New AI Technique Unravels Quantum Atomic Vibrations in Materials

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Caltech scientists have developed an artificial intelligence (AI)–based method that dramatically speeds up calculations of the quantum interactions that take place in materials. In new work, the group focuses on interactions among atomic vibrations, or phonons—interactions that govern a wide range of material properties, including heat transport, thermal expansion, and phase transitions. The new machine learning approach could be extended to compute all quantum interactions, potentially

New AI Technique Unravels Quantum Atomic Vibrations in Materials https://www.caltech.edu/ - 16.09.2025 22:54

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New AI Technique Unravels Quantum Atomic Vibrations in Materials https://www.caltech.edu/ - 16.09.2025 22:54