AiiDA 1.0, a scalable computational infrastructure for automated reproducible workflows and data provenance
AiiDA 1.0,一个可扩展的计算基础设施,用于自动化可复现工作流程和数据溯源
期刊:Scientific Data
影响因子:6.9
doi:10.1038/s41597-020-00638-4
Huber, Sebastiaan P; Zoupanos, Spyros; Uhrin, Martin; Talirz, Leopold; Kahle, Leonid; Häuselmann, Rico; Gresch, Dominik; Müller, Tiziano; Yakutovich, Aliaksandr V; Andersen, Casper W; Ramirez, Francisco F; Adorf, Carl S; Gargiulo, Fernando; Kumbhar, Snehal; Passaro, Elsa; Johnston, Conrad; Merkys, Andrius; Cepellotti, Andrea; Mounet, Nicolas; Marzari, Nicola; Kozinsky, Boris; Pizzi, Giovanni