Andersen, Casper W.
Armiento, Rickard
Blokhin, Evgeny http://orcid.org/0000-0002-5333-3947
Conduit, Gareth J.
Dwaraknath, Shyam http://orcid.org/0000-0003-0289-2607
Evans, Matthew L.
Fekete, Ádám
Gopakumar, Abhijith
Gražulis, Saulius
Merkys, Andrius http://orcid.org/0000-0002-7731-6236
Mohamed, Fawzi
Oses, Corey
Pizzi, Giovanni http://orcid.org/0000-0002-3583-4377
Rignanese, Gian-Marco http://orcid.org/0000-0002-1422-1205
Scheidgen, Markus
Talirz, Leopold http://orcid.org/0000-0002-1524-5903
Toher, Cormac
Winston, Donald
Aversa, Rossella http://orcid.org/0000-0003-2534-0063
Choudhary, Kamal http://orcid.org/0000-0001-9737-8074
Colinet, Pauline
Curtarolo, Stefano
Di Stefano, Davide
Draxl, Claudia http://orcid.org/0000-0003-3523-6657
Er, Suleyman http://orcid.org/0000-0002-5005-3894
Esters, Marco
Fornari, Marco
Giantomassi, Matteo
Govoni, Marco http://orcid.org/0000-0001-6303-2403
Hautier, Geoffroy http://orcid.org/0000-0003-1754-2220
Hegde, Vinay
Horton, Matthew K. http://orcid.org/0000-0001-7777-8871
Huck, Patrick http://orcid.org/0000-0001-8237-2227
Huhs, Georg
Hummelshøj, Jens
Kariryaa, Ankit
Kozinsky, Boris http://orcid.org/0000-0002-0638-539X
Kumbhar, Snehal
Liu, Mohan
Marzari, Nicola http://orcid.org/0000-0002-9764-0199
Morris, Andrew J. http://orcid.org/0000-0001-7453-5698
Mostofi, Arash A. http://orcid.org/0000-0002-6883-8278
Persson, Kristin A.
Petretto, Guido http://orcid.org/0000-0001-7220-5417
Purcell, Thomas
Ricci, Francesco
Rose, Frisco
Scheffler, Matthias http://orcid.org/0000-0002-1280-9873
Speckhard, Daniel
Uhrin, Martin http://orcid.org/0000-0001-6902-1289
Vaitkus, Antanas
Villars, Pierre
Waroquiers, David
Wolverton, Chris
Wu, Michael
Yang, Xiaoyu
Funding for this research was provided by:
Vetenskapsrådet (2016-04810)
U.S. Department of Energy (DE-AC02-05-CH11231, DE-AC02-05-CH11231, MICCoM, DE-AC02-05-CH11231, DE-AC02-05-CH11231, DE-AC02-05-CH11231, DE-AC02-05-CH11231)
EC | Horizon 2020 Framework Programme (951786, 689868, 689868, 824143, 951786, 951786, 824143, 760173, 654360, 951786, 951786, 824143, 760173, 824143, 760173, 824143, 760173, 689868, 951786)
RCUK | Engineering and Physical Sciences Research Council (EP/L015552/1, EP/M022595/1, EP/T026642/1)
U.S. Department of Commerce (CHiMaD, CHiMaD, CHiMaD)
U.S. Department of Defense (N00014-17-1-2090, N00014-17-1-2876, N00014-17-1-2876, N00014-17-1-2090, N00014-17-1-2876, N00014-17-1-2090, N00014-17-1-2876, N00014-17-1-2090, N00014-17-1-2090, N00014-17-1-2090, N00014-17-1-2876)
National Science Foundation (DMR-1921909, DMR-1921909, DMR-1921909, DMR-1921909, DMR-1921909, DMR-1921909)
Swiss National Science Foundation | National Center of Competence in Research Materials' Revolution: Computational Design and Discovery of Novel Materials (51NF40-182892, 51NF40-182892, 51NF40-182892, 51NF40-182892, 51NF40-182892)
Fonds De La Recherche Scientifique - FNRS
Swiss National Science Foundation | National Center of Competence in Research Materials' Revolution: Computational Design and Discovery of Novel Materials
Swiss National Science Foundation | National Center of Competence in Research Materials' Revolution: Computational Design and Discovery of Novel Materials
Swiss National Science Foundation | National Center of Competence in Research Materials' Revolution: Computational Design and Discovery of Novel Materials
Swiss National Science Foundation | National Center of Competence in Research Materials' Revolution: Computational Design and Discovery of Novel Materials
Article History
Received: 2 March 2021
Accepted: 23 June 2021
First Online: 12 August 2021
Competing interests
: G.J.C. is a shareholder and Director of Intellegens Ltd. G.H., G.Pe., G.-M.R. and D.Wa. are shareholders and Directors of Matgenix SRL. The other authors declare no competing commercial interests.