The application of an effective nuclear charge model to the prediction of valence force constants in uranyl tetrachloride and pentafluoride complexes—VIII
✍ Scribed by Ken Ohwada
- Publisher
- Elsevier Science
- Year
- 1985
- Tongue
- English
- Weight
- 480 KB
- Volume
- 41
- Category
- Article
- ISSN
- 1386-1425
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✦ Synopsis
The effective nuclear charge model previously developed is applied to calculate the valence force constants of uranyl tetrachloride complexes MIUO,C1,(M: K, Rb, Cs, NH4) and uranyl pentafluoride complexes M3UOZFS (M: K, Rb, Cs, NH,). The various types of force constants for such complexes are computed with the use of reasonable effective nuclear charges and geometric parameters and compared with the experimental force constants which have already been determined by normal coordinate analyses. The results show that the effective nuclear charge model is useful in predicting semiquantitatively the valence force constants for more complicated general polyatomic molecules.