If you use AiiDA please cite:
Main paper: S.P. Huber et al., Scientific Data 7, 300 (2020)
AiiDA engine: M. Uhrin et al., Comp. Mat. Sci. 187 (2021)
First paper, ADES model: G. Pizzi et al. Comp. Mat. Sci. 111, 218-230 (2016) (open access version)
Starting this January, AiiDA graphs will be on the cover image of Computational Materials Science for the next series of issues (picture on the left).
Cover of the Computational Materials Science journal (since Jan 2017). AiiDA graph: picture on the left.