Blar i SINTEF Industri på forfatter "Castelli, Ivano E."

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    • The atomic simulation environment - A Python library for working with atoms 

      Larsen, Ask Hjorth; Mortensen, Jens Jørgen; Blomqvist, Jakob; Castelli, Ivano E.; Christensen, Rune; Dulak, Marcin; Friis, Jesper; Groves, Michael N.; Hammer, Bjørk; Hargus, Cory; Hermes, Eric D.; Jennings, Paul C.; Jensen, Peter Bjerre; Kermode, James; Kitchin, John R.; Kolsbjerg, Esben Leonhard; Kubal, Joseph; Kaasbjerg, Kristen; Lysgaard, Steen; Maronsson, Jón Bergmann; Maxson, Tristan; Olsen, Thomas; Pastewka, Lars; Peterson, Andrew; Rostgaard, Carsten; Schiøtz, Jakob; Schütt, Ole; Strange, Mikkel; Thygesen, Kristian S.; Vegge, Tejs; Vilhelmsen, Lasse; Walter, Michael N.; Zeng, Zhenhua; Jacobsen, Karsten Wedel (Peer reviewed; Journal article, 2017)
      Abstract The Atomic Simulation Environment (ASE) is a software package written in the Python programming language with the aim of setting up, steering, and analyzing atomistic simula- tions. In ASE, tasks are fully scripted ...

    • Brokering between tenants for an international materials acceleration platform 

      Vogler, Monika; Busk, Jonas; Hajiyani, Hamidreza; Jørgensen, Peter Bjørn; Safaei, Nehzat; Castelli, Ivano E.; Ramirez, Francisco Fernando; Carlsson, Johan; Pizzi, Giovanni; Clark, Simon; Hanke, Felix; Bhowmik, Arghya; Stein, Helge S. (Peer reviewed; Journal article, 2023)
      The efficient utilization of resources in accelerated materials science necessitates flexible, reconfigurable software-defined research workflows. We demonstrate a brokering approach to modular and asynchronous research ...

    • Rechargeable Batteries of the Future—The State of the Art from a BATTERY 2030+ Perspective 

      Clark, Simon; Fichtner, Maximilian; Edström, Kristina; Ayerbe, Elixabete; Berecibar, Maitane; Bhowmik, Arghya; Castelli, Ivano E.; Dominko, Roberto; Erakca, Merve; Franco, Alejandro A.; Grimaud, Alexis; Horstmann, Birger; Latz, Arnulf; Lorrmann, Henning; Meeus, Marcel; Narayan, Rekha; Pammer, Frank; Ruhland, Janna; Stein, Helge; Vegge, Tejs; Weil, Marcel (Peer reviewed; Journal article, 2021)
      The development of new batteries has historically been achieved through discovery and development cycles based on the intuition of the researcher, followed by experimental trial and error—often helped along by serendipitous ...

    • A Roadmap for Transforming Research to Invent the Batteries of the Future Designed within the European Large Scale Research Initiative BATTERY 2030+ 

      Amici, Julia; Asinari, Pietro; Ayerbe, Elixabete; Barboux, Philippe; Bayle-Guillemaud, Pascale; Behm, R. Juergen; Berecibar, Maitane; Berg, Erik; Bhowmik, Arghya; Bodoardo, Silvia; Castelli, Ivano E.; Cekic-Laskovic, Isidora; Christensen, Rune; Clark, Simon; Diehm, Ralf; Dominko, Robert; Fichtner, Maximilian; Franco, Alejandro A.; Grimaud, Alexis; Guillet, Nicolas; Hahlin, Maria; Hartmann, Sarah; Heiries, Vincent; Hermansson, Kersti; Heuer, Andreas; Jana, Saibal; Jabbour, Lara; Kallo, Josef; Latz, Arnulf; Lorrmann, Henning; Løvvik, Ole Martin; Lyonnard, Sandrine; Meeus, Marcel; Paillard, Elie; Perraud, Simon; Placke, Tobias; Punckt, Christian; Raccurt, Oliver; Ruhland, Janna; Sheridan, Edel Maria; Stein, Helge; Tarascon, Jean-Marie; Trapp, Victor; Vegge, Tejs; Weil, Marcel; Wentzel, Wolfgang; Winter, Martin; Wolf, Andreas; Edström, Kristina (Peer reviewed; Journal article, 2022)
      This roadmap presents the transformational research ideas proposed by “BATTERY 2030+,” the European large-scale research initiative for future battery chemistries. A “chemistry-neutral” roadmap to advance battery research, ...