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Bond energies of small metal clusters

โœ Scribed by Karl A. Gingerich; I. Shim; S.K. Gupta; J.E. Kingcade Jr.


Book ID
118986296
Publisher
Elsevier Science
Year
1985
Tongue
English
Weight
691 KB
Volume
156
Category
Article
ISSN
0039-6028

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๐Ÿ“œ SIMILAR VOLUMES


Bond energies of small metal clusters
โœ Karl A. Gingerich; I. Shim; S.K. Gupta; J.E. Kingcade Jr. ๐Ÿ“‚ Article ๐Ÿ“… 1985 ๐Ÿ› Elsevier Science โš– 51 KB
Binding energies of small benzene cluste
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The binding energies of small Be cluster
โœ R.J. Harrison; N.C. Handy ๐Ÿ“‚ Article ๐Ÿ“… 1986 ๐Ÿ› Elsevier Science ๐ŸŒ English โš– 632 KB

The recent success of ab initio calculations in predicting the existence of several vibrational states of Be, %'Xl (now experimentally verified) shows that it is necessary to perform highly accurate calculations on small Be clusters for results to be reliable. We report the results of such calculati

Bond energies for molecules, clusters, a
โœ Karl Jug; Gerald Geudtner ๐Ÿ“‚ Article ๐Ÿ“… 2003 ๐Ÿ› John Wiley and Sons ๐ŸŒ English โš– 170 KB

## Abstract A new approach is suggested to the assignment of bond energies in molecules and clusters. It uses a shareholder principle for the redistribution of the shifts in atomic energies, which arise in a molecule, on the bonds. The scheme is directly suitable for semiempirical methods, where on

Binding energies and bond distances of i
โœ Karl Jug; Gerald Geudtner ๐Ÿ“‚ Article ๐Ÿ“… 1993 ๐Ÿ› Elsevier Science ๐ŸŒ English โš– 377 KB

Binding energies and bond distances are calculated with the semiempirical MO method SINDO 1. A quasilinear relationship is found between normalized binding energies or average bond distances and relative average coordination numbers. It is demonstrated that binding energy per unit and binding energy