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Correlation and the one-center method

✍ Scribed by Antony F. Saturno; Ronald M. Rutledge

Book ID
104577407
Publisher
John Wiley and Sons
Year
2009
Tongue
English
Weight
33 KB
Volume
1
Category
Article
ISSN
0020-7608

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πŸ“œ SIMILAR VOLUMES

One-center expansion method with model p
One-center expansion method with model potentials. I. Formulation and test calculations
✍ Alex R. Tindimubona πŸ“‚ Article πŸ“… 1980 πŸ› John Wiley and Sons 🌐 English βš– 737 KB

## Abstract The one‐center expansion (OCE) method is extended to evaluate molecular wave functions for molecules with heavy off‐center nuclei. This extension is achieved through the use of model potentials (MP) to approximate the highly bound core orbitals. The remaining diffuse valence charge dist

Binding energies as computed by a one ce
Binding energies as computed by a one center expansion method
✍ G. de Alti; P. Decleva πŸ“‚ Article πŸ“… 1975 πŸ› Elsevier Science 🌐 English βš– 326 KB

The calculation of the binding energies of molecular electrons as the diffcrcncc be:ween the ener&s oi pound stale and hole state is performed by a one center expansion method. The results arc compared with the experimental data and discussed comparatively with the early computations. The molecules