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Vertex Corrections to the Conductivity

Vertex Corrections to the Conductivity

Karsten Held (ORCID: 0000-0001-5984-8549)
  • Grant DOI 10.55776/P30997
  • Funding program Principal Investigator Projects
  • Status ended
  • Start May 1, 2018
  • End April 30, 2021
  • Funding amount € 398,286

Disciplines

Physics, Astronomy (100%)

Keywords

    Strongly Correlated Electron Systems, Solid State Theory, Dynamical Mean Field Theory, Optical Conductivity

Abstract Final report

The strong interaction between electrons leads, in many solids, to strong correlations among them them. This correlation gives rise to some of the most fascinating physical phenomena such as high- temperature superconductivity and quantum criticality. On the other hand, correlated electron systems are particularly challenging to calculate. A successful method to this end is the dynamical mean field theory (DMFT)-both for model and actual material calculations. However DMFT only includes local electronic correlations. In recent years we have seen stunning progress to account also for non-local correlations beyond DMFT. This progress has been brought about through novel methods that are based on a combination of numerical and quantum field theoretical concepts. This development started with the dynamical vertex approximation (DGA) and allowed, among others, the calculation of critical exponents and pseudogaps in the spectrum. In the present project we enter uncharted territory by studying how the dynamical vertex effects the conductivity. This aspect is a blank spot for strongly correlated electron systems. For weakly correlated electron systems, we know from perturbation theory that such vertex corrections give rise to fascinating physical phenomena such as excitons in semiconductors and weak localization corrections to the conductivity in disordered systems. Thanks to the recently developed diagrammatic extensions of DMFT, we are now able to study the same kind of phenomena also for strongly correlated systems. As particularly important applications we will study: (1) Vertex corrections to the optical conductivity of the Hubbard model which has possible implications for recent experiments indicating unexpected electron scattering in high-temperature superconductors. (2) Oxide heterostructures, where the conductivity is the key for prospective oxide electronics and vertex corrections are considered important because of the thinness of the conducting interface. (3) The interplay of weak localization and excitons for the Falicov-Kimball model. (4) Vertex corrections to the conductance through a nanoscopic systems which are important to understand e.g. in the context of molecular electronics. As this is a journey into the unknown we may expect the discovery of completely new phenomena.

A new quasiparticle, the pi-ton, has been discovered in the FWF project VeCoCo Originally, Karsten Held and coworkers have been looking for something completely different in the FWF project VeCoCo. Calculating the optical conductivity, i.e., the DC conductivity at frequencies in the optical range, they were looking for excitons. These are quasiparticles, generated by light and found in semiconductors. Here, the light excites an electron from a low energy to a higher energy. The missing electron can also be considered as a hole. That is, an electron-hole pair is created. Since the electron is negatively charged and the hole is positively charged, there is an attractive interaction. The bound electron and hole form an exciton. However, the research team was studying semiconductors but so-called strongly correlated electron systems. These often show strong charge or antiferromagnetic fluctuations that alternate from site-to-site. Such an alternation can be described by an angle of 180 degrees or pi in radian. With the newly developed methodology, the computational study was not biased toward any particle kind of physics such as excitons. This paved the way for the discovery of a new particle, coined pi-ton by the researchers. It consists of two electron-hole pairs (instead of one for the exciton) that are coupled to the incoming and outgoing light. The two distinct electron-hole pairs are glued together by the charge and antiferromagnetic fluctuations of the system. These pi-tons have been identified in many models for strongly correlated electrons so that it only appears to be a matter of time before it is also found in experiment.

Research institution(s)
  • Technische Universität Wien - 100%
International project participants
  • Zhicheng Zhong, Chinese Academy of Sciences - China
  • Giorgio Sangiovanni, Julius-Maximilians-Universität Würzburg - Germany
  • Martin Eckstein, Universität Hamburg - Germany
  • Jean-Marc Triscone, University of Geneva - Switzerland
  • Philipp Werner, Universität Freiburg - Switzerland
  • Boris L. Altshuler, Columbia University New York - USA
  • Emanuel Gull, University of Michigan - USA

Research Output

  • 1364 Citations
  • 64 Publications
Publications
  • 2022
    Title The plain and simple parquet approximation: single-and multi-boson exchange in the two-dimensional Hubbard model
    DOI 10.1140/epjb/s10051-022-00329-6
    Type Journal Article
    Author Krien F
    Journal The European Physical Journal B
    Pages 69
    Link Publication
  • 2021
    Title Solving the Bethe-Salpeter equation with exponential convergence
    DOI 10.1103/physrevresearch.3.033168
    Type Journal Article
    Author Wallerberger M
    Journal Physical Review Research
    Pages 033168
    Link Publication
  • 2021
    Title Tiling with triangles: parquet and GW? methods unified
    DOI 10.1103/physrevresearch.3.013149
    Type Journal Article
    Author Krien F
    Journal Physical Review Research
    Pages 013149
    Link Publication
  • 2021
    Title Numerical solver for the time-dependent far-from-equilibrium Boltzmann equation
    DOI 10.1016/j.cpc.2021.107877
    Type Journal Article
    Author Wais M
    Journal Computer Physics Communications
    Pages 107877
    Link Publication
  • 2021
    Title Self-consistent ladder dynamical vertex approximation
    DOI 10.1103/physrevb.103.035120
    Type Journal Article
    Author Kaufmann J
    Journal Physical Review B
    Pages 035120
    Link Publication
  • 2021
    Title Parametrizations of local vertex corrections from weak to strong coupling: importance of the Hedin three-leg vertex
    DOI 10.48550/arxiv.2104.11534
    Type Preprint
    Author Harkov V
  • 2021
    Title Comparing scattering rates from Boltzmann and dynamical mean-field theory
    DOI 10.1103/physrevb.103.205141
    Type Journal Article
    Author Wais M
    Journal Physical Review B
    Pages 205141
    Link Publication
  • 2021
    Title Tracking the Footprints of Spin Fluctuations: A MultiMethod, MultiMessenger Study of the Two-Dimensional Hubbard Model
    DOI 10.1103/physrevx.11.011058
    Type Journal Article
    Author Schäfer T
    Journal Physical Review X
    Pages 011058
    Link Publication
  • 2023
    Title sparse-ir: Optimal compression and sparse sampling of many-body propagators
    DOI 10.1016/j.softx.2022.101266
    Type Journal Article
    Author Badr S
    Journal SoftwareX
  • 2018
    Title Parquet approximation for molecules: spectrum and optical conductivity of the Pariser-Parr-Pople model
    DOI 10.48550/arxiv.1812.04962
    Type Preprint
    Author Pudleiner P
  • 2022
    Title Explaining the pseudogap through damping and antidamping on the Fermi surface by imaginary spin scattering
    DOI 10.1038/s42005-022-01117-5
    Type Journal Article
    Author Krien F
    Journal Communications Physics
    Pages 336
    Link Publication
  • 2022
    Title Toward Functionalized Ultrathin Oxide Films: the Impact of Surface Apical Oxygen
    DOI 10.48550/arxiv.2202.10778
    Type Preprint
    Author Gabel J
  • 2022
    Title Hidden one-dimensional, strongly nested, and almost half-filled Fermi surface in Ba2CuO3+y superconductors
    DOI 10.1103/physrevb.105.085110
    Type Journal Article
    Author Worm P
    Journal Physical Review B
    Pages 085110
    Link Publication
  • 2022
    Title The plain and simple parquet approximation: single- and multi-boson exchange in the two-dimensional Hubbard model
    DOI 10.48550/arxiv.2202.00226
    Type Preprint
    Author Krien F
  • 2022
    Title Zoology of spin and orbital fluctuations in ultrathin oxide films
    DOI 10.48550/arxiv.2201.07058
    Type Preprint
    Author Pickem M
  • 2019
    Title Competition between antiferromagnetic and charge density wave fluctuations in the extended Hubbard model
    DOI 10.48550/arxiv.1905.03065
    Type Preprint
    Author Pudleiner P
  • 2019
    Title Competition between antiferromagnetic and charge density wave fluctuations in the extended Hubbard model
    DOI 10.1103/physrevb.100.075108
    Type Journal Article
    Author Pudleiner P
    Journal Physical Review B
    Pages 075108
    Link Publication
  • 2019
    Title Symmetric improved estimators for continuous-time quantum Monte Carlo
    DOI 10.1103/physrevb.100.075119
    Type Journal Article
    Author Kaufmann J
    Journal Physical Review B
    Pages 075119
    Link Publication
  • 2020
    Title Diagrammatic Monte Carlo Method for Impurity Models with General Interactions and Hybridizations
    DOI 10.48550/arxiv.2004.00721
    Type Preprint
    Author Li J
  • 2020
    Title Parquet dual fermion approach for the Falicov-Kimball model
    DOI 10.1103/physrevb.101.165101
    Type Journal Article
    Author Astleithner K
    Journal Physical Review B
    Pages 165101
    Link Publication
  • 2020
    Title Terahertz Excitonics in Carbon Nanotubes: Exciton Autoionization and Multiplication
    DOI 10.48550/arxiv.2004.02615
    Type Preprint
    Author Bagsican F
  • 2020
    Title Numerical solver for the time-dependent far-from-equilibrium Boltzmann equation
    DOI 10.48550/arxiv.2004.02683
    Type Preprint
    Author Wais M
  • 2020
    Title Truncated unity parquet solver
    DOI 10.1103/physrevb.101.155104
    Type Journal Article
    Author Eckhardt C
    Journal Physical Review B
    Pages 155104
    Link Publication
  • 2020
    Title Terahertz Excitonics in Carbon Nanotubes: Exciton Autoionization and Multiplication
    DOI 10.1021/acs.nanolett.9b05082
    Type Journal Article
    Author Bagsican F
    Journal Nano Letters
    Pages 3098-3105
    Link Publication
  • 2020
    Title Electric-field-controllable high-spin SrRuO3 driven by a solid ionic junction
    DOI 10.48550/arxiv.2003.11050
    Type Preprint
    Author Lu J
  • 2020
    Title Topotactic Hydrogen in Nickelate Superconductors and Akin Infinite-Layer Oxides ABO2
    DOI 10.1103/physrevlett.124.166402
    Type Journal Article
    Author Si L
    Journal Physical Review Letters
    Pages 166402
  • 2020
    Title Electric field controllable high-spin SrRuO3 driven by a solid ionic junction
    DOI 10.1103/physrevb.101.214401
    Type Journal Article
    Author Lu J
    Journal Physical Review B
    Pages 214401
    Link Publication
  • 2019
    Title Truncated Unity Parquet Solver
    DOI 10.48550/arxiv.1912.07469
    Type Preprint
    Author Eckhardt C
  • 2019
    Title Topotactic hydrogen in nickelate superconductors and akin infinite-layer oxides ABO2
    DOI 10.48550/arxiv.1911.06917
    Type Preprint
    Author Si L
  • 2019
    Title Electronic structure of rare-earth infinite-layer RNiO2(R=La,Nd)
    DOI 10.1103/physrevb.100.201106
    Type Journal Article
    Author Jiang P
    Journal Physical Review B
    Pages 201106
    Link Publication
  • 2019
    Title Atomic-Scale Metal–Insulator Transition in SrRuO3 Ultrathin Films Triggered by Surface Termination Conversion
    DOI 10.1002/adma.201905815
    Type Journal Article
    Author Lee H
    Journal Advanced Materials
  • 2019
    Title Parquet dual fermion approach for the Falicov-Kimball model
    DOI 10.48550/arxiv.1912.01908
    Type Preprint
    Author Astleithner K
  • 2019
    Title Parquet approximation for molecules: Spectrum and optical conductivity of the Pariser-Parr-Pople model
    DOI 10.1103/physrevb.99.125111
    Type Journal Article
    Author Pudleiner P
    Journal Physical Review B
    Pages 125111
    Link Publication
  • 2019
    Title Symmetric Improved Estimators for Continuous-time Quantum Monte Carlo
    DOI 10.48550/arxiv.1906.00880
    Type Preprint
    Author Kaufmann J
  • 2019
    Title Generic optical excitations of correlated systems: $\pi$-tons
    DOI 10.48550/arxiv.1902.09342
    Type Preprint
    Author Kauch A
  • 2019
    Title Interplay between magnetic and superconducting fluctuations in the doped 2d Hubbard model
    DOI 10.48550/arxiv.1901.09743
    Type Preprint
    Author Kauch A
  • 2020
    Title Nickelate superconductors -- a renaissance of the one-band Hubbard model
    DOI 10.48550/arxiv.2002.12230
    Type Preprint
    Author Kitatani M
  • 2020
    Title Generic Optical Excitations of Correlated Systems: p-tons
    DOI 10.1103/physrevlett.124.047401
    Type Journal Article
    Author Kauch A
    Journal Physical Review Letters
    Pages 047401
    Link Publication
  • 2020
    Title Robust skyrmion-bubble textures in SrRuO$_3$ thin films stabilized by magnetic anisotropy
    DOI 10.48550/arxiv.2001.07039
    Type Preprint
    Author Zhang P
  • 2020
    Title Robust skyrmion-bubble textures in SrRuO3 thin films stabilized by magnetic anisotropy
    DOI 10.1103/physrevresearch.2.032026
    Type Journal Article
    Author Zhang P
    Journal Physical Review Research
    Pages 032026
    Link Publication
  • 2020
    Title Nickelate superconductors—a renaissance of the one-band Hubbard model
    DOI 10.1038/s41535-020-00260-y
    Type Journal Article
    Author Kitatani M
    Journal npj Quantum Materials
    Pages 59
    Link Publication
  • 2020
    Title Diagrammatic Monte Carlo method for impurity models with general interactions and hybridizations
    DOI 10.1103/physrevresearch.2.033211
    Type Journal Article
    Author Li J
    Journal Physical Review Research
    Pages 033211
    Link Publication
  • 2020
    Title Statistical error estimates in dynamical mean-field theory and extensions thereof
    DOI 10.1103/physrevb.102.085124
    Type Journal Article
    Author Kappl P
    Journal Physical Review B
    Pages 085124
    Link Publication
  • 2020
    Title Fluctuation diagnostic of the nodal/antinodal dichotomy in the Hubbard model at weak coupling: a parquet dual fermion approach
    DOI 10.48550/arxiv.2010.05935
    Type Preprint
    Author Krien F
  • 2020
    Title Tiling with triangles: parquet and $GW\gamma$ methods unified
    DOI 10.48550/arxiv.2009.12868
    Type Preprint
    Author Krien F
  • 2020
    Title Broadening and sharpening of the Drude peak through antiferromagnetic fluctuations
    DOI 10.48550/arxiv.2010.15797
    Type Preprint
    Author Worm P
  • 2020
    Title How correlations change the magnetic structure factor of the kagome Hubbard model
    DOI 10.48550/arxiv.2011.01085
    Type Preprint
    Author Kaufmann J
  • 2020
    Title Particle-hole asymmetric lifetimes promoted by spin and orbital fluctuations in SrVO$_3$ monolayers
    DOI 10.48550/arxiv.2008.12227
    Type Preprint
    Author Pickem M
  • 2021
    Title Zoology of spin and orbital fluctuations in ultrathin oxide films
    DOI 10.1103/physrevb.104.024307
    Type Journal Article
    Author Pickem M
    Journal Physical Review B
    Pages 024307
    Link Publication
  • 2021
    Title Hidden, one-dimensional, strongly nested, and almost half-filled Fermi surface in Ba$_2$CuO$_{3+y}$ superconductors
    DOI 10.48550/arxiv.2107.11897
    Type Preprint
    Author Worm P
  • 2021
    Title Pitfalls and solutions for perovskite transparent conductors
    DOI 10.1103/physrevb.104.l041112
    Type Journal Article
    Author Si L
    Journal Physical Review B
    Link Publication
  • 2021
    Title Explaining the pseudogap through damping and antidamping on the Fermi surface by imaginary spin scattering
    DOI 10.48550/arxiv.2107.06529
    Type Preprint
    Author Krien F
  • 2021
    Title Defect-Engineered Dzyaloshinskii–Moriya Interaction and Electric-Field-Switchable Topological Spin Texture in SrRuO3
    DOI 10.1002/adma.202102525
    Type Journal Article
    Author Lu J
    Journal Advanced Materials
    Link Publication
  • 2021
    Title Efficient ab initio many-body calculations based on sparse modeling of Matsubara Green's function
    DOI 10.48550/arxiv.2106.12685
    Type Preprint
    Author Shinaoka H
  • 2021
    Title Asymmetric interfaces and high-TC ferromagnetic phase in La0.67Ca0.33MnO3/SrRuO3 superlattices
    DOI 10.1007/s12274-021-3644-0
    Type Journal Article
    Author Qu L
    Journal Nano Research
    Pages 3621-3628
  • 2021
    Title Parametrizations of local vertex corrections from weak to strong coupling: Importance of the Hedin three-leg vertex
    DOI 10.1103/physrevb.104.125141
    Type Journal Article
    Author Harkov V
    Journal Physical Review B
    Pages 125141
    Link Publication
  • 2021
    Title Broadening and sharpening of the Drude peak through antiferromagnetic fluctuations
    DOI 10.1103/physrevb.104.115153
    Type Journal Article
    Author Worm P
    Journal Physical Review B
    Pages 115153
    Link Publication
  • 2019
    Title Electronic structure of rare-earth infinite-layer ReNiO2 (Re=La, Nd)
    DOI 10.48550/arxiv.1909.13634
    Type Preprint
    Author Jiang P
  • 2021
    Title How correlations change the magnetic structure factor of the kagome Hubbard model
    DOI 10.1103/physrevb.104.165127
    Type Journal Article
    Author Kaufmann J
    Journal Physical Review B
    Pages 165127
    Link Publication
  • 2020
    Title Fluctuation diagnostic of the nodal/antinodal dichotomy in the Hubbard model at weak coupling: A parquet dual fermion approach
    DOI 10.1103/physrevb.102.235133
    Type Journal Article
    Author Krien F
    Journal Physical Review B
    Pages 235133
    Link Publication
  • 2021
    Title Toward Functionalized Ultrathin Oxide Films: The Impact of Surface Apical Oxygen
    DOI 10.1002/aelm.202101006
    Type Journal Article
    Author Gabel J
    Journal Advanced Electronic Materials
    Link Publication
  • 2022
    Title Efficient ab initio many-body calculations based on sparse modeling of Matsubara Green's function
    DOI 10.21468/scipostphyslectnotes.63
    Type Journal Article
    Author Shinaoka H
    Journal SciPost Physics Lecture Notes
    Pages 063
    Link Publication
  • 2022
    Title sparse-ir: optimal compression and sparse sampling of many-body propagators
    DOI 10.48550/arxiv.2206.11762
    Type Preprint
    Author Wallerberger M
  • 2020
    Title Solving the Bethe-Salpeter equation with exponential convergence
    DOI 10.48550/arxiv.2012.05557
    Type Preprint
    Author Wallerberger M

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