Indirect nuclear spin-spin coupling constants within the coupled multiconfiguration hartree-fock approximation Academic Article uri icon

abstract

  • The multiconfigurational coupled Hartree-Fock expression for the Fermi contact contribution to the indirect nuclear spin-spin coupling constants is derived Numerical calculations on H2 and FH indicate that the nuclear spin-spin coupling is very difficult to describe in finite basis set calculations. 1980.

published proceedings

  • Chemical Physics Letters

author list (cited authors)

  • Albertsen, P., Jrgensen, P., & Yeager, D. L.

citation count

  • 32

complete list of authors

  • Albertsen, Preben||Jørgensen, Poul||Yeager, Danny L

publication date

  • December 1980