The results from the separate analyses demonstrate clearly that the two hamiltonian operators are essentially equivalent, both achieving equally satisfactory representations of the spectral data, and furnishing virtually identical Born-Oppenheimer potential functions. Fully quantum-mechanical vibrat
The radial Hamiltonian operator for LiH X1Σ+
✍ Scribed by John A. Coxon
- Publisher
- Elsevier Science
- Year
- 1992
- Tongue
- English
- Weight
- 655 KB
- Volume
- 152
- Category
- Article
- ISSN
- 0022-2852
No coin nor oath required. For personal study only.
📜 SIMILAR VOLUMES
The spin-caupled VB Theory is applied to the dipole moment function p(R) 01 LiH(X'Z\*) A series of calculations is reponed (1.7%. 127 and 188 spatial contigurauons) wluch demonslrates tie rapid convergence of thus properly onto thal given by aaurate MO CI wavefuncrions. The binding is essentially du
Electronic moments are given for internuclear distances, 0:5 6 R 6 50:0 bohr, for transitions connecting the six lowest 1 R þ u states and the 1 R þ g ground state of the hydrogen molecule. Except for the two lowest transitions, the computed moments show-due to avoided crossings-very strong R-depend