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Theoretical interpretation of 29Si NMR chemical shifts of aluminosilicates: Part 2. The SiOT (TSi or Al) bond angle dependence

✍ Scribed by Renate Wolff; Reiner Radeglia; Christine Vogel; Joachim Sauer


Book ID
119117294
Publisher
Elsevier Science
Year
1989
Tongue
English
Weight
642 KB
Volume
183
Category
Article
ISSN
0166-1280

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Correlation of SiOT (T = Si OR Al) ang
✍ R. Radeglia; G. Engelhardt 📂 Article 📅 1985 🏛 Elsevier Science 🌐 English ⚖ 215 KB

The empirical correlation of 2gSi NMR chemical shifts 6 and the mean SIOT (T = Al. 5%) bond angles a in sibcates and alutiosili~tes is explained by a simple quantum-chemical model. A linear mrrelatlon 6 = 6 o + M + b cos a/(cos a -1) is derived, where n is the number of Al atoms in the Si(OSi)q \_n(