Scientists use quantum many-body data and machine learning to boost density functional theory accuracy for chemistry and ...

Due to its high electron mobilities at ambient temperature and peculiar electronic behaviors like the quantum hall effect, which imitates massless transportation and results in high superconductivity, ...

At its core, DFT postulates that the ground-state energy of a quantum system is a functional of the electron density. This principle, known as the Hohenberg-Kohn theorem, simplifies the problem of ...

A team develops layering-charged, polymer-based stable high-capacity anode material. The electric vehicle market has been experiencing explosive growth, with global sales surpassing $1 trillion ...