exciting is a full-potential all-electron density-functional-theory package implementing linearized augmented planewave methods. It can be applied to all kinds of materials, irrespective of the atomic species involved and allows for exploring the physics of core electrons. As the name tells, exciting has a particular focus on excitations.
Following our exciting fluorine release, we are already working hard on upcoming features. Here are some examples:
- Adaptively-compressed exchange
- Iterative eigensolver
- Speedy BSE
Follow our numerous step-by-step tutorials which guide you through basic, as well as advanced features of exciting.
Have a look at the Psi-k highlight of the month about the cluster expansion package CELL, by Santiago Rigamonti and other team members.
We are happy to present exciting fluorine, the newest main release of the exciting code. New features comprise density-functional perturbation theory for phonons, the implementation of the library SIRIUS for tackling large systems, and more.
Do you like to learn about the most exciting features, explore our tutorials, or get to know our team? Or are you interested in our events? If so, just enjoy our new webpage!