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 Great Polymer Puzzle: Are All Glasses Created Equal?

Explore the fascinating science behind polymer glass transition and discover how intramolecular barriers make plastics behave differently from standard glass-forming systems.

Joshua Mitchell
Oct 07, 2025

The Knotty Problem of Ring Polymers: How Flexibility Shapes Their Structure

Exploring how local flexibility affects knot positioning in ring polymers and its implications for biological systems and advanced materials

Natalie Ross
Oct 05, 2025

The Hidden Architecture of Polymers: How Molecular Rigidity Rewrites the Rules of Self-Assembly

Exploring how molecular rigidity and chemical randomness in polymers create unexpected nanostructures through field-theoretic simulations.

Aria West
Aug 09, 2025

Unlocking the Future: The Rise of Tractable High-Performance Polymers

Explore the revolutionary advancements in tractable high-performance polymers that promise self-healing materials, ultra-fast charging batteries, and sustainable plastics.

Lily Turner
Aug 09, 2025

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