Where will curiosity lead you?
Batista Group at Yale University explores how quantum mechanics, dynamics, computing, and machine learning can be used to solve problems in physics, chemistry, biology, and beyond.
Resources & Links
Energy Sciences Institute
Visit WebsiteYale's hub for energy research and innovation
Center for Quantum Dynamics
ExploreNew paradigms for quantum simultions of complex systems
GitHub
View CodeOur open-source code repositories
Tutorials
ExploreLearn how to use our tools and models
ML Models
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Our Publications
BrowseCheck out our latest findings!
Latest News
MOSAIC paper has been highlighted in Chemical & Engineering News!
April 24, 2026Congratulations to Jinchan for winning the poster award at the Eastern Regional Photosynthesis Conference!
April 19, 2026Congratulations to Chris for winning the Rosenfeld Science Scholars Fellowship! We’re excited to have you join us for the summer!
April 17, 2026Congratulations to Jinchan for successfully defending her thesis! We’re excited to see the many impactful contributions you’ll continue to make at the forefront of photosynthesis research and water oxidation.
April 6, 2026Congratulations to Brent for winning the First Year Fellowship! We’re excited to have you join us for the summer!
April 4, 2026Congratulations to Delmar on successfully defending his thesis! We’re excited to see the many impactful contributions you’ll continue to make at the intersection of quantum computing and chemistry.
March 13, 2026Congratulations to Jana for defending her thesis! We all wish you the best of luck in your future!
March 9, 2025Congratulations to Anton for defending his thesis! We all wish you the best of luck in your future and we look forward to many more important AI developments for Chemistry!
March 5, 2026Congratulations to Michael for defending his thesis! We all wish you the best of luck in your future!
March 5, 2025MOSAIC paper has been published in Nature and highlighted in Yale News
January 19, 2026