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Feliciano Giustino

Professor Feliciano Giustino
Professor of Materials

Department of Materials
University of Oxford
16 Parks Road
Oxford OX1 3PH

Tel: +44 1865 612790
Tel: +44 1865 612790 (Room 271.40.27)
Tel: +44 1865 273777 (reception)
Fax: +44 1865 273789 (general fax)

Personal Homepage
Materials Modelling Laboratory

Summary of Interests

My main research interest in the development and application of atomistic simulation methods for real materials. My strategy is to combine the predictive capability of the quantum theory of real materials with the power of high-performance computing, in order to investigate the structural, electronic, and optical properties of third-generation solar cells and superconductors. My research group is currently active in the following areas:

  • Photovoltaics
    • Solid-state dye-sensitised solar cells
    • Hybrid organic/inorganic solar cells
  • Superconductors
    • Graphane
    • Diamond
    • Iron pnictides
    • Cuprates
  • Electronic structure methods
    • Electron-phonon interaction
    • Many-body perturbation theory

Research Publications

Savini, G., Ferrari, A. C., Giustino, F. (2010) 'First-principles prediction of doped graphane as a high-temperature electron-phonon superconductor' Physical Review Letters 105 037002.

Schaffry, M., Filidou, V., Karlen, S. D., Gauger, E. M., Benjamin, S. C., Anderson, H. L., Ardavan, A., Briggs, G. A. D., Maeda, K., Henbest, K. B., Giustino, F., Morton, J. J. L., Lovett, B. W. (2010) 'Entangling remote nuclear spins linked by a chromophore' Physical Review Letters 104 200501.

Giustino, F., Cohen, M. L., Louie, S. G. (2010) 'GW method with the self-consistent Sternheimer equation' Physical Review B 81 115105.

Park, C.-H., Giustino, F., Spataru, C. D., Cohen, M. L., Louie, S. G. (2009) 'Angle-resolved photoemission spectra of graphene from first-principles calculations' Nano Letters 9 4234.

Noffsinger, J., Giustino, F., Louie, S.G. and Cohen, M.L. (2009). 'Role of fluorine in the iron pnictides: phonon softening and effective hole doping' Physical Review Letters 102 147003.

Noffsinger, J., Giustino, F., Louie, S.G. and Cohen, M.L. (2009). 'Origin of Superconductivity in boron-doped silicon carbide from first principles' Physical Review B 79 104511.

Park, C.-H., Giustino, F., Spataru, C.D., Cohen, M.L. and Louie, S.G. (2009). 'First-principles study of electron linewidths in graphene' Physical Review Letters 102 076803.

There is a more complete list of publications on my Personal Homepage.