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OPTIMADE, an API for exchanging materials data.
Andersen, Casper W; Armiento, Rickard; Blokhin, Evgeny; Conduit, Gareth J; Dwaraknath, Shyam; Evans, Matthew L; Fekete, Ádám; Gopakumar, Abhijith; Grazulis, Saulius; Merkys, Andrius; Mohamed, Fawzi; Oses, Corey; Pizzi, Giovanni; Rignanese, Gian-Marco; Scheidgen, Markus; Talirz, Leopold; Toher, Cormac; Winston, Donald; Aversa, Rossella; Choudhary, Kamal; Colinet, Pauline; Curtarolo, Stefano; Di Stefano, Davide; Draxl, Claudia; Er, Suleyman; Esters, Marco; Fornari, Marco; Giantomassi, Matteo; Govoni, Marco; Hautier, Geoffroy; Hegde, Vinay; Horton, Matthew K; Huck, Patrick; Huhs, Georg; Hummelshøj, Jens; Kariryaa, Ankit; Kozinsky, Boris; Kumbhar, Snehal; Liu, Mohan; Marzari, Nicola; Morris, Andrew J; Mostofi, Arash A; Persson, Kristin A; Petretto, Guido; Purcell, Thomas; Ricci, Francesco; Rose, Frisco; Scheffler, Matthias; Speckhard, Daniel; Uhrin, Martin.
Affiliation
  • Andersen CW; Theory and Simulation of Materials (THEOS), and National Centre for Computational Design and Discovery of Novel Materials (MARVEL), École Polytechnique Fédérale de Lausanne, 1015, Lausanne, Switzerland.
  • Armiento R; Materials Design and Informatics unit, Department of Physics, Chemistry and Biology, Linköping University, Linköping, Sweden.
  • Blokhin E; Tilde Materials Informatics, Straßmannstraße 25, 10249, Berlin, Germany.
  • Conduit GJ; Materials Platform for Data Science, Sepapaja 6, 15551, Tallinn, Estonia.
  • Dwaraknath S; Theory of Condensed Matter Group, Cavendish Laboratory, 19 J.J. Thomson Avenue, Cambridge, CB3 0HE, United Kingdom.
  • Evans ML; Lawrence Berkeley National Laboratory, 1 Cyclotron Rd, Berkeley, CA 94720, USA.
  • Fekete Á; Theory of Condensed Matter Group, Cavendish Laboratory, 19 J.J. Thomson Avenue, Cambridge, CB3 0HE, United Kingdom.
  • Gopakumar A; UCLouvain, Institut de la Matière Condensée et des Nanosciences (IMCN), Chemin des Étoiles 8, Louvain-la-Neuve, 1348, Belgium.
  • Grazulis S; UCLouvain, Institut de la Matière Condensée et des Nanosciences (IMCN), Chemin des Étoiles 8, Louvain-la-Neuve, 1348, Belgium.
  • Merkys A; Department of Physics, King's College London, London, United Kingdom.
  • Mohamed F; Department of Materials Science and Engineering, Northwestern University, Evanston, IL, 60208, USA.
  • Oses C; Institute of Biotechnology, Life Science Center, Vilnius University, Sauletekio av. 7, LT-10257, Vilnius, Lithuania.
  • Pizzi G; Institute of Computer Science, Faculty of Mathematics and Informatics, Vilnius University, Naugarduko g. 24, LT-03225, Vilnius, Lithuania.
  • Rignanese GM; Institute of Biotechnology, Life Science Center, Vilnius University, Sauletekio av. 7, LT-10257, Vilnius, Lithuania.
  • Scheidgen M; Fritz-Haber-Institut der Max-Planck-Gesellschaft, Faradayweg 4-6, 14195, Berlin, Germany.
  • Talirz L; Center for Autonomous Materials Design, Duke University, Durham, NC, 27708, USA.
  • Toher C; Department of Mechanical Engineering and Materials Science, Duke University, Durham, NC, 27708, USA.
  • Winston D; Theory and Simulation of Materials (THEOS), and National Centre for Computational Design and Discovery of Novel Materials (MARVEL), École Polytechnique Fédérale de Lausanne, 1015, Lausanne, Switzerland.
  • Aversa R; UCLouvain, Institut de la Matière Condensée et des Nanosciences (IMCN), Chemin des Étoiles 8, Louvain-la-Neuve, 1348, Belgium. gian-marco.rignanese@uclouvain.be.
  • Choudhary K; Fritz-Haber-Institut der Max-Planck-Gesellschaft, Faradayweg 4-6, 14195, Berlin, Germany.
  • Colinet P; Humboldt-Universität zu Berlin, Institut für Physik and IRIS Adlershof, 12489, Berlin, Germany.
  • Curtarolo S; Theory and Simulation of Materials (THEOS), and National Centre for Computational Design and Discovery of Novel Materials (MARVEL), École Polytechnique Fédérale de Lausanne, 1015, Lausanne, Switzerland.
  • Di Stefano D; Laboratory of Molecular Simulation (LSMO), École Polytechnique Fédérale de Lausanne, 1951, Sion, Switzerland.
  • Draxl C; Center for Autonomous Materials Design, Duke University, Durham, NC, 27708, USA.
  • Er S; Department of Mechanical Engineering and Materials Science, Duke University, Durham, NC, 27708, USA.
  • Esters M; Lawrence Berkeley National Laboratory, 1 Cyclotron Rd, Berkeley, CA 94720, USA.
  • Fornari M; National Research Council-Istituto Officina dei Materiali (CNR-IOM), 34136, Trieste, Italy.
  • Giantomassi M; Karlsruhe Institute of Technology (KIT), Hermann-von-Helmholtz-Platz 1, 76344, Eggenstein-Leopoldshafen, Germany.
  • Govoni M; Materials Measurement Laboratory, National Institute of Standards and Technology, Gaithersburg, MD, 20899, USA.
  • Hautier G; Center for Autonomous Materials Design, Duke University, Durham, NC, 27708, USA.
  • Hegde V; Department of Mechanical Engineering and Materials Science, Duke University, Durham, NC, 27708, USA.
  • Horton MK; Center for Autonomous Materials Design, Duke University, Durham, NC, 27708, USA.
  • Huck P; Department of Mechanical Engineering and Materials Science, Duke University, Durham, NC, 27708, USA.
  • Huhs G; Ansys, 300 Rustat House, 62 Clifton Rd, Cambridge, CB1 7EG, United Kingdom.
  • Hummelshøj J; Humboldt-Universität zu Berlin, Institut für Physik and IRIS Adlershof, 12489, Berlin, Germany.
  • Kariryaa A; Dutch Institute for Fundamental Energy Research (DIFFER), De Zaale 20, 5612 AJ, Eindhoven, The Netherlands.
  • Kozinsky B; Center for Autonomous Materials Design, Duke University, Durham, NC, 27708, USA.
  • Kumbhar S; Department of Mechanical Engineering and Materials Science, Duke University, Durham, NC, 27708, USA.
  • Liu M; Center for Autonomous Materials Design, Duke University, Durham, NC, 27708, USA.
  • Marzari N; Department of Physics and Science of Advanced Materials Program, Central Michigan University, Mount Pleasant, Michigan, 48859, USA.
  • Morris AJ; UCLouvain, Institut de la Matière Condensée et des Nanosciences (IMCN), Chemin des Étoiles 8, Louvain-la-Neuve, 1348, Belgium.
  • Mostofi AA; Argonne National Laboratory, Lemont, IL, 60439, USA.
  • Persson KA; UCLouvain, Institut de la Matière Condensée et des Nanosciences (IMCN), Chemin des Étoiles 8, Louvain-la-Neuve, 1348, Belgium.
  • Petretto G; Thayer School of Engineering, Dartmouth College, Hanover, NH, 03755, USA.
  • Purcell T; Department of Materials Science and Engineering, Northwestern University, Evanston, IL, 60208, USA.
  • Ricci F; Lawrence Berkeley National Laboratory, 1 Cyclotron Rd, Berkeley, CA 94720, USA.
  • Rose F; Lawrence Berkeley National Laboratory, 1 Cyclotron Rd, Berkeley, CA 94720, USA.
  • Scheffler M; Humboldt-Universität zu Berlin, Institut für Physik and IRIS Adlershof, 12489, Berlin, Germany.
  • Speckhard D; Toyota Research Institute (TRI), Los Altos, California, 94022, USA.
  • Uhrin M; Department of Computer Science, University of Copenhagen, Universitetsparken 1, 2100, Copenhagen, Denmark.
Sci Data ; 8(1): 217, 2021 08 12.
Article in En | MEDLINE | ID: mdl-34385453
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Full text: 1 Collection: 01-internacional Database: MEDLINE Language: En Journal: Sci Data Year: 2021 Document type: Article Affiliation country: Suiza
Fulltext
Add to My VHL
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XML
PubMed Links
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Full text: 1 Collection: 01-internacional Database: MEDLINE Language: En Journal: Sci Data Year: 2021 Document type: Article Affiliation country: Suiza