Configuration interaction by the method of bonded functions, some preliminary calculations

Methods of Molecular Quantum Mechanics

1971 • 1,655 citations

A new method for large-scale Cl calculations

1972 • 507 citations

Automatic Fundamental Calculations of Molecular Structure

1956 • 191 citations

SCF-MO-LCGO studies on hydrogen bonding. The water dimer

1971 • 138 citations

Studies in Configuration Interaction. I. Matrix Elements between Spin-Coupled Functions

1966 • 134 citations

The valence bond theory of molecular structure - I. Orbital theories and the valence-bond method

1954 • 124 citations

Optimized transformation of four center integrals

1974 • 110 citations

Matrix Elements between Bonded Functions

1966 • 95 citations

Construction of the hamiltonian matrix in large configuration interaction calculations

1973 • 78 citations

An algorithm for generating projective reduction formulas for matrix elements of many-electron wavefunctions

1966 • 56 citations