Ah initlo calculations are reported For the systems .ti(H20)~' and Cu(H~0)z' with n up to 7. Tine cdcul2ted binding ene&s increase monotically up 10 ,I = 6, v&h equal binding energ& for IL = 6 2nd 7 foi Z& Al"'cation. AR estimate of the enihalpy of hydration of M3' \_ IS given, based on model calcuh
Ab initio SCF study of the BO−2 ion and the NaBO2 and HBO2 molecules
✍ Scribed by F. Ramondo; L. Bencivenni; C. Sadun
- Book ID
- 113257065
- Publisher
- Elsevier Science
- Year
- 1990
- Tongue
- English
- Weight
- 533 KB
- Volume
- 209
- Category
- Article
- ISSN
- 0166-1280
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