Browsing Publikasjoner fra CRIStin - SINTEF AS by Author "Castelli, Ivano E."

Now showing items 1-3 of 3

    • 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 ...