news

Our intersecter Fraunhofer IWM is giving workshops about the Metadata scheme of the ontologies and capabilities of the BDSS (Business Decision Support System) developed in the pan-European H2020-project FORCE (Formulations and Computational Engineering) on January and February, 2021. The workshops will be offering a detailed...

A new paper about “AiiDAlab - An ecosystem for developing, executing, and sharing scientific workflow", by our intersecter Marzari et al., is available online, and will be soon published on Computational Materials Science (2021, volume 188, February 15), Abstract: Cloud platforms allow users to execute tasks directly...

Materials and our ability to understand and utilise their behaviour play a central role in supporting industrial transformation and delivering against the objectives of the European Green Deal. More than ever, we are aware of supply chain capabilities and opportunities of a digitally connected world. Following...

A new paper about "Workflows in AiiDA: Engineering a high-throughput, event-based engine for robust and modular computational workflows", by Martin Uhrin, Sebastiaan P. Huber, Jusong Yu, our intersecter Nicola Marzari, and Giovanni Pizzi, has been published on Computational Materials Science, Volume 187, 1 February 2021. Executive...

A fifth minor version of the AiiDA v1 series is out with a couple of new features and some relevant bug fixes. Support for Python 3.5 is dropped and support for Python 3.9 is added. AiiDA is an open-source Python infrastructure to help researchers with automating,...