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Electron correlation forms in the LiH molecule—fermi correlation

✍ Scribed by Xuejun Feng; Jens Peder Dahl

Publisher
John Wiley and Sons
Year
1989
Tongue
English
Weight
778 KB
Volume
36
Category
Article
ISSN
0020-7608

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Electron correlation effects in SCF+CI w
Electron correlation effects in SCF+CI wave functions—Fermi and coulomb correlation holes in HCN
✍ Ian L. Cooper; Christopher N. M. Pounder 📂 Article 📅 1980 🏛 John Wiley and Sons 🌐 English ⚖ 722 KB

## Abstract The Coulomb correlation hole distribution function has been computed with respect to various reference centers in the HCN molecule, using standard SCF+CI type wave functions. The extent to which statistical correlation between unlike‐spin electrons is introduced into an SCF wave functio