ELECTRONIC DENSITY OF STATES
CONTENTS INTRODUCTION STRONGLY CORRELATED MATERIALS BASIC MODELS IN STRONGLY CORRELATED SYSTEMS THEORY METHODS FOR MODELS INVESTIGATION AB-INITIO ELECTRONIC STRUCTURE CALCULATION METHODS ELECTRONIC STRUCTURE CALCULATIONS IN ONE-ELECTRON APPROXIMATION DENSITY FUNCTIONAL THEORY AND ELECTRONIC STRUCTURE CALCULATIONS METHODS DENSITY FUNCTIONAL THEORY ELECTRONIC STRUCTURE CALCULATIONS METHODS BASED ON DFT BREAKDOWN OF LOCAL DENSITY APPROXIMATION FOR STRONGLY CORRELATED SYSTEMS CORRECTIONS FOR ELECTRON–ELECTRON CORRELATIONS DETERMINING PROBLEM HAMILTONIAN FROM DENSITY FUNCTIONAL THEORY PROBLEM DE?NITION COULOMB INTERACTION HAMILTONIAN DOUBLE-COUNTING PROBLEM FOR COULOMB INTERACTION WANNIER FUNCTIONS AS COULOMB INTERACTION HAMILTONIAN BASIS COULOMB PARAMETER U VALUE FROM CONSTRAIN DFT CALCULATION STATIC MEAN-FIELD APPROXIMATION: LDA + U METHOD LDA + U METHOD APPLICATIONS MOTT INSULATORS: NIO, COO, AND CACUO2 CHARGE ORDERING: FE3O4 ORBITAL ORDERING: KCUF3 ORBITAL AND CHARGE ORDERING: PR0 5CA0 5MNO3 SPIN ORDERING: CAVNO2N+1 HUBBARD MODEL IN DYNAMICAL MEAN-FIELD THEORY REDUCING LATTICE MODEL TO E?ECTIVE SINGLE IMPURITY ANDERSON MODEL ELECTRONIC GREEN FUNCTION SINGLE IMPURITY ANDERSON MODEL BASIC DMFT EQUATIONS DMFT EQUATIONS FOR BETHE LATTICE METHODS FOR SOLUTION OF SINGLE IMPURITY ANDERSON MODEL QUANTUM MONTE CARLO METHOD AS SINGLE IMPURITY ANDERSON MODEL SOLVER HIRSCH–FYE ALGORITHM MAXIMUM ENTROPY METHOD FOR SPECTRAL FUNCTION CALCULATION QMC FOR SINGLE IMPURITY ANDERSON MODEL WITH ORBITAL DEGREES OF FREEDOM PROJECTIVE QUANTUM MONTE CARLO METHOD CONTINUOUS-TIME QMC HUBBARD MODEL SPECTRAL FUNCTION IN DMFT APPROXIMATION THREE PEAK SPECTRAL STRUCTURE FOR HALF-FILLING METAL–INSULATOR PHASE TRANSITION HUBBARD MODEL WITH DEVIATION FROM HALF-FILLING QUASIPARTICLE PEAK EVOLUTION PHASE DIAGRAM FOR T = 0 SPIN-POLARIZED CASE ANTIFERROMAGNETISM DMFT EQUATIONS WITH ANTIFERROMAGNETIC ORDER PARAMETER NRG METHOD RESULTS FOR AFM PHASE SUPERCONDUCTIVITY IN TWO-DIMENSIONAL HUBBARD MODEL DMFT EQUATIONS FOR SUPERCONDUCTING STATE COEXISTENCE PROBLEM FOR SUPERCONDUCTING AND ANTIFERROMAGNETIC ORDER PARAMETERS TRANSPORT PROPERTIES AND SUSCEPTIBILITY OPTICAL CONDUCTIVITY MAGNETIC SUSCEPTIBILITY DMFT EXTENSIONS T ?J MODEL AS A HUBBARD MODEL LIMIT HAMILTONIAN AND GREEN FUNCTION DMFT EQUATIONS DERIVATION REFORMULATION OF DMFT EQUATIONS NUMERICAL CALCULATION RESULTS DMFT EXTENSIONS FOR NONLOCAL COULOMB AND EXCHANGE INTERACTION CASE HAMILTONIAN AND GREEN FUNCTION FOR EXTENDED MODEL EDMFT FOR HOMOGENEOUS SYSTEM EDMFT FOR THE SYSTEM WITH TWO SUBLATTICES DMFT WITH ORBITAL DEGENERACY QMC IMPURITY SOLVER FOR THE PROBLEM WITH ORBITAL DEGENERACY EXCHANGE INTERACTIONS IN QMC CONTINUOUS-TIME QMC FOR TWO-ORBITAL MODEL TAKING INTO ACCOUNT SPATIAL FLUCTUATIONS HEURISTIC APPROACH TO DMFT EXTENSION FOR SPATIAL FLUCTUATIONS DYNAMICAL VERTEX APPROXIMATION PSEUDOGAP DYNAMICAL CLUSTER METHOD GENERATING FUNCTIONAL FOR GREEN FUNCTIONS BAYM-KADANO?FUNCTIONAL TOTAL ENERGY DMFT FOR SYSTEMS WITH DISORDER ANDERSON-HUBBARD MODEL PHASE DIAGRAM FOR NONMAGNETIC STATE PERIODIC ANDERSON MODEL (PAM ) EARLY STUDIES FOR PAM PAM AS A BASIC MODEL FOR HEAVY FERMION SYSTEMS REVIEW OF EARLY ANALYTICAL STUDIES FOR PAM DMFT FOR PAM PAM STUDIES BY DMFT METHOD DMFT(NRG) RESULTS AT T = 0 KONDO LATTICE DMFT FOR KONDO LATTICE NUMERICAL RENORM-GROUP METHOD FOR SINGLE IMPURITY KONDO PROBLEM SOLUTION TWO ENERGY SCALES PHOTOEMISSION SPECTRA CALCULATIONS BY NRG METHOD MAGNETIC ORDERING IN KONDO LATTICE STUDY BY CONTINUOUS-TIME QMC METHOD FERROMAGNETIC KONDO LATTICE DMFT EQUATIONS FOR SD-MODEL WITH CLASSICAL SPIN ANALYSIS OF DMFT EQUATIONS SOLUTION ELECTRONIC STRUCTURE CALCULATIONS FOR REAL MATERIALS BY LDA + DMFT METHOD COMBINING DENSITY FUNCTIONAL THEORY AND DYNAMICAL MEAN-FIELD THEORY: LDA + DMFT METHOD COULOMB INTERACTION COMPUTATION OF LATTICE AND LOCAL GREEN FUNCTIONS IN GENERAL CASE TOTAL ENERGY CALCULATION IN LDA + DMFT EARLY TRANSITION METAL OXIDES: MOTT INSULATORS AND STRONGLY CORRELATED METALS SRVO3: ONE ELECTRON IN DEGENERATE D-BAND, STRONGLY CORRELATED METAL V2O3: TWO ELECTRONS IN D-BAND WITH TRIGONAL CRYSTAL-FIELD SPLITTING LIV2O4: HEAVY FERMION IN D-ELECTRON SYSTEM LATE TRANSITION METAL OXIDES: CHARGE TRANSFER INSULATORS NIO: BAND STRUCTURE FOR CHARGE TRANSFER INSULATOR MNO: METAL–INSULATOR TRANSITION WITH PRESSURE AND D-ION MAGNETIC MOMENT COLLAPSE F-ELECTRON SYSTEMS: ? ?? TRANSITION IN CE MANGANITES MANGANITES PHYSICAL PROPERTIES ELECTRONIC MODEL FOR MANGANITES QMC FOR SYSTEMS WITH ELECTRON–LATTICE COUPLING LDA + DMFT (QMC) RESULTS FOR LA1?XSRXMNO3 HIGH-TC SUPERCONDUCTORS BASED ON PNICTIDES COMPOUNDS THE LIST OF STRONGLY CORRELATED MATERIALS INVESTIGATED BY DMFT METHOD CONCLUSION