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Authors
Ko, Tsz Wai
Deng, Bowen
Nassar, Marcel
Barroso-Luque, Luis
Liu, Runze
Qi, Ji
Thakur, Atul C.
Mishra, Adesh Rohan
Liu, Elliott
Ceder, Gerbrand
Miret, Santiago
Ong, Shyue Ping
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Funding
Funding for this research was provided by:
Schmidt Futures (Eric and Wendy Schmidt AI in Science Postdoctoral Fellowship)
The U.S. Department of Energy, Office of Science, Office of Basic Energy Sciences, Materials Sciences and Engineering Division (Contract No. DE-AC02-05-CH11231 (Materials Project program KC23MP), Contract No. DE-AC02-05-CH11231 (Materials Project program KC23MP))
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Article History
Received: 5 March 2025
Accepted: 17 July 2025
First Online: 5 August 2025
Competing interests
: G.C. and S.P.O. are Editorial Board Members of npj Computational Materials.
