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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From Molecular Crystals to Catalytic Surfaces: The Invisible Frameworks Shaping Our World

Explore the fascinating world of molecular crystals, MOFs, and catalytic surfaces revolutionizing environmental cleanup and drug delivery through tailored molecular architectures.

Logan Murphy
Nov 14, 2025

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