Automated Interactive Infrastructure and Database for Computational Science

If you use AiiDA please cite:
AiiDA 1.x
Main paper: S.P. Huber et al., Scientific Data 7, 300 (2020)
AiiDA engine: M. Uhrin et al., Comp. Mat. Sci. 187 (2021)

AiiDA 0.x
First paper, ADES model: G. Pizzi et al. Comp. Mat. Sci. 111, 218-230 (2016) (open access version)


Documentation revamp, and more than 50 registered plugins

👤 🕔 June 3, 2020 Comments Off on Documentation revamp, and more than 50 registered plugins
We are thrilled to announce a comprehensive revamp of the AiiDA documentation.
With the ultimate goal to lower the entry barrier for new users and to make it easier for both beginners and experienced AiiDA users to find the information they are looking for, the documentation is now divided into four distinct sections: a brief, learning-oriented tutorial, goal-oriented how-to recipes, understanding-oriented topic guides, and information-oriented reference material (for more details on the philosophy, see our wiki). Your feedback is most welcome!
We are also happy to report that the AiiDA plugin registry  has reached the milestone of 50 plugin packages (and 100 calculation plugins) – all thanks to your continued contribution to the AiiDA ecosystem.