PhD Thesis: Electronic correlations in multiorbital systems
arXiv:1912.04141
Abstract
The role of electronic correlations in Condensed Matter is at the heart of various important systems, like magnetic materials, superconductors, topological materials, optical lattices, etc. Electronic correlations are those which change the motion of individual electrons when considering the interaction with other electrons in the material. Among the available systems to study electronic correlation effects, in this thesis I focus on unconventional superconductors, specifically in high- iron-based superconductors, and on two-dimensional materials, like the recent magic-angle twisted bilayer graphene or the itinerant ferromagnet . In the introduction, I explained in detail the importance of electronic correlations, and how their strength can be modeled by the quasiparticle weight . I briefly reviewed the most important aspects of the Fermi Liquid Theory. Chapter 2 is devoted to explain in detail the role of electronic correlations in multiorbital systems, with a special attention to the role played by the Hund's coupling . Chapters 3 to 6 describe the calculations done in various real systems. During this thesis, I used a combination of ab-initio and modelling, plus slave-spin many-body approaches to study the effect of the Hubbard interaction and the Hund's coupling in various real systems. A detailed description of the techniques can be found in the appendixes.
arXiv commentPhD Thesis, 191 pages, Abstract and Conclusions in english and spanish, 3 detailed appendixes
References in corpus (134)
- The electronic properties of graphene
- Magic-angle graphene superlattices: a new platform for unconventional superconductivity
- Correlated Insulator Behaviour at Half-Filling in Magic Angle Graphene Superlattices
- Maximally-localized generalized Wannier functions for composite energy bands
- Moire bands in twisted double-layer graphene
- Superconductivity at 38 K in the iron arsenide (Ba1-xKx)Fe2As2
- Unconventional sign-reversing superconductivity in LaFeAsO_(1-x)F_x
- Unconventional pairing originating from disconnected Fermi surfaces in superconducting LaFeAsOF}
- High-temperature superconductivity in iron-based materials
- Evidence for superconductivity above 260 K in lanthanum superhydride at megabar pressures
- Local strain engineering in atomically thin MoS2
- Quantum Cluster Theories
- Flat Bands in Slightly Twisted Bilayer Graphene
- Kinetic frustration and the nature of the magnetic and paramagnetic states in iron pnictides and iron chalcogenides
- Black phosphorus: narrow gap, wide applications
- Dynamical singlets and correlation-assisted Peierls transition in VO2
- Magnetism, superconductivity, and pairing symmetry in Fe-based superconductors
- Strong Correlations and Magnetic Frustration in the High Tc Iron Pnictides
- Origin of the ~150 K Anomaly in LaOFeAs; Competing Antiferromagnetic Superexchange Interactions, Frustration, and Structural Phase Transition
- Optical Absorption in Twisted Bilayer Graphene
- A minimal two-band model for the superconducting Fe-pnictides
- Wien2wannier: From linearized augmented plane waves to maximally localized Wannier functions
- Topological Superconductivity in Twisted Multilayer Graphene
- Superlattice-induced insulating states and valley-protected orbits in twisted bilayer graphene
- Faithful Tight-binding Models and Fragile Topology of Magic-angle Bilayer Graphene
- Selective Mottness as a key to iron superconductors
- Mott Transition from a Spin Liquid to a Fermi Liquid in the Spin-Frustrated Organic Conductor kappa-(ET)2Cu2(CN)3
- Cluster Dynamical Mean Field Theory of the Mott Transition
- Chiral SDW and d + id superconductivity in the magic-angle twisted bilayer-graphene
- Spin freezing transition and non-Fermi-liquid self-energy in a 3-orbital model
- Orbital-Selective Mott transition out of band degeneracy lifting
- Slave-rotor mean field theories of strongly correlated systems and the Mott transition in finite dimensions
- Phases of a phenomenological model of twisted bilayer graphene
- Observation of Temperature-Induced Crossover to an Orbital-Selective Mott Phase in AFeSe (A=K, Rb) Superconductors
- Pressure-induced Superconductivity in the Iron-based Ladder Material BaFe2S3
- Quasiparticle mass enhancement approaching optimal doping in a high-Tc superconductor
- Tight-binding models for the new iron based superconductor materials
- Hund's coupling key role in multi-orbital correlations
- Bandwidth and Fermi surface of Iron-Oxypnictides: covalency and sensitivity to structural changes
- Electronic Structure Theory of Weakly Interacting Bilayers
- Observation of universal strong orbital-dependent correlation effects in iron chalcogenides
- Universal sheet resistance and revised phase diagram of the cuprate high-temperature superconductors
- Strong-coupling theory of superconductivity in a degenerate Hubbard model
- Dynamical Breakup of the Fermi Surface in a doped Mott Insulator
- Satellites and large doping- and temperature-dependence of electronic properties in hole-doped BaFe2As2
- Role of the orbital degree of freedom in iron-based superconductors
- Fate of the false Mott-Hubbard transition in two dimensions
- Using Gap Symmetry and Structure to Reveal the Pairing Mechanism in Fe-based Superconductors
- Evidence of Strong Correlations and Coherence-Incoherence Crossover in the Iron Pnictide Superconductor KFe2As2
- Electronic Correlation and Magnetism in the Ferromagnetic Metal Fe3GeTe2
- Spin-orbital quantum liquid on the honeycomb lattice
- Electrically controllable magnetism in twisted bilayer graphene
- Orbital-selective Mott Phase in Multiorbital Models for Alkaline Iron Selenides K(1-x)Fe(2-y)Se2
- Pairing symmetry of interacting fermions on twisted bilayer graphene superlattice
- Theory of 2D crystals: graphene and beyond
- Integer filling metal insulator transitions in the degenerate Hubbard model
- Modeling the Fermi arc in underdoped cuprates
- Mott Transition in Degenerate Hubbard Models: Application to Doped Fullerenes
- Iron Displacements and Magnetoelastic Coupling in the Spin-Ladder Compound BaFe2Se3
- Revealing the dual nature of magnetism in iron pnictides and iron chalcogenides using x-ray emission spectroscopy
- Dichotomy between large local and small ordered magnetic moment in Iron-based superconductors
- Fermi-liquid, non-Fermi-liquid, and Mott phases in iron pnictides and cuprates
- Simultaneous dimerization and SU(4) symmetry breaking of 4-color fermions on the square lattice
- Charge-transfer insulation in twisted bilayer graphene
- Helical Network Model for Twisted Bilayer Graphene
- Pairing symmetry in a two-orbital Hubbard model on a square lattice
- Orbital Selectivity in Hund's metals: The Iron Chalcogenides
- Orbital Selective Magnetism in the Spin-Ladder Iron Selenides BaKFeSe
- U(1) Slave-spin theory and its application to Mott transition in a multi-orbital model for iron pnictides
- Finite temperature crossovers and the quantum Widom line near the Mott transition
- Block magnetism coupled with local distortion in the iron-based spin-ladder compound BaFe2Se3
- Non-local Coulomb interactions and metal-insulator transition in TiO: a cluster LDA+DMFT approach
- Electronic correlations in Hund metals
- Multi-Orbital Hubbard Model in Infinite Dimensions: Quantum Monte Carlo Calculation
- Ferromagnetism in the Hubbard model with orbital degeneracy in infinite dimensions
- Competing magnetic ground states in non-superconducting Ba(Fe1-xCrx)2As2
- Ab initio Evidence for Strong Correlation Associated with Mott Proximity in Iron-based Superconductors
- Mott transition at large orbital degeneracy: dynamical mean-field theory
- Magnetic interactions in iron superconductors: A review
- Strong Correlations, Strong Coupling and s-wave Superconductivity in Hole-doped BaFe2As2 Single Crystals
- Itinerant antiferromagnetism in BaCrAs
- Mott insulating states and quantum phase transitions of correlated SU(2N) Dirac fermions
- Orbital differentiation and the role of orbital ordering in the magnetic state of Fe superconductors
- Magnetic States of the Two-Leg Ladder Alkali Metal Iron Selenides FeSe
- The nature of correlations in the insulating states of twisted bilayer graphene
- Proposal for an Experiment to Test a Theory of High Temperature Superconductors
- The phase diagrams of iron-based superconductors: theory and experiments
- Experimental Observation of Incoherent-Coherent Crossover and Orbital Dependent Band Renormalization in Iron Chalcogenide Superconductors
- Sequential structural and antiferromagnetic transitions in BaFeSe under pressure
- Nematicity at the Hund's metal crossover in iron superconductors
- Correlation induced spin freezing transition in FeSe: a dynamical mean field study
- Fermi surface in KFe2As2 determined via de Haas-van Alphen oscillation measurements
- From antiferromagnetic insulator to correlated metal in pressurized and doped LaMnPO
- Quantum criticality in AFe2As2 with A = K, Rb, and Cs suppresses superconductivity
- Pressure Induced Metallization of BaMn2As2
- Tight binding model for iron pnictides
- Itinerant and local-moment magnetism in EuCr2As2 single crystals
- Antiferromagnetism and Superconductivity in Cerium based Heavy Fermion Compounds
- The magnetic precursor of the pressure-induced superconductivity in Fe-ladder compound
- Magnetic properties and pairing tendencies of the iron-based superconducting ladder BaFeS: combined ab initio and density matrix renormalization group study
- Antiferromagnetic structure and electronic properties of BaCr2As2 and BaCrFeAs2
- Persistence of local-moment antiferromagnetic order in Ba(1-x)KxMn2As2
- Orbital order and fluctuations in the two-leg ladder materials BaFe ( = S and Se) and CsFeSe
- Magnetic structure and spin excitations in BaMn2Bi2
- Nonlocal correlations induced by Hund's coupling: a cluster DMFT study
- First-principles study of magnetic properties in Fe-ladder compound BaFe2S3
- Evidences of Mott physics in iron pnictides from x-ray spectroscopy
- Crystal, magnetic, and electronic structures, and properties of new BaMnPnF (Pn = As, Sb, Bi)
- Itinerant ferromagnetism in the As 4 conduction band of BaKMnAs identified by x-ray magnetic circular dichroism
- From Hunds insulator to Fermi liquid: Optical spectroscopy study of K doping in BaMnAs
- Modeling many-body physics with Slave-Spin Mean-Field: Mott and Hund's physics in Fe-superconductors
- Non-local correlations in the orbital selective Mott phase of a one dimensional multi-orbital Hubbard model
- Chromium analogues of Iron-based superconductors
- Spin reorientation and Ce-Mn coupling in antiferromagnetic oxypnictide CeMnAsO
- Electronic and Magnetic Structure of Possible Iron Based Superconductor BaFe2Se3
- Coexistence of localized and itinerant electrons in BaFe2X3 (X = S and Se) revealed by photoemission spectroscopy
- Metal-insulator transitions, superconductivity, and magnetism in the two-band Hubbard model
- Strong correlations and the search for high-Tc superconductivity in chromium pnictides and chalcogenides
- Linear Flavor-Wave Theory for Fully Antisymmetric Irreducible Representations
- Coulomb correlations in the honeycomb lattice: role of translation symmetry
- Structure and magnetic properties of {\it Ln}MnSbO ({\it Ln} = La and Ce) and CeMnAsO
- Correlation, doping and interband effects on the optical conductivity of iron superconductors
- Observation of a remarkable reduction of correlation effects in BaCr2As2 by ARPES
- Importance of effective dimensionality in manganese pnictides
- Ba{0.4}Rb{0.6}Mn2As2: A Prototype Half-Metallic Ferromagnet
- Non-trivial role of interlayer cation states in iron-based superconductors
- Spatial fluctuations of spin and orbital in two-orbital Hubbard model
- Competing valence bond and symmetry breaking Mott states of spin-3/2 fermions on a honeycomb lattice
- Evidence for the formation of magnetic moments in the cuprate superconductor HgCuBaCaCuO below seen by NQR
- The Electronic and Magnetic Properties of Magnetoresistant Nd1-xSrxMnAsO Oxyarsenides
- Correlated Dirac semimetal by periodized cluster dynamical mean-field theory
- Genuine Electronic States of Vanadium Perovskites Revealed by High-Energy Photoemission
- Large resistivity change and phase transition in LiMnAs
- Half-metallic Antiferromagnet Sheets in Sr4M2O6CrFeAs2 (M=Sc, Cr) and Their Bulk Form