Regular ring dynamics in AX2 tetrahedral glasses

R. A. Barrio, F. L. Galeener, E. Martínez, and R. J. Elliott
Phys. Rev. B 48, 15672 – Published 1 December 1993
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Abstract

We review the experimental evidence and qualitative arguments for the existence of small highly regular rings of bonds in amorphous (a-)SiO2 and selected other AX2 tetrahedral glasses. The structure and vibrations of planar 3-rings and regular puckered 4-rings in a-SiO2 are then modeled using Born central and noncentral forces. The vibrational coupling of these rings to the more disordered glass network is modeled by attaching a Bethe lattice at each connection. The calculated vibrational properties of the breathing modes of the rings are found to be quite consistent with the observed frequencies, linewidths, and isotope shifts of the sharp lines D1 and D2 seen in the Raman spectra of a-SiO2. The results support the previous assignment of D2 (606 cm1) to a planar 3-ring and D1 (495 cm1) to a regular ring. Similar calculations for a-GeO2 are consistent with the suggestion that this material contains a substantial concentration of nearly planar 3-rings. Our methods can be generalized to treat similar forms of intermediate range order in glasses having other network connectivities.

  • Received 10 May 1993

DOI:https://doi.org/10.1103/PhysRevB.48.15672

©1993 American Physical Society

Authors & Affiliations

R. A. Barrio

  • Instituto de Física, Universidad Nacional Autónoma de México, Apartado Postal 20-364, 01000 México, Distrito Federal Mexico

F. L. Galeener

  • Department of Physics, Colorado State University, Fort Collins, Colorado 80523

E. Martínez

  • Departamento de Física Fundamental, Universidad Autónoma de Madrid, CIII, Canto Blanco, Madrid, Spain

R. J. Elliott

  • Theoretical Physics, Department of Physics, University of Oxford, 1 Keble Road, Oxford OX1 3NP, United Kingdom

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Vol. 48, Iss. 21 — 1 December 1993

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