Towards modelling the vibrational signatures of functionalized surfaces: Carboxylic acids on H-Si(111) surfaces

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• Finished

  consortium des équipements de calcul intensif

  Champagne, B. (CoI)

  1/01/11 → 31/12/22

  Project: Research

  • nonlinear problems 100%
  • Hyperpolarizability 84%
  • simulation 83%
  • molecules 76%
  • investigations 63%

• TINTIN - ARC 09/14-23: Molecular TINkertoys for OpToelectronics and SpINtronics - TINTIN

  BONIFAZI, D. (PI), Champagne, B. (CoI), FORENSI, S. (Researcher), SEGERIE, A. (Researcher) & Melinte, S. (CoI)

  1/09/09 → 31/08/14

  Project: Research

  • Hyperpolarizability 100%
  • shells 54%
  • nonlinear problems 42%
  • Third-Order Nonlinear Optical Property 26%
  • optical properties 25%

• Functional Supramolecular Systems (PAI P6/27)

  Champagne, B. (PI), Wouters, J. (PI), BOTEK, E. (Researcher), DE WERGIFOSSE, M. (Researcher), GUTHMULLER, J. (Researcher), Liegeois, V. (Researcher), NORBERG, B. (Technician), Plaquet, A. (Researcher), STAELENS, N. (Researcher) & Vercauteren, D. (CoI)

  1/01/07 → 31/12/11

  Project: Research

  • Hyperpolarizability 100%
  • shells 61%
  • electrons 40%
  • transition metals 35%
  • Transition Element 35%

• Development of the ISCF Center

  Champagne, B. (PI), VIGNERON, J.-P. (PI), Derycke, I. (Support role), Fripiat, J. (Researcher), Lambin, P. (Researcher), Schievekamp, I. (Support role), Vercauteren, D. (Researcher), Wautelet, F. (Support role) & Wouters, J. (CoI)

  1/01/95 → 31/12/12

  Project: Research

  • optical activity 100%
  • Raman Optical Activity 75%
  • investigations 50%
  • spectra 48%
  • nonlinear problems 37%