We present an exact three-dimensional wavepacket calculation for the photodissociation of water in the first absorption band using the ab initio potential energy surface of Staemmler and Palma. The results are compared with two-dimensional calculations in which the bending angle is frozen and (appro
โฆ LIBER โฆ
A semiclasical justification for the use of non-spreading wavepackets in dynamics calculations
โ Scribed by Michael F. Herman; Edward Kluk
- Publisher
- Elsevier Science
- Year
- 1984
- Tongue
- English
- Weight
- 603 KB
- Volume
- 91
- Category
- Article
- ISSN
- 0301-0104
No coin nor oath required. For personal study only.
๐ SIMILAR VOLUMES
Three-dimensional wavepacket calculation
โ
Michael von Dirke; Reinhard Schinke
๐
Article
๐
1992
๐
Elsevier Science
๐
English
โ 424 KB
A justification for the use of the Lange
โ
Michael F. Herman; Robert Currier
๐
Article
๐
1985
๐
Elsevier Science
๐
English
โ 363 KB
The analytical behavior of the S matrix in hi&x's classxal anaiog method for electroruc degrees of freedom in nonadiabatic scattermg is considered. It is demonstrated that the L-anger modlfiuhon, wiuch replaces the action vannbks nk with nk f 4, resplrs in an acceptable functional form at the singul
The use of scaled orbital functions in s
โ
David A. Liberman
๐
Article
๐
1984
๐
John Wiley and Sons
๐
English
โ 394 KB
The use of interparticle coordinates in
โ
Arthur A. Frost
๐
Article
๐
1962
๐
Springer
๐
English
โ 304 KB
A practical method for the calculation o
โ
Ataman Haksever
๐
Article
๐
1985
๐
John Wiley and Sons
๐
English
โ 424 KB
Using R-functions in the calculation of
Using R-functions in the calculation of dynamic stability of plates with a complex form in plan view
โ
N. N. Volkova; G. A. Marchenko
๐
Article
๐
1973
๐
Springer US
๐
English
โ 207 KB