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Calculation of vacancy-formation energy of alkali metals using an electron-density functional

โœ Scribed by V. M. Kuznetsov; Yu. A. Khon; S. A. Beznosyuk; V. P. Fadin


Book ID
112426069
Publisher
Springer
Year
1979
Tongue
English
Weight
241 KB
Volume
22
Category
Article
ISSN
1573-9228

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The calculation of clusters of alkali me
โœ Yu.A. Borisov ๐Ÿ“‚ Article ๐Ÿ“… 1976 ๐Ÿ› Elsevier Science ๐ŸŒ English โš– 309 KB

The density functional due to Kixzhnits is used to calculate values of the equilibrium lattice parameters (a) and of the atomization energy (D) for alkali metals clusters M n (bee and fee structured Li clusters artd bee structured Na clusters), containing 9 to 100 atoms. The calculated values of a a