Cutting-Edge Theoretical Studies

Dive into peer-reviewed articles on DFT simulations, reaction mechanisms, and ab initio calculations shaping modern chemical science.

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The Proton's Wild Water Ride: Catching a Quantum Sprite in Action

How a century-old mystery of acid chemistry is finally being solved through resolving heterogeneous dynamics of excess protons in aqueous solution.

Jackson Simmons
Oct 12, 2025

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