A CNDO/2 molecular orbital study of the silica polymorphs quartz, cristobalite, and coesite-Reference-Cited by-同舟云学术

A CNDO/2 molecular orbital study of the silica polymorphs quartz, cristobalite, and coesite

Published:1979 Issue:1 Volume:4 Page:11-21
ISSN:0342-1791
Container-title:Physics and Chemistry of Minerals
language:en
Short-container-title:Phys Chem Minerals

Author:

Meagher E. P.,Tossell J. A.,Gibbs G. V.

Publisher

Springer Science and Business Media LLC

Subject

Geochemistry and Petrology,General Materials Science

Link

http://link.springer.com/content/pdf/10.1007/BF00308356.pdf

Reference30 articles.

1. Allen, L.C.: Why three-dimensional Hückel theory works and where it breaks down. In: Sigma Molecular Orbital Theory, Sinanoglu, O. and Wiberg, K.B. (eds.). New Haven, Connecticut: Yale University Press 1970, pp. 227?248

2. Araki, T., Zoltai, T.: Refinement of a coesite structure. Krist. 129, 381?387 (1969)

3. Baur, W.H.: The prediction of bond length variations in silicon oxygen bonds. Am. Mineral. 56, 1573?1598 (1971)

4. Baur, W.H.: Silicon-oxygen bond length prediction is based on bond strength variation, other factors contribute very little. (Abstr.) Amer. Crystallogr. Assoc. Summer Meeting, Illinois. 4, 60 (1976)

5. Baur, W.H.: Silicon-oxygen bond lengths, bridging angles Si-O-Si and synthetic low tridymite. Acta Cryst. B33, 2615?2619 (1977)

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