Discrete Variational Method for the Energy-Band Problem with General Crystal Potentials

Simplified LCAO Method for the Periodic Potential Problem

1954 • 4,907 citations

A Simplification of the Hartree-Fock Method

1951 • 4,355 citations

Atomic Structure Calculations

1964 • 4,027 citations

Solution of the Schrödinger Equation in Periodic Lattices with an Application to Metallic Lithium

1954 • 1,734 citations

Ab Initio Computations in Atoms and Molecules

1965 • 1,526 citations

Methods in Computational Physics

1971 • 1,354 citations

Quantum theory of cohesive properties of solids

1956 • 1,199 citations

Cohesion of Ionic Solids in the Born Model

1964 • 1,038 citations

Quantum theory of molecules and solids

1964 • 927 citations

Electronic Band Structure and Optical Properties of Graphite from a Variational Approach

1970 • 509 citations

X-ray study of the alkali metals at low temperatures

1956 • 454 citations

Molecular Schrödinger Equation. VIII. A New Method for the Evaluation of Multidimensional Integrals

1967 • 397 citations

Energy Bands of Alkali Metals. I. Calculated Bands

1962 • 301 citations

Self-Consistent Energy Bands and Cohesive Energy of Potassium Chloride

1967 • 249 citations

Comparison of Several Exchange Potentials for Electrons in the<mml:math xmlns:mml="http://www.w3.org/1998/Math/MathML" display="inline"><mml:mrow><mml:msup><mml:mrow><mml:mi mathvariant="normal">Cu</mml:mi></mml:mrow><mml:mrow><mml:mo>+</mml:mo></mml:mrow></mml:msup></mml:mrow></mml:math>Ion

1969 • 241 citations

Energy Bands of Alkali Metals. II. Fermi Surface

1962 • 231 citations

Fourier Expansion for the Electronic Energy Bands in Silicon and Germanium

1967 • 219 citations

Band Structure and Fermi Surface of Re<mml:math xmlns:mml="http://www.w3.org/1998/Math/MathML" display="inline"><mml:mrow><mml:msub><mml:mrow><mml:mi mathvariant="normal">O</mml:mi></mml:mrow><mml:mrow><mml:mn>3</mml:mn></mml:mrow></mml:msub></mml:mrow></mml:math>

1969 • 216 citations

A method for numerical integration

1961 • 200 citations

Band Structure and Cohesive Energy of Potassium Chloride

1958 • 197 citations

Energy Band Structure of Lithium by the Tight-Binding Method

1966 • 169 citations

Self-Consistent Orthogonalized-Plane-Wave and Empirically Refined Orthogonalized-Plane-Wave Energy-Band Models for Cubic ZnS, ZnSe, CdS, and CdSe

1969 • 151 citations

A calculation for the energies and wavefunctions for states of neon with full electronic correlation accuracy

1969 • 150 citations

The Theoretical Constitution of Metallic Lithium

1935 • 134 citations

A condition to remove the indeterminacy in interelectronic correlation functions

1969 • 128 citations

Variation of Lattice Constant in Augmented-Plane-Wave Energy-Band Calculation for Lithium

1969 • 122 citations

Some bilinear convergence characteristics of the solutions of dissymmetric secular equations

1969 • 113 citations

Self-Consistent Augmented-Plane-Wave Method

1969 • 111 citations

Local-Energy Method in Electronic Energy Calculations

1960 • 108 citations

Spin-Polarized Electronic Energy-Band Structure in EuS

1967 • 87 citations

Combined Plane-Wave Tight-Binding Method for Energy-Band Calculations with Application to Sodium Iodide and Lithium Iodide

1969 • 83 citations

Application of diophantine integration to hartree-fock and configuration interaction calculations

2009 • 81 citations

Symmetrized Relativistic Augmented-Plane-Wave Method: Gray Tin and the Warped Muffin-Tin Potential

1969 • 68 citations

Shifts in the Electronic Band Structure of Metals Due to Non-Muffin-Tin Potentials

1970 • 68 citations

Molecular Schrödinger Equation. II. Monte Carlo Evaluation of Integrals

1964 • 62 citations

Exchange in Spin-Polarized Energy Bands

1968 • 55 citations

Quantum Calculations

1966 • 53 citations

Generalized Ewald Potential Problem

1969 • 47 citations

Molecular Schrödinger Equation. III. Calculation of Ground-State Energies by Extrapolation

1964 • 42 citations

Spin-Polarized Energy-Band Structure of Antiferromagnetic MnO

1969 • 41 citations

Energy Bands in Lithium

1961 • 35 citations

Molecular Schrödinger Equation. VII. Properties of the Energy Variance Function: The Estimation of Energy Eigenvalues

1967 • 34 citations

Modification of the Orthogonalized-Plane-Wave Method Applied to Copper

1969 • 33 citations

On the least squares procedure for atomic calculations

1969 • 21 citations

Discrete least squares method for the solution of the schrödinger equation; Application to the nuclear three-body problem

1969 • 16 citations

Carlson's Sum over Points and Local Energy

1969 • 11 citations