Citation Impact
Citing Papers
Valence-band splitting of SrTiO 3
1983 StandoutNobel
Strongly Constrained and Appropriately Normed Semilocal Density Functional
2015 Standout
Gate-tunable room-temperature ferromagnetism in two-dimensional Fe3GeTe2
2018 StandoutNature
Half-metallic graphene nanoribbons
2006 StandoutNature
Ab initioself-consistent study of the electronic structure and properties of cubic boron nitride
1978
Self-consistent local-orbital method for calculating surface electronic structure: Application to Cu (100)
1980
Spin-polarized photoelectron diffraction and valence-band photoemission from MnO(001)
1990 StandoutNobel
Surface migration of ‘‘hot’’ adatoms in the course of dissociative chemisorption of oxygen on Al(111)
1992 StandoutNobel
Connecting the irreversible capacity loss in Li-ion batteries with the electronic insulating properties of solid electrolyte interphase (SEI) components
2016
Optical absorption edge of SiO 2
1980 StandoutNobel
The magnetic, optical, and transport properties of representatives of a class of magnetic semiconductors: The europium chalcogenides
1986
Computer Simulation of Liquids
2017 Standout
Bulk electronic structure of SiO 2
1979 StandoutNobel
Optical-absorption and photo emission edges in insulating solids
1975
Metal-insulator transitions
1998 Standout
Auger neutralization spectroscopy of clean and adsorbate-covered transition-metal surfaces by deexcitation of metastable noble-gas atoms
1987 StandoutNobel
Physical Content of the Exact Kohn-Sham Orbital Energies: Band Gaps and Derivative Discontinuities
1983 Standout
First-Principles Determination of the Soft Mode in CubicZrO 2
1997 Standout
Discrete Variational Method for the Energy-Band Problem with General Crystal Potentials
1970
Density-functional approximation for the correlation energy of the inhomogeneous electron gas
1986 Standout
Unified Approach for Molecular Dynamics and Density-Functional Theory
1985 Standout
Low-Energy-Electron-Diffraction Intensity Profiles and Electronic Energy Bands for Lithium Fluoride
1973
Self-consistent linear-combination-of-Gaussian-orbitals approach for polymers: Application totrans-(CH) x
1987
Lanthanide-Activated Phosphors Based on 4f-5d Optical Transitions: Theoretical and Experimental Aspects
2017 Standout
Toward Safe Lithium Metal Anode in Rechargeable Batteries: A Review
2017 Standout
Projector augmented-wave method
1994 Standout
Ground- and excited-state properties of LiF in the local-density formalism
1977
Efficient pseudopotentials for plane-wave calculations
1991 Standout
Excited electronic states and optical spectra of ZnS and CdS crystallites in the ≊15 to 50 Å size range: Evolution from molecular to bulk semiconducting properties
1985 StandoutNobel
Interaction of oxygen with Al(111) studied by scanning tunneling microscopy
1993 StandoutNobel
Challenges for Density Functional Theory
2011 Standout
Chemisorption of oxygen on aluminum surfaces
1984
Photon-Assisted Tunneling in Electron Pumps
2000 StandoutNobel
Efficient iterative schemes forab initiototal-energy calculations using a plane-wave basis set
1996 Standout
First-principles nonlocal-pseudopotential approach in the density-functional formalism. II. Application to electronic and structural properties of solids
1979
Local-density-approximation-based simulations of hydrocarbon interactions with applications to diamond chemical vapor deposition
1991
Making Nonmagnetic Semiconductors Ferromagnetic
1998 StandoutScience
Local-density self-consistent energy-band structure of cubic CdS
1978
Energy-Band Structure of SrTiO 3
1972
Exchange Effects in theLi K
1976 StandoutNobel
From ultrasoft pseudopotentials to the projector augmented-wave method
1999 Standout
Soft self-consistent pseudopotentials in a generalized eigenvalue formalism
1990 Standout
Iterative minimization techniques forab initiototal-energy calculations: molecular dynamics and conjugate gradients
1992 Standout
Self-consistent Hartree energy bands of MnO
1984
Augmented-Plane-Wave Hartree-Fock First-Principles Calculation of the Fermi Surfaces of Li, Na, and K
1973
Prediction of New Low Compressibility Solids
1989 StandoutScience
A Self-Consistent Procedure for the Linear-Combination-of-Atomic-Orbitals Method: Application to LiF
1972
Density-Functional Theory for Fractional Particle Number: Derivative Discontinuities of the Energy
1982 Standout
Electronic-energy-structure calculations of silicon and silicon dioxide using the extended tight-binding method
1977
Accurate and simple analytic representation of the electron-gas correlation energy
1992 Standout
Correlation bag and high-T c
1990 StandoutNobel
The performance of a family of density functional methods
1993 StandoutNobel
Ground-state electronic properties of diamond in the local-density formalism
1977
Ab initiomolecular-dynamics simulation of the liquid-metal–amorphous-semiconductor transition in germanium
1994 Standout
Exact‐exchange Hartree–Fock calculations for periodic systems. I. Illustration of the method
1980
Atoms, molecules, solids, and surfaces: Applications of the generalized gradient approximation for exchange and correlation
1992 Standout
Pressure-Induced Structural Transformations in Si Nanocrystals: Surface and Shape Effects
1996 StandoutNobel
Theory of static structural properties, crystal stability, and phase transformations: Application to Si and Ge
1982
Electronic band structure of the alkali halides. II. Critical survey of theoretical calculations
1975
Self-Consistent Calculation of Work Function, Charge Densities, and Local Densities of States for Cu(100)
1977
Magnetic transition inMn n ( n = 2 – 8 )
1998
Insights into Current Limitations of Density Functional Theory
2008 StandoutScience
Ab initiomolecular dynamics for open-shell transition metals
1993 Standout
First-principles linear combination of atomic orbitals method for the cohesive and structural properties of solids: Application to diamond
1984
Alloy Negative Electrodes for Li-Ion Batteries
2014 Standout
Phonons and related crystal properties from density-functional perturbation theory
2001 Standout
Self-interaction correction to density-functional approximations for many-electron systems
1981 Standout
Dielectric theory of elementary excitations in crystals
1978
Revealing SEI Morphology: In-Depth Analysis of a Modeling Approach
2017
Localized description of the electronic structure of covalent semiconductors. II. Imperfect crystals
1975
New approach for solving the density-functional self-consistent-field problem
1982
The SIESTA method forab initioorder-Nmaterials simulation
2002 Standout
Valence and core-shakeup photoelectron spectra of solid polyacetylene and related free model molecules
1992 StandoutNobel
Band theory and Mott insulators: HubbardUinstead of StonerI
1991 Standout
Calculation of the Optical Properties of AmorphousSi O x
1971
An all-electron numerical method for solving the local density functional for polyatomic molecules
1990 Standout
Ville Axioms and Consumer Theory
1979 StandoutNobel
Hybrid functionals based on a screened Coulomb potential
2003 Standout
Semiconductor cluster beams: One and two color ionization studies of Six and Gex
1985 StandoutNobel
Works of Earl E. Lafon being referenced
Optical Dielectric Function of the Lithium-Fluoride Crystal
1973
Energy Band Structure of Lithium by the Tight-Binding Method
1966
Generalization of the basis functions of the LCAO method for band-structure calculations
1975
Application of bonding molecular orbitals to the valence bands of diamond
1973
Application of the Method of Tight Binding to the Calculation of the Energy Band Structures of Diamond, Silicon, and Sodium Crystals
1971
Self-consistent calculation of Compton profiles, X-ray structure factors, and band structure for silicon
1981
Energy Band Structure of Lithium Fluoride Crystals by the Method of Tight Binding
1971
Application of the Gaussian-Type Orbitals for Calculating Energy Band Structures of Solids by the Method of Tight Binding
1970
Advanced Calculus, Second Edition.
1962