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Application of the AMO method to non-alternant systems

✍ Scribed by Z. Silberman; Z. Gershgorn; R. Pauncz


Publisher
John Wiley and Sons
Year
1968
Tongue
English
Weight
425 KB
Volume
2
Category
Article
ISSN
0020-7608

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The application of the alternant molecul
✍ R. Pauncz πŸ“‚ Article πŸ“… 1963 πŸ› Elsevier Science 🌐 French βš– 457 KB

The alternant molecular orbital method is a device for taking into account the horizontal correlation among electrons posessing different spins. A comparison with the configurationinteraction treatment suggests that in the case of aromatic hydrocarbons the method can yield reliable results only if t