AiiDA
Automated Interactive Infrastructure and Database for Computational Science

AiiDA is a flexible and scalable informatics' infrastructure to manage, preserve, and disseminate the simulations, data, and workflows of modern-day computational science. Able to store the full provenance of each object, and based on a tailored database built for efficient data mining of heterogeneous results, AiiDA gives the user the ability to interact seamlessly with any number of remote HPC resources and codes, thanks to its flexible plugin interface and workflow engine for the automation of complex sequences of simulations.

Journal ref: G. Pizzi, A. Cepellotti, R. Sabatini, N. Marzari, and B. Kozinsky, AiiDA: automated interactive infrastructure and database for computational science, Comp. Mat. Sci. 111, 218-230 (2016)

Open access link: arXiv:1504.0116

Posts

Two open positions available for computational materials scientist/software scientists on data and services

👤 🕔 July 3, 2018 Comments Off on Two open positions available for computational materials scientist/software scientists on data and services


Two positions for computational materials scientists/software scientists are available at the Ecole Polytechnique Fédérale de Lausanne (EPFL, Lausanne, Switzerland) in the group of Prof. Nicola Marzari. The positions are funded by the new H2020 MarketPlace project (2018-2022, 9.2 M€) aimed at developing a single entry point for all industrial and academic materials modeling activities in Europe. EPFL will lead the work package on “Data and Modeling Services”.

For more information, please refer to the official advertisement