Cutting-Edge Theoretical Studies

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

Research Articles

Tuning Quantum Materials: How Chemical Pressure Reveals Hidden Electronic States

Exploring how chemical pressure tunes van Hove singularities in iron-based superconductors KFe₂As₂ and CsFe₂As₂ using ARPES technology

Jaxon Cox
Oct 13, 2025

The Jahn-Teller Effect: How Molecular Distortions Shape Our World

Explore the fascinating world of vibronic interactions and the Jahn-Teller effect, from quantum computing to advanced battery technology.

Julian Foster
Aug 22, 2025

The Hidden Symphony: Decoding the Electronic Secrets of Complex Solids

Exploring the quantum world of complex solids, their electronic properties, and revolutionary applications in modern technology.

Nathan Hughes
Aug 10, 2025

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