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20022023
most citedAdvanced capabilities for materials modelling with Quantum ESPRESSO

7.7k citations

Showing 2014 · cond-mat.str-elShow all

15 papers · 2 filters

cond-mat.str-el201462 cited

Dynamical Screening Effects in Correlated Electron Materials -- A Progress Report on Combined Many-Body Perturbation and Dynamical Mean Field Theory: "GW+DMFT"

Silke Biermann

We give a summary of recent progress in the field of electronic structure calculations for materials with strong electronic Coulomb correlations. The discussion focuses on developm…

cond-mat.str-el2014123 cited

Bands, resonances, edge singularities and excitons in core level spectroscopy investigated within the dynamical mean field theory

M. W. Haverkort, G. Sangiovanni, P. Hansmann +3

Using a recently developed impurity solver we exemplify how dynamical mean field theory captures band excitations, resonances, edge singularities and excitons in core level x-ray a…

cond-mat.str-el201414 cited

Electronic correlations in Fe at Earth's inner core conditions: effect of doping with Ni

O. Yu. Vekilova, L. V. Pourovskii, I. A. Abrikosov +1

We have studied the body-centered cubic (bcc), face-centered cubic (fcc) and hexagonal close-packed (hcp) phases of Fe alloyed with 25 at. % of Ni at Earth's core conditions using…

cond-mat.str-el20148 cited

Diagrammatic series for extremely correlated Fermi liquids

Edward Perepelitsky, B. Sriram Shastry

The recently developed theory of extremely correlated Fermi liquids (ECFL), applicable to models involving the physics of Gutzwiller projected electrons, shows considerable promise…

cond-mat.str-el2014138 cited

Low-energy description of the metal-insulator transition in the rare-earth nickelates

Alaska Subedi, Oleg E. Peil, Antoine Georges

We propose a simple theoretical description of the metal-insulator transition of rare-earth nickelates. The theory involves only two orbitals per nickel site, corresponding to the…

cond-mat.str-el201443 cited

A weakly correlated Fermi liquid state with a small Fermi surface in lightly doped SrIrO

Alberto de la Torre, Emily Claire Hunter, Alaska Subedi +7

We characterize the electron doping evolution of (SrLa)IrO by means of angle-resolved photoemission. Concomitant with the metal insulator transition around…