Theoretical study of the second-order nonlinear optical properties of oxazine derivatives

Original language	English
Publication status	Published - 2015

Access to Document

• PosterFinal published version, 467 KB

Research output

Research output per year 2016 2016 2016

• 1 Article

Research output per year

Research output per year

• Oxazines: A New Class Of Second-Order Nonlinear Optical Switches

  Beaujean, P., Bondu, F., Plaquet, A., Garcia-Amoros, J., Cusido, J., Raymo, F. M., Castet, F., Rodriguez, V. & Champagne, B., 20 Mar 2016, In: J. Am. Chem. Soc.. 138, p. 5052-62 11 p.

  Research output: Contribution to journal › Article › peer-review

  Open Access

  • Oxazines 100%
  • Nitrophenols 97%
  • Excitation energy 90%
  • Optical switches 72%
  • Hyperpolarizability 61%
  1 Downloads (Pure)

Projects

Projects per year 2018 2018 2022

• 1 Finished

Projects per year

• CÉCI – Consortium of high performance computing centers

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

  1/01/18 → 31/12/22

  Project: Research

  • Density Functional Theory 99%
  • Optical properties 86%
  • density functional theory 85%
  • Hyperpolarizability 83%
  • Derivatives 80%

Equipment

• High Performance Computing Technology Platform

  Benoît Champagne (Manager)

  Technological Platform High Performance Computing

  Facility/equipment: Technological Platform

  • Hyperpolarizability 100%
  • Molecules 47%
  • Simulation 46%
  • Optical properties 42%
  • Graphene 40%

Student theses

• Characterization of the second-order nonlinear optical properties of oxazine molecular switches by quantum chemistry calculation and hyper-Rayleigh scattering spectroscopy

  Author: Beaujean, P., 22 Jan 2015

  Supervisor: Champagne, B. (Supervisor) & Plaquet, A. (Co-Supervisor)

  Student thesis: Master types › Master in Chemistry

Cite this

• APA
• Author
• BIBTEX
• Harvard
• Standard
• RIS
• Vancouver

Beaujean, P. (2015). Theoretical study of the second-order nonlinear optical properties of oxazine derivatives.

Beaujean, Pierre. / Theoretical study of the second-order nonlinear optical properties of oxazine derivatives.

@conference{1d2b99e126414f6db8df8af23911d70f,

title = "Theoretical study of the second-order nonlinear optical properties of oxazine derivatives",

author = "Pierre Beaujean",

year = "2015",

language = "English",

}

Beaujean, P 2015, 'Theoretical study of the second-order nonlinear optical properties of oxazine derivatives'.

Theoretical study of the second-order nonlinear optical properties of oxazine derivatives. / Beaujean, Pierre.

2015.

Research output: Contribution to conference › Poster

TY - CONF

T1 - Theoretical study of the second-order nonlinear optical properties of oxazine derivatives

AU - Beaujean, Pierre

PY - 2015

Y1 - 2015

M3 - Poster

ER -

Beaujean P. Theoretical study of the second-order nonlinear optical properties of oxazine derivatives. 2015.