One-Electron Properties of Near-Hartree–Fock Wavefunctions. II. HCHO, CO

New Developments in Molecular Orbital Theory

1951 • 5,347 citations

Gaussian-Type Functions for Polyatomic Systems. I

1965 • 4,930 citations

Tables of experimental dipole moments

1963 • 1,571 citations

Magnetic Shielding of Nuclei in Molecules

1950 • 1,380 citations

Dissociation energies and spectra of diatomic molecules

1953 • 620 citations

The molecular orbital theory of chemical valency VIII. A method of calculating ionization potentials

1951 • 565 citations

Tables of Atomic Functions

1965 • 551 citations

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

1966 • 432 citations

Studies in Molecular Structure. II. LCAO-MO-SCF Wave Functions for Selected First-Row Diatomic Molecules

1960 • 399 citations

Electronic Structure of CO and BF

1965 • 315 citations

Spin—Rotation Interaction and Magnetic Shielding in Molecules

1964 • 296 citations

One-Electron Properties of Near-Hartree–Fock Wavefunctions. I. Water

1968 • 291 citations

Isotopic Mass Ratios, Magnetic Moments and the Sign of the Electric Dipole Moment in Carbon Monoxide

1958 • 226 citations

Electronic States of the Amide Group

1967 • 196 citations

Millimeter Wave Spectrum of Formaldehyde

1963 • 192 citations

Microwave Spectrum of Formaldehyde II. Molecular Structure in the Ground State

1960 • 176 citations

Approximate Hartree–Fock Wavefunctions, One-Electron Properties, and Electronic Structure of the Water Molecule

1968 • 173 citations

C13 Nuclear Magnetic Resonance Spectra

1957 • 157 citations

Stark Effect from 1.1 to 2.6 Millimeters Wavelength : PH3, PD3, DI, and CO

1958 • 147 citations

Analysis of Charge Distributions: Hydrogen Fluoride

1964 • 141 citations

Molecular Binding Energies

1966 • 127 citations

Centrifugal Distortion in Asymmetric Top Molecules. I. Ordinary Formaldehyde,<mml:math xmlns:mml="http://www.w3.org/1998/Math/MathML" display="inline"><mml:mrow><mml:msub><mml:mrow><mml:mi mathvariant="normal">H</mml:mi></mml:mrow><mml:mrow><mml:mn>2</mml:mn></mml:mrow></mml:msub></mml:mrow></mml:math><mml:math xmlns:mml="http://www.w3.org/1998/Math/MathML" display="inline"><mml:mrow><mml:msup><mml:mrow><mml:mi mathvariant="normal">C</mml:mi></mml:mrow><mml:mrow><mml:mn>12</mml:mn></mml:mrow></…

1951 • 116 citations

Molecular g-Value Tensor, the Molecular Susceptibility Tensor, and the Sign of the Electric Dipole Moment in Formaldehyde

1968 • 110 citations

Non-empirical LCAO-MO-SCF-CI calculations on organic molecules with Gaussian type functions

1966 • 108 citations

Hyperfine Structure in the Spectrum of<mml:math xmlns:mml="http://www.w3.org/1998/Math/MathML" display="inline"><mml:mrow><mml:msup><mml:mrow><mml:mi mathvariant="normal">N</mml:mi></mml:mrow><mml:mrow><mml:mn>14</mml:mn></mml:mrow></mml:msup></mml:mrow></mml:math><mml:math xmlns:mml="http://www.w3.org/1998/Math/MathML" display="inline"><mml:mrow><mml:msub><mml:mrow><mml:mi mathvariant="normal">H</mml:mi></mml:mrow><mml:mrow><mml:mn>3</mml:mn></mml:mrow></mml:msub></mml:mrow></mml:math>. II. …

1954 • 106 citations

Spin Rotation Constant and Rotational Magnetic Moment of 13C16O

1968 • 80 citations

Experimental Determination of the Field Gradient at the Deuteron in Formaldehyde

1964 • 68 citations

Experimental Study of the Nuclear-Quadrupole and Spin—Rotation Interactions of 17O in Formaldehyde

1965 • 65 citations

Calculation of the Hyperfine Constants for<mml:math xmlns:mml="http://www.w3.org/1998/Math/MathML" display="inline"><mml:mrow><mml:msup><mml:mrow><mml:mi mathvariant="normal">B</mml:mi></mml:mrow><mml:mrow><mml:mn>11</mml:mn></mml:mrow></mml:msup></mml:mrow></mml:math>and<mml:math xmlns:mml="http://www.w3.org/1998/Math/MathML" display="inline"><mml:mrow><mml:msup><mml:mrow><mml:mi mathvariant="normal">O</mml:mi></mml:mrow><mml:mrow><mml:mn>17</mml:mn></mml:mrow></mml:msup></mml:mrow></mml:math>

1962 • 62 citations

13C Spin—Rotation Interaction and Magnetic Shielding at the Carbon and Oxygen Nuclei in Formaldehyde

1966 • 58 citations

Calculations on the Electronic Structure of the Normal State of Formaldehyde

1960 • 55 citations

Tertiary Interferometric Wavelength Standards from Measurements on Lines of the 2-0 Band of Carbon Monoxide and Derived Wavelength Standards for Some Lines of the 1-0 Band of Carbon Monoxide The Velocity of Light Derived from a Band Spectrum Method IV*

1957 • 54 citations

Ground states of linear molecules: Dissociation energies and dipole moments in the hartree-fock approximation

2009 • 53 citations

C13 Chemical Shifts in CO and CO2

1960 • 52 citations

Recalculation of Formaldehyde Wavefunctions

1966 • 47 citations

Molecular Magnetic Moments and Susceptibility in Formaldehyde

1965 • 47 citations

Study of the Electronic Structure of Molecules. VIII. All-Electron SCF Wavefunctions for Pyridine Positive Ion, 2A2

1967 • 44 citations

Coupling of Nuclear Spins in Molecules

1958 • 39 citations

Sign and Magnitude of the Rotational Moment of 12C16O

1967 • 39 citations

The calculation of the electric dipole moment of CO

2009 • 37 citations

Improved Molecular Orbital Wave Functions and Nuclear Quadrupole Coupling in CO,<mml:math xmlns:mml="http://www.w3.org/1998/Math/MathML" display="inline"><mml:mrow><mml:msub><mml:mrow><mml:mi mathvariant="normal">N</mml:mi></mml:mrow><mml:mrow><mml:mn>2</mml:mn></mml:mrow></mml:msub></mml:mrow></mml:math>, and<mml:math xmlns:mml="http://www.w3.org/1998/Math/MathML" display="inline"><mml:mrow><mml:msub><mml:mrow><mml:mi mathvariant="normal">Li</mml:mi></mml:mrow><mml:mrow><mml:mn>2</mml:mn></mml…

1960 • 33 citations

Calculation of One-Electron Properties for the Formaldehyde Molecule with the LCAO MO SCF Function of Foster and Boys

1966 • 32 citations

Signs of the Rotational Magnetic Moment and Electric Dipole Moment of CO

1966 • 27 citations

Values of 〈ψ | ∑i ri2 | ψ〉 for H2O, NH3, and CH2O

1965 • 18 citations

Refinement of the LCAO MO SCF Wavefunction and the Recalculation of One-Electron Properties for the Formaldehyde Molecule

1966 • 18 citations

Calculation of the Field Gradient at the Deuteron in Formaldehyde

1964 • 13 citations