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On the accuracy of numerical Hartree–Fock energies

✍ Scribed by Frank Jensen

Book ID: 105885734
Publisher: Springer
Year: 2005
Tongue: English
Weight: 92 KB
Volume: 113
Category: Article
ISSN: 1432-2234
DOI: 10.1007/s00214-004-0618-8

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📜 SIMILAR VOLUMES

On the accuracy of hartree-fock wave-fun

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is shown. by comparison with experiment, that the use of explicit angular momentum coupling in Hartree-Fock solutions for rare-earth ions can lead to inaccurate 4f radial wave-functions beCaUSe of the neglect of intershell correlation effects.

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