Title of article :
One-electron wavefunctions: variational perturbation theory
Author/Authors :
Erwin B. Montgomery Jr، نويسنده , , H.E.، نويسنده ,
Issue Information :
روزنامه با شماره پیاپی سال 1999
Abstract :
The ground-state wavefunction of H2+ is calculated using variational perturbation theory. The accuracy of the wavefunction is demonstrated by comparing calculated energies and expectation values with the corresponding exact values. Extrapolation of the ratios of the perturbation energies and of the expectation value coefficients is used to study the asymptotic behavior of the perturbation expansions.
Journal title :
Chemical Physics Letters
Journal title :
Chemical Physics Letters