Spectral Density Functionals for Electronic Structure Calculations
S. Y. Savrasov, G. Kotliar
Abstract
We introduce a functional of the local spectral electron density which can be used to to compute the total energy and the local spectral function of strongly-correlated materials. We illustrate the applicability of the method by using as an example the long-standing problem of the electronic structure of metallic plutonium.
Create a lesson
Related papers
Spacetime Dynamics of Altermagnetic Magnons
Ali Emami Kopaei, Karthik Subramaniam Eswaran, Krzysztof Wohlfeld
Engineering Weak Universality with Quantum Dots
Warre Missiaen, Michael Wimmer, Natalia Chepiga
Lyapunov-controlled thermalization: an exact real-time example
Jonas Loy, Jan C. Louw
Multiconfigurational Analysis of Local Electronic Structure of RuO2 Using Relativistic Embedded Clusters
Zhosan I. A., Lomachuk Yu. V., Maltsev D. A. et al.
Unconstrained compact lattice QED2+1 coupled to phonons: Gauss sectors, orthogonal semimetal, and deconfined criticality
João C. Inácio, Fakher F. Assaad
Collective Charge-\(2e\) Bosonic Excitations in Charge-Ordered Systems
Ping Tang