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Study of the Coulomb-lattice vibrations by the scf-method

โœ Scribed by B. Pietrass

Publisher
Elsevier Science
Year
1967
Tongue
English
Weight
141 KB
Volume
24
Category
Article
ISSN
0375-9601

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๐Ÿ“œ SIMILAR VOLUMES

On the use of a model function of Coulom
On the use of a model function of Coulomb hole approximation for evaluation of the Coulomb integrals in semiempirical SCF MO methods
โœ M.J. Filatov; I.L. Zilberberg; G.M. Zhidomirov ๐Ÿ“‚ Article ๐Ÿ“… 1992 ๐Ÿ› Elsevier Science ๐ŸŒ English โš– 273 KB

In order to evaluate the Coulomb and exchange integrals in the semiempirical SCF MO methods over an spd-basis of orbitals, an approximation of the model function of the Coulomb hole is used. The procedure of calculating mono-and bicentric Coulomb integrals based on the properties of Fourier transfor

Raman and far-infrared study of the latt
Raman and far-infrared study of the lattice vibrations of methanol
โœ A. Anderson; B. Andrews; E. M. Meiering; B. H. Torrie ๐Ÿ“‚ Article ๐Ÿ“… 1988 ๐Ÿ› John Wiley and Sons ๐ŸŒ English โš– 424 KB ๐Ÿ‘ 2 views

Raman and far-infrared spectra of the lattice vibrations of solid methanol in the ordered a-phase at 20 K are presented and discussed in terms of the available crystallographic data. Spectra of the deuterated species, CH,OD and CD,OD, have also been recorded to facilitate the assignment of observed