Our group has a long standing interest in magnetic response properties, such as
- Rotational g-tensors
- Magnetisabilities and Hyper-Magnetisabilities
- Spin-Rotation Constants
- NMR Shielding constants
Our work has provided benchmark data for testing electronic structure methods, improved density-functional approaches for calculating these properties and novel methods for related non-linear magnetic properties.
Recently our work on real-time approaches has allowed us to access electronic absorption, electronic circular dichroism and magnetic circular dichroism spectra both under standard conditions and in the presence of strong external electromagnetic fields.