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)

Join us

Are you interested in the intersection of software and computational science?

You love coding and building the tools for the computational science of tomorrow?

Then you might be a candidate for the AiiDA team!


We advertise openings for positions when they become available, but excellent candidates are encouraged to apply throughout the year.

Use a 1-page cover letter to explain what motivates you and why you would fit into the team – please note that we don’t consider blanket applications.