Interpretation of flow curves in terms of molecular properties
β Scribed by J Schurz
- Publisher
- Elsevier Science
- Year
- 1959
- Weight
- 437 KB
- Volume
- 14
- Category
- Article
- ISSN
- 0095-8522
No coin nor oath required. For personal study only.
π SIMILAR VOLUMES
The validity and applicability of bidirectional molecular dynamics is shown in terms of modern classical mechanics. A simple interpretation of bidirectional molecular dynamics is given. This interpretation justifies an easy approach to start from an equilibrium configuration, to perform simulations
A model potential method in which a molccl;lc is described as P single clectronmoving in the field of two poluizable cores is used to calculate the potential energy CUIVCS and the wavefunctions of the lowest six electronic states of the moleculw ion Na;. The ground Xzxg state has a dissociation ener
## Abstract A number of molecular oneβelectron progperties have been analyzed by partitioning their electronic components over energy localized molecular orbitals (LMO). The ammonia and ethane molecules, calculated in an Approximately double zeta qualtiy basis set, were considered. The partitioning