Density Localization of Atomic and Molecular Orbitals. I

Gaussian-Type Functions for Polyatomic Systems. I

1965 • 4,930 citations

N�herungsmethode zur L�sung des quantenmechanischen Mehrk�rperproblems

1930 • 1,701 citations

Ab Initio Computations in Atoms and Molecules

1965 • 1,526 citations

Localized Atomic and Molecular Orbitals

1963 • 1,526 citations

Canonical Configurational Interaction Procedure

1960 • 1,309 citations

Construction of Some Molecular Orbitals to Be Approximately Invariant for Changes from One Molecule to Another

1960 • 1,204 citations

Quantum theory of atoms, molecules, and the solid state

1966 • 1,064 citations

The Physical Nature of the Chemical Bond

1962 • 880 citations

Molecular Orbitals in Chemistry Physics and Biology

1965 • 774 citations

Gaussian Lobe Function Expansions of Hartree—Fock Solutions for the First-Row Atoms and Ethylene

1966 • 432 citations

Localized Atomic and Molecular Orbitals. II

1965 • 305 citations

On the Solution of the Hartree-Fock Equation in Terms of Localized Orbitals

1961 • 248 citations

Direct Determination of Natural Orbitals and Natural Expansion Coefficients of Many-Electron Wavefunctions. I. Natural Orbitals in the Geminal Product Approximation

1964 • 235 citations

Uniform Localization of Atomic and Molecular Orbitals. I

1967 • 175 citations

Orbital Theories of Electronic Structure

1962 • 173 citations

Semiempirical Method for the Determination of Localized Orbitals in Molecules

1968 • 94 citations

Construction of Hybrid Orbitals

1960 • 93 citations

Uniform Localization of Atomic and Molecular Orbitals. II

1968 • 82 citations

Maximum Overlap Atomic and Molecular Orbitals

1961 • 71 citations

The molecular orbital theory of chemical valency IX. The interaction of paired electrons in chemical bonds

1951 • 71 citations

Criteria for bond orbitals and optimum hybrids

1968 • 60 citations

Localized Orbitals for Polyatomic Molecules. I. The Transferability of the C–H Bond in Saturated Molecules

1969 • 59 citations

Orbital Theories of Electronic Structure. II. Molecularly Invariant Orbitals

1965 • 55 citations

The molecular orbital theory of chemical valency. VI. Properties of equivalent orbitals

1950 • 48 citations

A Theory of Molecules in Molecules. I

1971 • 40 citations

Localized orbitals for polyatomic molecules. II. Carbon-hydrogen bond transferability in unsaturated systems

1971 • 24 citations

Transferability of atomic Hartree-Fock valence-shell orbitals and chemical periodicity

1970 • 21 citations

Molecular orbital set determined by a localization procedure

1968 • 18 citations

Pseudopotential Approaches to Localized Orbitals for Polyatomic Systems

1970 • 18 citations

Localized orbitals for arbitrary molecular wave functions

1968 • 11 citations

Localized Orbitals in the Theory of Correlated Wavefunctions

1971 • 7 citations

Localized orbitals for the oxygen and nitric oxide molecules

1970 • 6 citations