Dynamical correlation in quantum electron liquids

Gurinder S. Atwal

Shafiqur M. Rahman

愛一郎 中野

J. S. Thakur

T. Egami

Liquid and gas are distinct in their extent of dynamic atomic correlations; in gas atoms are almost uncorrelated whereas they are strongly correlated in liquid. This distinction applies also to electronic systems. Fermi liquids are actually gas-like, whereas strongly correlated electrons are liquid-like. Doped Mott insulators share characteristics with supercooled liquids. Such distinctions have important implications on superconductivity. We discuss the evolution of dynamic atomic correlations in liquid with temperature, and a possible effect of dynamic correlations on the high-temperature superconductivity in the cuprates.

Gia-Wei Chern, Kipton M. Barros, Cristian D. Batista +2 more

We present a formulation of quantum molecular dynamics that includes electron correlation effects via the Gutzwiller method. Our new scheme enables the study of the dynamical behavior of atoms and molecules with strong electron interactions. The Gutzwiller approach goes beyond the conventional mean-field treatment of the intra-atomic electron repulsion and captures crucial correlation effects such as band narrowing and electron localization. We use Gutzwiller quantum molecular dynamics to investigate the Mott transition in the liquid phase of a single-band metal and uncover intriguing structural and transport properties of the atoms.