A hybrid method for improving MCSCF convergence
- Charles W. Bauschlicher Jr.
- Paul S. Bagus
- et al.
- 1981
- The Journal of Chemical Physics
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34 results for Byron H. Lengsfield III
On the use of corresponding orbitals in the calculation of nonorthogonal transition moments
- Byron H. Lengsfield III
- Jawed A. Jafri
- et al.
- 1981
- The Journal of Chemical Physics
On the low-lying states of MgO. II
- Charles W. Bauschlicher Jr.
- Byron H. Lengsfield III
- et al.
- 1981
- The Journal of Chemical Physics
A second order MCSCF method for large CI expansions
- Byron H. Lengsfield III
- Bowen Liu
- 1981
- The Journal of Chemical Physics