Research Articles
The Invisible Dance: Unlocking the Secrets of Carbonofluoridic Acid
Explore the quantum chemical properties of carbonofluoridic acid, a fleeting molecule revealing secrets about chemical bonds and quantum mechanics.
How AI Is Solving Quantum Chemistry's Hardest Puzzle
The same technology that powers ChatGPT is now cracking the secrets of molecular behavior through Transformer-based frameworks like QiankunNet.
The Quantum River: How Water's Secret Dance Powers Your Body
Explore how water facilitates proton transfer in biomolecules through quantum chemical investigations, revealing the quantum ballet that powers life itself.
Quantum Chemistry Unlocks the Secrets of a Life-Saving Cancer Drug
Discover how quantum chemistry reveals the molecular mechanisms of cisplatin, a revolutionary cancer drug, through computational studies and DNA binding analysis.
Quantum Echoes: How Quantum Computing Is Revolutionizing Molecular Science
Explore how quantum computing is transforming molecular science through quantum echoes, quantum advantage, and innovative algorithms for drug discovery and materials science.
Voyages in Molecular Space: Vincenzo Aquilanti's Exploration of Chemical Worlds
Explore the scientific journey of Vincenzo Aquilanti, his pioneering work in molecular dynamics, and his contributions to understanding quantum chemical processes.
The Quantum Theory of Atoms in Molecules: From Solid State to DNA and Drug Design
Explore how QTAIM revolutionizes molecular understanding from materials science to medicine through electron density analysis.
Seeing the Unseen: How Ab Initio Programs Decode Nature's Blueprint
Explore how high-accuracy ab initio programs like MOLPRO 2000 are revolutionizing molecular science by predicting chemical phenomena from first principles.
The Silent Dance of Atoms: How Quantum Interference Guides Chemical Reactions
Discover how quantum coherence and interference are revolutionizing our understanding of chemical reactions at the atomic level.
Beyond the Freeze-Frame: How Scientists Are Capturing Molecules in Motion
Discover how scientists are breaking the adiabatic approximation to capture molecular motion in unprecedented detail using machine learning and advanced simulations.