Abstract
The variational principle in quantum mechanics gives an upper bound on the energy eigenvalue of the state if its trial wave function is orthogonal to the eigenfunctions of all the lower states. A lower bound on has been derived assuming that: (i) its upper bound be less than , and (ii) the energy fluctuation be less than . An upper bound on the error in the wave function of the state has also been derived. The formulas for the bounds have been applied to calculate the accuracy of the energies and wave functions of the various states of the ground and excited bands in . The intrinsic wave functions of the bands were taken from the earlier calculations performed by using the deformed Hartree-Fock and Tamm-Dancoff approximations. Techniques for calculating have also been discussed. Our results show that the energies and wave functions calculated by these approximations are fairly accurate for a number of states. The wave functions of the ground and first excited states are accurate at least to the order of 92.5 and 87.3%, respectively.
- Received 8 October 1971
DOI:https://doi.org/10.1103/PhysRevC.6.179
©1972 American Physical Society