This information sheet indicates how the course will be organized at pandemic code level yellow and green.
If the colour codes change during the academic year to orange or red, modifications are possible, for example to the teaching and evaluation methods.

Advanced molecular spectroscopy

Course Code :2000WETGMS
Study domain:Chemistry
Academic year:2020-2021
Semester:1st semester
Contact hours:50
Credits:6
Study load (hours):168
Contract restrictions: No contract restriction
Language of instruction:English
Exam period:exam in the 1st semester
Lecturer(s)Christian Johannessen
Wouter Herrebout

3. Course contents *

Covered in lectures:

Instrumentation:

  • Sources
  • monochromators
  • polarization and non-linear optics
  • detectors
  • interferrometers
  • lasers
  • data handling: Phase sensitive detection, convolution, auto- and cross-correlation

Quantum mechanics in a practical setting:

  • Tensor formalism
  • Berny optimisation
  • Hessian matrices
  • Atomic Axial and Atomic Polar tensors in property tensor calculations
  • Polarisability and activity tensors
  • Resonance effects in optical spectroscopy
  • Fourier series and transforms, dicrete and fast FT

Covered in practicals:

  • FT-IR and VCD spectroscopy
  • Raman and ROA spectroscopy
  • Sample handling
  • Data analysis and post measuring handling
  • Conformational searching
  • Quantum mechanical calculations
  • Critical data analysis