Minimal basis sets in the linear muffin-tin orbital method: Application to the diamond-structure crystals C, Si, and Ge
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journal
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August 1986 |
Implementation of the LDA+U method using the full-potential linearized augmented plane-wave basis
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October 1999 |
Complex Band Structure and Tunneling through Ferromagnet Insulator Ferromagnet Junctions
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July 2000 |
Dynamical cluster approximation with continuous lattice self-energy
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September 2013 |
Maximally localized Wannier functions: Theory and applications
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journal
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October 2012 |
computation of the electronic spectrum of NiO
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November 2006 |
Metal-insulator transition and local-moment collapse in FeO under pressure
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journal
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August 2015 |
Frequency-dependent local interactions and low-energy effective models from electronic structure calculations
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journal
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November 2004 |
Theory of Surface States
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journal
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June 1965 |
Experimental and Theoretical Evidence for Pressure-Induced Metallization in FeO with Rocksalt-Type Structure
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January 2012 |
Accurate spin-dependent electron liquid correlation energies for local spin density calculations: a critical analysis
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August 1980 |
Pressure-driven orbital selective insulator-to-metal transition and spin-state crossover in cubic CoO
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June 2012 |
Charge self-consistency in density functional theory combined with dynamical mean field theory: -space reoccupation and orbital order
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October 2016 |
Optical Absorption of CoO and MnO above and below the Néel Temperature
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October 1959 |
Hall mobility and defect structure in undoped and Cr or Ti-doped CoO at high temperature
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January 1972 |
Metal-insulator transition and lattice instability of paramagnetic
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May 2015 |
Continuous-pole-expansion method to obtain spectra of electronic lattice models
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June 2014 |
Magnetic collapse and the behavior of transition metal oxides at high pressure
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October 2016 |
Maximally localized generalized Wannier functions for composite energy bands
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November 1997 |
Continuous-time Monte Carlo methods for quantum impurity models
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May 2011 |
Quantification of Correlations in Quantum Many-Particle Systems
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February 2012 |
Collapse of magnetic moment drives the Mott transition in MnO
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February 2008 |
Electronic structure and effects of dynamical electron correlation in ferromagnetic bcc Fe, fcc Ni, and antiferromagnetic NiO
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May 2008 |
Electron density distribution in paramagnetic and antiferromagnetic CoO: A γ-ray diffraction study
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March 2002 |
DCA++: A software framework to solve correlated electron problems with modern quantum cluster methods
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January 2020 |
Complex band structure, decay lengths, and Fermi level alignment in simple molecular electronic systems
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journal
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May 2002 |
Néel Temperature of Antiferromagnets for Phase Transitions Driven by Spin-wave Interactions
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January 2013 |
Surface representations and complex band structure of a diamond-type semiconductor
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October 1966 |
Consistent LDA’ + DMFT approach to the electronic structure of transition metal oxides: Charge transfer insulators and correlated metals
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journal
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April 2013 |
First-principles calculations of dynamical screened interactions for the transition metal oxides O ( =Mn, Fe, Co, Ni)
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journal
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April 2013 |
Computing total energies in complex materials using charge self-consistent DFT + DMFT
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December 2014 |
Ab initio complex band structure of conjugated polymers: Effects of hydrid density functional theory and schemes
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June 2012 |
Semiconductor interface formation: theoretical aspects
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January 1992 |
Electron density distribution in paramagnetic and antiferromagnetic MnO: A γ-ray diffraction study
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May 2003 |
Hubbard and Hund exchange in transition metal oxides: Screening versus localization trends from constrained random phase approximation
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October 2012 |
Discussion of the paper by de Boer and Verwey
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August 1937 |
The Basis of the Electron Theory of Metals, with Special Reference to the Transition Metals
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July 1949 |
Accurate screened exchange band structures for the transition metal monoxides MnO, FeO, CoO and NiO
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journal
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April 2013 |
Construction and solution of a Wannier-functions based Hamiltonian in the pseudopotential plane-wave framework for strongly correlated materials
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journal
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September 2008 |
Charge self-consistent dynamical mean-field theory based on the full-potential linear muffin-tin orbital method: Methodology and applications
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journal
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April 2012 |
Calculations of Hubbard from first-principles
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September 2006 |
The metal-semiconductor interface: Si (111) and zincblende (110) junctions
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June 1977 |
Valence-band satellite in ferromagnetic nickel: LDA+DMFT study with exact diagonalization
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June 2012 |
Optical Properties of NiO and CoO
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September 1970 |
Condensed Matter Field Theory
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book
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August 2010 |
Local correlations and hole doping in NiO: A dynamical mean-field study
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April 2007 |
Electron density distribution in paramagnetic and antiferromagnetic NiO: A -ray diffraction study
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November 2004 |
LDA+DMFT study of magnetic transition and metallization in CoO under pressure
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September 2012 |
Angle resolved photoemission on NiO: on the nature of the valence band
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August 1995 |
Pressure-Induced Site-Selective Mott Insulator-Metal Transition in
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September 2018 |
Spin-phonon coupling in highly correlated transition-metal monoxides
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December 2009 |
Consistent LDA’ + DMFT—an unambiguous way to avoid double counting problem: NiO test
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August 2012 |
Accuracy of downfolding based on the constrained random-phase approximation
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June 2015 |
Electrical and optical properties of FeO
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January 1975 |
Ni–NiO–Ni tunnel junctions for terahertz and infrared detection
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January 2005 |
Dynamical mean-field theory of strongly correlated fermion systems and the limit of infinite dimensions
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January 1996 |
Orbital-selective pressure-driven metal to insulator transition in FeO from dynamical mean-field theory
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November 2010 |
NiO: Correlated Band Structure of a Charge-Transfer Insulator
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October 2007 |
Magnitude and Origin of the Band Gap in NiO
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December 1984 |
A local exchange-correlation potential for the spin polarized case. i
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July 1972 |
Double counting in LDA+DMFT—The example of NiO
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July 2010 |
Electron correlations in narrow energy bands
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November 1963 |
Theory of tunneling transport in periodic chains
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July 2009 |
Quasiparticle band structures of the antiferromagnetic transition-metal oxides MnO, FeO, CoO, and NiO
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journal
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June 2009 |
Schottky Barrier Heights and the Continuum of Gap States
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February 1984 |
Influence of magnetic ordering on the NiO valence band
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October 1996 |
Electronic structure of NiO: Correlation and band effects
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August 1991 |
Band structure, evanescent states, and transport in spin tunnel junctions
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October 2003 |
Schottky Barrier Heights and the Continuum of Gap States
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March 1984 |
Theory of surface states
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April 1976 |
DCA++: A software framework to solve correlated electron problems with modern quantum cluster methods
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text
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January 2020 |
NiO: Correlated Bandstructure of a Charge-Transfer Insulator
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text
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January 2007 |
Construction and solution of a Wannier-functions based Hamiltonian in the pseudopotential plane-wave framework for strongly correlated materials
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text
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January 2008 |
Theory of tunneling transport in periodic chains
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text
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January 2009 |
Orbital Selective Pressure-Driven Metal-Insulator Transition in FeO from Dynamical Mean-Field Theory
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text
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January 2010 |
Pressure-Driven Orbital Selective Insulator to Metal Transition and Spin State Crossover in Cubic CoO
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text
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January 2011 |
Experimental and theoretical evidence for pressure-induced metallization in FeO with the rock-salt type structure
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text
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January 2011 |
Maximally localized Wannier functions: Theory and applications
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text
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January 2011 |
Valence-band satellite in the ferromagnetic nickel: LDA+DMFT study with exact diagonalization
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text
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January 2012 |
Accurate screened exchange band structures for transition metal monoxides MnO, FeO, CoO and NiO
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text
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January 2012 |
Consistent LDA'+DMFT approach to electronic structure of transition metal oxides: charge transfer insulators and correlated metals
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text
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January 2012 |
Frequency-dependent local interactions and low-energy effective models from electronic structure calculations
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text
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January 2004 |
Local correlations and hole doping in NiO: a dynamical mean field study
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text
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January 2006 |