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The force constants and vibration frequencies of trihalides of metals of the III-a group

✍ Scribed by V. G. Solomonik; K. S. Krasnov


Publisher
Springer US
Year
1974
Tongue
English
Weight
173 KB
Volume
21
Category
Article
ISSN
0021-9037

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πŸ“œ SIMILAR VOLUMES


Unrestricted Hartreeβ€”Fock calculation of
✍ P. Botschwina πŸ“‚ Article πŸ“… 1974 πŸ› Elsevier Science 🌐 English βš– 453 KB

UHk SCF ulculations with ZI medium-sized basis set of gaussian lobe functions have been performed on the ground state of the X0 Ladical. All the harmonic and the diagonal cubic force constants have been calculated by thb force method of Pulay. From the force constants, vibrational frequexies have be