Cutting-Edge Theoretical Studies

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

Research Articles

The Ultimate Stop-Motion: Filming the Electron's Quantum Dance

Explore how theoretical scientists capture the universe's fastest movements by studying electron dynamics in attoseconds.

Leo Kelly
Aug 20, 2025

Beyond Alchemy: The Science of Crafting Matter Atom by Atom

Exploring the revolutionary approach of materials by design (MBD) combining AI, quantum physics, and advanced manufacturing to create materials with atomic precision.

Joshua Mitchell
Aug 09, 2025

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