Fast dynamics of H 2O in hydrous aluminosilicate glasses studied with quasielastic neutron scattering

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Authors

  • Sylvio Indris
  • Paul Heitjans
  • Harald Behrens
  • Reiner Zorn
  • Bernhard Frick

External Research Organisations

  • Forschungszentrum Jülich
  • Institut Laue-Langevin
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Details

Original languageEnglish
Article number064205
JournalPhysical Review B - Condensed Matter and Materials Physics
Volume71
Issue number6
Publication statusPublished - Feb 2005

Abstract

We studied the dynamics of dissolved water in aluminosilicate glasses with the compositions NaAlSi 3O 8·0.3H 2O, NaAlSi 3O 8·1.3H 2O and Ca 0.5AlSi 3O 8·1.3H 2O using quasielastic neutron scattering. As shown by near-infrared spectroscopy on these samples, H 2O molecules are the predominant hydrous species in the water-rich glasses whereas OH groups bound to tetrahedrally coordinated cations are predominant at low water contents. Backscattering and time-of-flight methods were combined to investigate motional correlation times in the range between 0.2 ps and 2 ns. For the water-rich glasses an elastic scan between 2 K and 420 K shows that the dynamical processes set in at lower temperatures in the Ca-bearing glass than in the Na-bearing glass. This is corroborated by the broadening of the inelastic spectra 5(Q,ω). The shape of the scattering function S(Q,t) suggests a distribution of activation barriers for the motion of hydrous species in the disordered structure of the glass. The distribution is narrower and the average activation energy is smaller in the Ca-bearing glass than in the Na-bearing glass. No indication for dynamics of hydrous species was found at temperatures up to 520 K in the water-poor glass NaAlSi 3O 8·0.3H 2O containing dissolved water mainly in the form of OH groups. It is concluded that H 2O molecules are the dynamic species in the above-mentioned time regime in the water-rich glasses. The dynamic process is probably a rotation of H 2O molecules around their bisector axis.

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Fast dynamics of H 2O in hydrous aluminosilicate glasses studied with quasielastic neutron scattering. / Indris, Sylvio; Heitjans, Paul; Behrens, Harald et al.
In: Physical Review B - Condensed Matter and Materials Physics, Vol. 71, No. 6, 064205, 02.2005.

Research output: Contribution to journalArticleResearchpeer review

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title = "Fast dynamics of H 2O in hydrous aluminosilicate glasses studied with quasielastic neutron scattering",
abstract = "We studied the dynamics of dissolved water in aluminosilicate glasses with the compositions NaAlSi 3O 8·0.3H 2O, NaAlSi 3O 8·1.3H 2O and Ca 0.5AlSi 3O 8·1.3H 2O using quasielastic neutron scattering. As shown by near-infrared spectroscopy on these samples, H 2O molecules are the predominant hydrous species in the water-rich glasses whereas OH groups bound to tetrahedrally coordinated cations are predominant at low water contents. Backscattering and time-of-flight methods were combined to investigate motional correlation times in the range between 0.2 ps and 2 ns. For the water-rich glasses an elastic scan between 2 K and 420 K shows that the dynamical processes set in at lower temperatures in the Ca-bearing glass than in the Na-bearing glass. This is corroborated by the broadening of the inelastic spectra 5(Q,ω). The shape of the scattering function S(Q,t) suggests a distribution of activation barriers for the motion of hydrous species in the disordered structure of the glass. The distribution is narrower and the average activation energy is smaller in the Ca-bearing glass than in the Na-bearing glass. No indication for dynamics of hydrous species was found at temperatures up to 520 K in the water-poor glass NaAlSi 3O 8·0.3H 2O containing dissolved water mainly in the form of OH groups. It is concluded that H 2O molecules are the dynamic species in the above-mentioned time regime in the water-rich glasses. The dynamic process is probably a rotation of H 2O molecules around their bisector axis.",
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T1 - Fast dynamics of H 2O in hydrous aluminosilicate glasses studied with quasielastic neutron scattering

AU - Indris, Sylvio

AU - Heitjans, Paul

AU - Behrens, Harald

AU - Zorn, Reiner

AU - Frick, Bernhard

PY - 2005/2

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N2 - We studied the dynamics of dissolved water in aluminosilicate glasses with the compositions NaAlSi 3O 8·0.3H 2O, NaAlSi 3O 8·1.3H 2O and Ca 0.5AlSi 3O 8·1.3H 2O using quasielastic neutron scattering. As shown by near-infrared spectroscopy on these samples, H 2O molecules are the predominant hydrous species in the water-rich glasses whereas OH groups bound to tetrahedrally coordinated cations are predominant at low water contents. Backscattering and time-of-flight methods were combined to investigate motional correlation times in the range between 0.2 ps and 2 ns. For the water-rich glasses an elastic scan between 2 K and 420 K shows that the dynamical processes set in at lower temperatures in the Ca-bearing glass than in the Na-bearing glass. This is corroborated by the broadening of the inelastic spectra 5(Q,ω). The shape of the scattering function S(Q,t) suggests a distribution of activation barriers for the motion of hydrous species in the disordered structure of the glass. The distribution is narrower and the average activation energy is smaller in the Ca-bearing glass than in the Na-bearing glass. No indication for dynamics of hydrous species was found at temperatures up to 520 K in the water-poor glass NaAlSi 3O 8·0.3H 2O containing dissolved water mainly in the form of OH groups. It is concluded that H 2O molecules are the dynamic species in the above-mentioned time regime in the water-rich glasses. The dynamic process is probably a rotation of H 2O molecules around their bisector axis.

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