What is missing in autonomous discovery: open challenges for the community

Author:

Maffettone Phillip M.12ORCID,Friederich Pascal34ORCID,Baird Sterling G.5,Blaiszik Ben67ORCID,Brown Keith A.8ORCID,Campbell Stuart I.1ORCID,Cohen Orion A.9,Davis Rebecca L.10ORCID,Foster Ian T.67,Haghmoradi Navid3ORCID,Hereld Mark67ORCID,Joress Howie11,Jung Nicole12,Kwon Ha-Kyung13ORCID,Pizzuto Gabriella14ORCID,Rintamaki Jacob15,Steinmann Casper16ORCID,Torresi Luca4,Sun Shijing1317

Affiliation:

1. National Synchrotron Light Source II, Brookhaven National Laboratory, Upton, NY 11973, USA

2. BigHat Biosciences, San Mateo, CA 94403, USA

3. Karlsruhe Institute of Technology, Institute of Nanotechnology, Hermann-von-Helmholtz-Platz 1, Eggenstein-Leopoldshafen, 76344, Germany

4. Karlsruhe Institute of Technology, Institute of Theoretical Informatics, Engler-Bunte-Ring 8, 76131, Karlsruhe, Germany

5. University of Utah, Salt Lake City, UT 84108, USA

6. University of Chicago, Chicago, IL 60637, USA

7. Argonne National Laboratory, Lemont, IL 60439, USA

8. Boston University, Boston, MA 02215, USA

9. Materials Science Division, Lawrence Berkeley National Laboratory, Berkeley, CA 94720, USA

10. University of Manitoba, Winnipeg, Manitoba R3T 2N2, Canada

11. Materials Measurement Science Divison, National Institute of Standards and Technology, Gaithersburg, MD 20899, USA

12. Karlsruhe Institute of Technology, Institute of Biological and Chemical Systems, Hermann-von-Helmholtz-Platz 1, Eggenstein-Leopoldshafen, 76344, Germany

13. Toyota Research Institute, Los Altos, CA 94022, USA

14. University of Liverpool, Liverpool, L69 3BX, UK

15. Stanford University, Stanford, CA, 94305, USA

16. Department of Chemistry and Bioscience, Aalborg University, 9220, Aalborg, Denmark

17. University of Washington, Seattle, WA, 98195, USA

Abstract

Self-driving labs (SDLs) leverage combinations of artificial intelligence, automation, and advanced computing to accelerate scientific discovery.

Funder

Bundesministerium für Bildung und Forschung

Villum Fonden

Brookhaven National Laboratory

Basic Energy Sciences

Argonne National Laboratory

U.S. Department of Energy

Publisher

Royal Society of Chemistry (RSC)

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