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 Glass That Defies Pressure: Unveiling Silica's Secret Pyrite Form

Discover how silica glass transforms under extreme pressure, revealing a dense pyrite-type structure that challenges our understanding of materials science.

Camila Jenkins
Oct 24, 2025

The Invisible Squeeze: How High Pressure Reveals a Hidden World of Materials

Explore how high-pressure crystallography transforms materials and unlocks new scientific possibilities through diamond anvil cells and synchrotron technology.

Samuel Rivera
Oct 21, 2025

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