๐”– Bobbio Scriptorium
โœฆ   LIBER   โœฆ

A discussion of the bonding in ferrocene from an ab initio LCAO MO SCF calculation

โœ Scribed by M.M. Rohmer; A. Veillard

Publisher
Elsevier Science
Year
1975
Tongue
English
Weight
709 KB
Volume
11
Category
Article
ISSN
0301-0104

No coin nor oath required. For personal study only.

๐Ÿ“œ SIMILAR VOLUMES

Bonding in phosphorus oxyfluoride and ph
Bonding in phosphorus oxyfluoride and phosphorus thiofluoride. An ab initio SCF LCAO MO study
โœ A. Serafini; J.-F. Labarre ๐Ÿ“‚ Article ๐Ÿ“… 1974 ๐Ÿ› Elsevier Science ๐ŸŒ English โš– 240 KB

## A comparison of the electronic structures of the molecules OPFs and SPFs is performed within the framework of an ab initio SCF LCAO MO study. In complete agreement with the empirical assumptions provided by previous magneto-optical experiments, the (P-S) bond in SPFs is weaker, endowed with a h

Proton polarizability of hydrogen-bonded
Proton polarizability of hydrogen-bonded chains: An ab initio SCF calculation with a model related to the conducting system in bacteriorhodopsin
โœ Johannes Fritsch; Georg Zundel; A. Hayd; M. Maurer ๐Ÿ“‚ Article ๐Ÿ“… 1984 ๐Ÿ› Elsevier Science ๐ŸŒ English โš– 397 KB

The energy and dipole-moment surfaces of the proton motion in the hydrogen-bonded formic-acid -water-formats systern are calculated using an ab initio treatment. Such a system shows a very Ia+ proton pokuizability. The charge motion proceeds step-by-step. ## Consequences regarding the charge con