Ab-initio calculation of resonance states of H2O
โ Scribed by Hiroaki Iwaki; Takeshi Noro; Kimio Ohno
- Publisher
- John Wiley and Sons
- Year
- 1988
- Tongue
- English
- Weight
- 414 KB
- Volume
- 33
- Category
- Article
- ISSN
- 0020-7608
No coin nor oath required. For personal study only.
๐ SIMILAR VOLUMES
The energy v&es of the Io\\est "22 Feshbach resonzmce in rbe I l-15 eV region nre cafculnted m a rel~t~~ef~ smdI but carefully optimized ST0 basis set. ;\dd%ional information is obt.Gncd for the Z& rescxnant state. The dominnnt configuretions in the nsvefunctions are given.
The eight low-lying doublet states of the NH + ion are investigated with an ab initio configuration interaction method including all single and double excitations from a multi-reference confrguration space (MRSD CI). The spectroscopic constants for the X \*II, A\*Z-, Bh and C \*IX+ states and the tr
Ab initio MRCI electronic dipole transition moments were calculated for the singlet and triplet molecular states contributing to free-free and free-bound absorption in the far wings of the Lyman โฃ and Lyman โค lines of hydrogen atom perturbed by another hydrogen atom in its ground state. Results are