Independent-Atom Reference State Offers Accurate, Low-Cost Reaction Energetics Modeling

November 24, 2025
Professor Alexander V. Mironenko and his team at the University of Illinois Urbana-Champaign have developed a new theoretical framework that may change how engineers predict the energetics of chemical reactions. Their work focuses on reducing the cost and complexity of quantum mechanical calculations without lowering accuracy, an issue that has long limited the routine use

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