Cutting-Edge Theoretical Studies

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

Research Articles

Iron-Peroxo Sites in MOFs: A Game Changer for Ethylene Purification

Discover how iron-peroxo sites in metal-organic frameworks are revolutionizing ethylene purification through advanced molecular separation technology.

Lucas Price
Oct 05, 2025

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