𝔖 Bobbio Scriptorium
✦   LIBER   ✦

Transferability of dipole moment derivatives: The definition and calculation of pure geometrical reference coordinates

✍ Scribed by W.M.A. Smit; J.H.G. Bode


Publisher
Elsevier Science
Year
1981
Tongue
English
Weight
438 KB
Volume
86
Category
Article
ISSN
0022-2852

No coin nor oath required. For personal study only.


πŸ“œ SIMILAR VOLUMES


AB initio SCF calculation of the force c
✍ Tae-Kyu Ha; R. Meyer; Hs.H. GΓΌnthard πŸ“‚ Article πŸ“… 1973 πŸ› Elsevier Science 🌐 English βš– 212 KB

Using a gaussian Lobe basis set nearly cquivalcnt to the double-zeta Sl;lter type orbital basis set, the principal force constants and rhe derivatives of the electric dipole moment are nIcuIated. The force constants are found to be in scltisktory agreement with csperimentol

Quantum chemical calculations, synthesis
✍ Maris Utinans; Ojars Neilands πŸ“‚ Article πŸ“… 1999 πŸ› John Wiley and Sons 🌐 English βš– 136 KB πŸ‘ 2 views

## The topic of this paper is bipolar organic compounds containing both charged electron donor and electron acceptor groups interconnected by various kinds of bridges (-D-X-A ). Such betaines are subject to photoinduced intramolecular electron transfer (PIET), large change in dipole moment in the