HPC-Europa

PRACE

Status: finished project
Starting date 
1 January 2008
Ending date 
31 December 2012
  1. HPC-Europa++ Code:
    Project Title: In Silico spectroscopic characterization of carbon nanomaterials with thousands of atoms
    Researcher: Dr. Manuel Melle Franco - Universidade do Minho - Braga (Portugal)
    Host: Prof. Angel Rubio (University of the Basque Country UPV/EHU).

  2. HPC-Europa++ Code:
    Project Title:
    Researcher: Dr. Lorenzo Stella - University College London
    Host: Prof. Angel Rubio (University of the Basque Country UPV/EHU).

  3. HPC-Europa++ Code: 16
    Project Title: Assignment of defect levels in chalcopyrites compounds for solar cells: sc-GW calculations.
    Researcher: Dr. Silvana Botti (Centre National Recherche Scientifique (CNRS) - Ecole Polytechnique)
    Host: Prof. Angel Rubio (University of the Basque Country UPV/EHU).

  4. HPC-Europa++Code: 20.
    Project Title: Exact models for (time-dependent) density functional theory.
    Researcher: Dr. Miguel Alexandre Lopes Marques (Université Lyon 1 and CNRS)
    Host: Prof. Angel Rubio (University of the Basque Country UPV/EHU).

  5. HPC-Europa++ Code: 2009/100.
    Project Title: Development of computational methods for real-time simulation of inner-shell electron dynamics within time-dependent density functional theory.
    Researcher: Arto Sakko (university of Helsinki)
    Host: Prof. Angel Rubio (University of the Basque Country UPV/EHU).

  6. HPC-Europe++Code:2009/124.
    Project Title: Theoretical and numerical description of time-resolved and X-ray laser spectroscopy.
    Researcher: Leonardo Andrés Espinosa Leal
    Host: Prof. Keijo Hämäläinen.

  7. HPC-Europe++Code: 2009/155
    Project Title: Role of exciton-phonon scattering in the exciton-polariton dynamics of GaN microcavities
    Researcher: Dr. Andrea Marini (University of Rome)
    Host: Prof. Angel Rubio (University of the Basque Country UPV/EHU).

  8. HPC-Europe++Code: 2009/246
    Project Title: Optical Properties of TiO2 Nanostructures: many­body corrections in the GW and BSE schemes
    Researcher: Dr. Amilcare Iacomino (Univerità degli Studi Roma Tre)
    Host: Prof. Angel Rubio (University of the Basque Country UPV/EHU).

  9. HPC-Europe++Code: 2009/247
    Project Title: Optical excitation energies and photocatalytic activity of doped and undoped metal oxide nanostructures
    Researcher: Dr. Duncan Mowbray (Technical University of Denmark)
    Host: Prof. Angel Rubio (University of the Basque Country UPV/EHU).

  10. HPC-Europe++Code: 2009/326
    Project Title: Optical properties of monoatomic carbon chains
    Researcher: Dr. Zeila Zanolli (ICMAB-CSIC)
    Host: Prof. Angel Rubio (University of the Basque Country UPV/EHU).

  11. HPC-Europe++Code: 637
    Project Title: An efficient local potential in reduced density matrix functional theory
    Researcher: Dr. Nektarios Lathiotakis (National Hellenic Research Foundation )
    Host: Prof. Angel Rubio (University of the Basque Country UPV/EHU)

  12. HPC-Europe++Code: 739
    Project Title: Optical properties of silver (and its alloys) nanoparticles
    Researcher: Dr. Francesca Baletto (Kings College London)
    Host: Angel Rubio (University of the Basque Country UPV/EHU)

  13. HPC-Europe++Code: 896
    Project Title: Methane Oxidation on Gold - Elucidation of a mechanism using microkinetic modelling
    Researcher: Guido Walther (Leibniz Institute for Catalysis)
    Host: Angel Rubio (University of the Basque Country UPV/EHU)

Participants

  • Prof. Angel Rubio (Universidad del País Vasco)
  • Dr. Claudio Attaccalite  (Universidad del Pais Vasco)
  • Prof. Keijo Hämäläinen (University of Helsinki)

Visitors

  1. Dr. Manuele Melle Franco (Universidade do Minho, Braga -Portugal-).
  2. Dr. Lorenzo Stella (University College London).
  3. Dr. Silvana Botti (Centre National Recherche Scientifique (CNRS) - Ecole Polytechnique.
  4. Dr. Miguel Alexandre Lopes Marques (University of Lyon 1 and CNRS).
  5. Arto Sakko (University of Helsinki).
  6. Leonardo Andrés Espinosa Leal (Universidad del País Vasco).
  7. Dr. Andrea Marini (University of Rome "Tor Vergata").
  8. Amilcare Iacomino (Universita' degli Studi Roma Tre).
  9. Dr. Duncan Mowbray (Technical University of Denmark).
  10. Dr. Zeila Zanolli
  11. Dr. Nektarios Lathiotakis
  12. Dr. Francesca Baletto