Evaluation of Gaussian basis sets in ab initio

This publication has 29 references indexed in Scilit:

• CI calculations for the inversion barrier of ammonia
  The Journal of Chemical Physics, 1974
• On radial weighting effects in gaussian expansions of self-consistent field atomic orbitals
  Theoretical Chemistry Accounts, 1973
• One-Electron Properties of Ammonia Computed from Near-Hartree—Fock Wavefunctions
  The Journal of Chemical Physics, 1972
• Accurate SCF Calculation for Ammonia and Its Inversion Motion
  The Journal of Chemical Physics, 1971
• Self-Consistent Molecular-Orbital Methods. IX. An Extended Gaussian-Type Basis for Molecular-Orbital Studies of Organic Molecules
  The Journal of Chemical Physics, 1971
• Self-Consistent Molecular Orbital Methods. IV. Use of Gaussian Expansions of Slater-Type Orbitals. Extension to Second-Row Molecules
  The Journal of Chemical Physics, 1970
• Self-Consistent Molecular-Orbital Methods. I. Use of Gaussian Expansions of Slater-Type Atomic Orbitals
  The Journal of Chemical Physics, 1969
• Interpretation of Nuclear Quadrupole Coupling in Nitrogen Containing Molecules with Ab Initio Molecular-Orbital Wavefunctions
  The Journal of Chemical Physics, 1968
• Electronic structure of large molecular systems
  Journal of Computational Physics, 1966
• Nuclear Quadrupole Coupling in Polyatomic Molecules
  The Journal of Chemical Physics, 1965