Dependence of generalized oscillator strengths of H2O on momentum transfer
โ Scribed by S.R Mielczarek; K.J Miller
- Publisher
- Elsevier Science
- Year
- 1971
- Tongue
- English
- Weight
- 234 KB
- Volume
- 10
- Category
- Article
- ISSN
- 0009-2614
No coin nor oath required. For personal study only.
๐ SIMILAR VOLUMES
The oscillator strength for the A 'B,-X 'A1 transition of water is computed by means of ab initio MRD CI calculations employing a variety of A0 basis sets. The advantages of carrying out a large CI computation are emphasized in this work, withfL andfv values of 0.0500 and 0.0576 resulting from the m
We report the first experimental and theoretical observation of a broad peak in the kinetic energy dependence of the total cross sections for the title reaction with v~ = 0 and 1, in the laboratory collision energy range of 8-400 eV. A theoretical analysis reveals that the peak in the total cross se
We report extensive quantum mechanical calculations of the product vibrational branching ratios in the title reaction. The calculations involve total angular momenta up to 2 and excited as well as ground initial rotational states, and they are completely converged with up to 513 channels in individu
Recent calculations of the variation of the probability of dissociative chemisorption, S o, of H 2 on Pd(100) and on W(100) predict distinct oscillations in this probability with increasing translational energy, Ei, at low energy. We have searched for these oscillations in the H2/Pd(100) system usin
The structures, properties, and the electron transfer reactivities of Mn 2+ (H 2 O) 2 /Mn 3+ (H 2 O) 2 have been investigated in this article at the different levels of theory. The geometrical optimizations that have been made at the UMP2(full)/6-311+G \* level for these two species, the binding cha