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Thomas-Fermi-Dirac calculations for molecules

✍ Scribed by Jerry Goodisman


Publisher
Springer
Year
1972
Tongue
English
Weight
554 KB
Volume
25
Category
Article
ISSN
1432-2234

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Accurate Thomas–Fermi–Dirac calculations
✍ K. Yonei; J. Goodisman 📂 Article 📅 1977 🏛 John Wiley and Sons 🌐 English ⚖ 863 KB

## Abstract The Thomas–Fermi–Dirac equation for the electron density in a homonuclear diatomic system is solved numerically. The problems arising and methods of dealing with them are discussed and attention is given to the accuracy of the calculated energies. Comparisons are made to previously publ