Solution to a Problem in Constrained Hartree-Fock and Other Calculations Academic Article uri icon

abstract

  • When using the method of Lagrange multipliers in constrained variational calculations, certain regions of interest have in the past been inaccessible. A modified procedure is proposed which, as is shown both algebraically and numerically, circumvents this difficulty. 1971 The American Physical Society.

published proceedings

  • Physical Review Letters

author list (cited authors)

  • Bassichis, W. H., & Wilets, L.

citation count

  • 26

complete list of authors

  • Bassichis, WH||Wilets, L

publication date

  • November 1971