𝔖 Bobbio Scriptorium
✦   LIBER   ✦

Relation of the force constant of a bond to the electric field at a nucleus

✍ Scribed by McDowell, Sean A. C.

Publisher
John Wiley and Sons
Year
1997
Tongue
English
Weight
129 KB
Volume
18
Category
Article
ISSN
0192-8651

No coin nor oath required. For personal study only.

✦ Synopsis

The change in the electric field at a nucleus in a molecule due to bond stretch is related to the force constant of the stretched bond. The validity of this relationship using approximate wave functions at the SCF and MP2 levels of theory is tested for the diatomic molecules H , HF, CO, and N . The effect of 2 2 basis set variation on H is also investigated.

πŸ“œ SIMILAR VOLUMES

Heating of ions moving in a gas under th
Heating of ions moving in a gas under the influence of a uniform and constant electric field
✍ Valeri V. Raznikov; Vyacheslav I. Kozlovsky; Alexander F. Dodonov; Marina O. Raz πŸ“‚ Article πŸ“… 1999 πŸ› John Wiley and Sons 🌐 English βš– 69 KB πŸ‘ 2 views

A simple model for estimation of the internal temperature of ions, moving in a monoatomic gas under the influence of an electric field, is considered. The basic assumption of the model is formation of ion-atom complexes in a quasi-equilibrium state for some of the ion-atom collisions, and other coll

Theory for the extension of a linear pol
Theory for the extension of a linear polyelectrolyte attached at one end in an electric field
✍ J. Michael Schurr; Steven B. Smith πŸ“‚ Article πŸ“… 1990 πŸ› Wiley (John Wiley & Sons) 🌐 English βš– 362 KB πŸ‘ 1 views

## Abstract A simple theory is developed for the extension of a uniformly charged linear polyion attached at one end in an electric field. For a polyion consisting of a very large number (__N__) of Kuhn lengths (__b__), the mean extension in the direction of the electric field (__E__) is given accu