Following to our Deliverable 4.7 "Business plan assessment and revision", we have created informative synthetic tabs illustrating the INTERSECT key exploitable results defined within our Innovation plan. INTERSECT's main result will be the release of the Interoperable Material-To-Device Simulation Box (IM2D) that is conceived as an...
This year's edition of the AiiDA tutorial will take place from the 5th to the 9th July 2021 in a virtual format There is also a poster session to which participants are encouraged to present their work. The goal of this 5 day-tutorial is to help students and researchers...
The flagship school "Introduction to running reproducible workflows with AiiDA", organized by Cecam with our partner EPFL, will take place on July 06-09, 2021 at the Vilnius University. This school will focus on using AiiDA as a tool for HTC: running simulations, retrieving and querying...
After a successful Google Summer of Code (GSOC) 2020 under the NumFocus umbrella, the AiiDA team plans to participate in GSOC 2021 as well.Are you a student / PhD student passionate about (python) programming and open science? Google Summer of Code is a way for you to spend 10 weeks during...
The Simulation Workflows in Materials Modeling - SWiMM 2021 workshop will familiarize its participants with new trends and solutions in simulation workflow management and optimization, coupling and linking of codes, and data integration by semantic interoperability in materials modelling. The online event, organized by our...
As we recently posted, new INTERSECT project deliverables are out! Deliverable 2.4, "Materials-to-device and device-to-materials syntactic interconnections", by our intersecters C. Rosati, M. Bertocchi, F. Benedetto, A. Padovani, V. Lunardelli, F. J. Dos Santos, N. Marzari, and A. Calzolari, is developed within WP2, "Interconnection and Interoperability Implementations", under...
As we recently posted, new INTERSECT project deliverables are out! Deliverable 2.3, "QE and SIESTA workflows for advanced materials parameters (Tasks 2.1.3-5): Part I", by our intersecters F. J. Dos Santos, F. Aquilante, A. Akhtar, A. García, P. Ordejón, L. Bursi, A.Calzolari, and N. Marzari, is developed within...
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...
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...