phenomena of molecular systems within time-dependent density functional theory

    Andrade Valencia, Xavier Iago

    Supervised by Ángel Rubio Secades

2006

  1. First principles description of response functions in low dimensional systems

    VARSANO, DANIELE

    Supervised by Ángel Rubio Secades