An accurate three-dimensional potential energy surface for H3

Potential-Energy Curves for the X 1Σg+, b3Σu+, and C 1Πu States of the Hydrogen Molecule

1965 • 1,371 citations

An improved eigenvalue corrector formula for solving the Schrödinger equation for central fields

1961 • 1,079 citations

Potential Energy Surface for H3

1964 • 665 citations

An R matrix approach to the solution of coupled equations for atom–molecule reactive scattering

1976 • 625 citations

Functional representation of Liu and Siegbahn’s accurate a b i n i t i o potential energy calculations for H+H2

1978 • 615 citations

Ab initio potential energy surface for linear H3

1973 • 522 citations

A new method for large-scale Cl calculations

1972 • 507 citations

Quantum mechanical reactive scattering for three-dimensional atom plus diatom systems. II. Accurate cross sections for H+H2

1976 • 357 citations

History of H3 Kinetics

1976 • 227 citations

Classification of configurations and the determination of interacting and noninteracting spaces in configuration interaction

1973 • 220 citations

Quantum mechanical reaction cross sections for the three-dimensional hydrogen exchange reaction

1975 • 198 citations

Quantum mechanical reactive scattering: An accurate three-dimensional calculation

1975 • 195 citations

Atom—Molecule Kinetics Using ESR Detection. II. Results for D+H2→HD+H and H+D2→HD+D

1967 • 163 citations

A Calculation of the Rates of the Ortho-Para Conversions and Isotope Exchanges in Hydrogen

1959 • 143 citations

A Method of Diatomics in Molecules. II. H and H₃⁺¹

1963 • 132 citations

H3 Activated Complex and the Rate of Reaction of Hydrogen Atoms with Hydrogen Molecules

1959 • 117 citations

Variation-Perturbation Expansions and Padé Approximants to the Energy

1970 • 111 citations

I. Calculation of Energy of H3 Molecule

1936 • 110 citations

Correlation of Experimental Rate Constants of the Hydrogen Exchange Reactions with a Theoretical H3 Potential Surface, Using Transition-State Theory

1968 • 105 citations

Theoretical studies of H+H2 reactive scattering

1974 • 84 citations

A new H3 potential energy surface and its implications for chemical reaction

1974 • 64 citations

Pseudonatural Orbitals as a Basis for the Superposition of Configurations. II. Energy Surface for Linear H3

1968 • 53 citations

Three-dimensional quantum mechanical studies of D+H2 → HD+H reactive scattering

1975 • 49 citations

Reduced partitioning procedure in configuration interaction studies. II. Excited states

1973 • 46 citations