Crystal structure, thermal expansivity, and elasticity of OH-chondrodite: Trends among dense hydrous magnesium silicates
Abstract
Here, we report the structure and thermoelastic properties of OH-chondrodite. The sample was synthesized at 12 GPa and 1523 K, coexisting with hydroxyl-clinohumite and hydrous olivine. The Fe content Fe/(Fe+Mg) is 1.1 mol%, and the monoclinic unit-cell parameters are: a = 4.7459(2) Å, b = 10.3480(7) Å, c = 7.9002(6) Å, α = 108.702(7)°, and V = 367.50(4) Å3. At ambient conditions the crystal structure was refined in space group P21/b from 1915 unique reflection intensities measured by single-crystal x-ray diffraction. The volume thermal expansion coefficient was measured between 150 and 800 K, resulting in αV = 2.8(5)×10-9(K-2) × T + 40.9(7) × 10-6(K-1) – 0.81(3)(K)/T2, with an average value of 38.0(9)×10-6 K-1. Brillouin spectroscopy was used to measure a set of acoustic velocities from which all thirteen components (Cij) of the elastic tensor were determined. The Voigt-Reuss-Hill average of the moduli yield for the adiabatic bulk modulus, KS0 = 117.9(12) GPa, and for shear modulus, G0 = 70.1(5) GPa. The Reuss bound on the isothermal bulk modulus (KT0) is 114.2(14) GPa. From the measured thermodynamic properties, the Grüneisen parameter (γ) is calculated to be 1.66(4). Fitting previous static compression data using our independently measured bulk modulus (isothermal Reuss bound)more »
- Authors:
-
- China Univ. of Geosciences, Wuhan (People's Republic of China); Univ. of Colorado, Boulder, CO (United States)
- Northwestern Univ., Evanston, IL (United States)
- Univ. of Science and Technology of China, Hefei (People's Republic of China)
- Princeton Univ., Princeton, NJ (United States)
- Univ. of Colorado, Boulder, CO (United States)
- Publication Date:
- Research Org.:
- Carnegie Institution of Washington, Washington, D.C. (United States)
- Sponsoring Org.:
- USDOE National Nuclear Security Administration (NNSA)
- OSTI Identifier:
- 1335501
- Grant/Contract Number:
- NA0002006
- Resource Type:
- Accepted Manuscript
- Journal Name:
- Contributions to Mineralogy and Petrology
- Additional Journal Information:
- Journal Volume: 169; Journal Issue: 4; Journal ID: ISSN 0010-7999
- Publisher:
- Springer
- Country of Publication:
- United States
- Language:
- English
- Subject:
- 37 INORGANIC, ORGANIC, PHYSICAL, AND ANALYTICAL CHEMISTRY; 58 GEOSCIENCES; chondrodite; dense hydrous magnesium silicates; crystal structure; thermal expansivity; bulk modulus; Gruneisen parameter
Citation Formats
Ye, Yu, Jacobsen, Steven D., Mao, Zhu, Duffy, Thomas S., Hirner, Sarah M., and Smyth, Joseph R. Crystal structure, thermal expansivity, and elasticity of OH-chondrodite: Trends among dense hydrous magnesium silicates. United States: N. p., 2015.
Web. doi:10.1007/s00410-015-1138-3.
Ye, Yu, Jacobsen, Steven D., Mao, Zhu, Duffy, Thomas S., Hirner, Sarah M., & Smyth, Joseph R. Crystal structure, thermal expansivity, and elasticity of OH-chondrodite: Trends among dense hydrous magnesium silicates. United States. https://doi.org/10.1007/s00410-015-1138-3
Ye, Yu, Jacobsen, Steven D., Mao, Zhu, Duffy, Thomas S., Hirner, Sarah M., and Smyth, Joseph R. Wed .
"Crystal structure, thermal expansivity, and elasticity of OH-chondrodite: Trends among dense hydrous magnesium silicates". United States. https://doi.org/10.1007/s00410-015-1138-3. https://www.osti.gov/servlets/purl/1335501.
@article{osti_1335501,
title = {Crystal structure, thermal expansivity, and elasticity of OH-chondrodite: Trends among dense hydrous magnesium silicates},
author = {Ye, Yu and Jacobsen, Steven D. and Mao, Zhu and Duffy, Thomas S. and Hirner, Sarah M. and Smyth, Joseph R.},
abstractNote = {Here, we report the structure and thermoelastic properties of OH-chondrodite. The sample was synthesized at 12 GPa and 1523 K, coexisting with hydroxyl-clinohumite and hydrous olivine. The Fe content Fe/(Fe+Mg) is 1.1 mol%, and the monoclinic unit-cell parameters are: a = 4.7459(2) Å, b = 10.3480(7) Å, c = 7.9002(6) Å, α = 108.702(7)°, and V = 367.50(4) Å3. At ambient conditions the crystal structure was refined in space group P21/b from 1915 unique reflection intensities measured by single-crystal x-ray diffraction. The volume thermal expansion coefficient was measured between 150 and 800 K, resulting in αV = 2.8(5)×10-9(K-2) × T + 40.9(7) × 10-6(K-1) – 0.81(3)(K)/T2, with an average value of 38.0(9)×10-6 K-1. Brillouin spectroscopy was used to measure a set of acoustic velocities from which all thirteen components (Cij) of the elastic tensor were determined. The Voigt-Reuss-Hill average of the moduli yield for the adiabatic bulk modulus, KS0 = 117.9(12) GPa, and for shear modulus, G0 = 70.1(5) GPa. The Reuss bound on the isothermal bulk modulus (KT0) is 114.2(14) GPa. From the measured thermodynamic properties, the Grüneisen parameter (γ) is calculated to be 1.66(4). Fitting previous static compression data using our independently measured bulk modulus (isothermal Reuss bound) as a fixed parameter, we refined the first pressure derivative of the bulk modulus, KT’ = 5.5(1). Systematic trends between H2O content and physical properties are evaluated among dense hydrous magnesium silicate (DHMS) phases along the forsterite-brucite join.},
doi = {10.1007/s00410-015-1138-3},
journal = {Contributions to Mineralogy and Petrology},
number = 4,
volume = 169,
place = {United States},
year = {Wed Apr 01 00:00:00 EDT 2015},
month = {Wed Apr 01 00:00:00 EDT 2015}
}
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