Multi-State Second-Order Nonlinear Optical Switches Incorporating One to Three Benzazolo-Oxazolidine Units: A Quantum Chemistry Investigation

Résultats de recherche

• Moriarty: Multi or individual addressability of multi-responsive topological system

  Champagne, B., Sanguinet, L., Beaujean, P. & Quertinmont, J.

  1/01/17 → 31/12/18

  Projet: Recherche

  • Oxazolidine 100%
  • Density Functional Theory 50%
  • Depolarization 33%
  • Structure 33%
  • Second Order 33%

• CÉCI – Consortium des Équipements de Calcul Intensif

  Champagne, B., Lazzaroni, R., Geuzaine , C., Chatelain, P. & Knaepen, B.

  1/01/18 → 31/12/22

  Projet: Recherche

  • Density Functional Theory 100%
  • Hyperpolarizability 77%
  • Structure 68%
  • Donor 61%
  • Procedure 61%