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Quantum chemical calculations of SiF-species

✍ Scribed by Rainer Lück; Gudrun Scholz; Lothar Kolditz


Book ID
104150160
Publisher
Elsevier Science
Year
1985
Tongue
English
Weight
36 KB
Volume
29
Category
Article
ISSN
0022-1139

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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(