Alibaba DAMO Academy: AI autonomously discovers four new superconducting materials, which have been experimentally verified.
On July 3, Alibaba DAMO Academy announced that its AI agent ElementsClaw, developed in collaboration with Renmin University of China, the University of Chinese Academy of Sciences, and other institutions, has successfully discovered and experimentally verified four novel superconducting materials. The findings have been published on the arXiv preprint platform.
According to DAMO Academy, ElementsClaw adopts a "specialized-general-integrated" architecture: based on 125 million molecular and crystal structure data, it pre-trains a 1B-parameter atomic fundamental model, achieving an AUC of 0.996 for predicting superconductivity, with an average error of less than 1K in the critical temperature. The AI completed the screening of 2.4 million crystal structures in just 28 GPU hours, predicting 68,000 superconducting candidate materials. The team validated four materials, including Hf21Re25, Zr4VRe7, HfZrRe4, and Zr3ScRe8, with a critical temperature reaching up to 6.5K.
Rong Yu, head of scientific intelligence at DAMO Academy, stated that these are the first superconducting materials discovered and validated by the AI agent, verifying the framework's potential in materials discovery. Huang Wenbing, associate professor at the Gaoling School of Artificial Intelligence, Renmin University of China, said that this AI agent is also expected to be applied to the discovery of new materials such as solid-state battery electrolytes and heterogeneous catalysts. DAMO Academy has already made its relevant prediction database available to researchers free of charge.