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Molecular dynamics simulations of liquids and glasses in the system NaAlSiO4-SiO2: Physical properties and transport mechanisms

  • D.J. Stein and F.J. Spera
Published/Copyright: November 13, 2015
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American Mineralogist
From the journal American Mineralogist Volume 81 Issue 3-4

Received: 1995-3-30
Accepted: 1995-12-7
Published Online: 2015-11-13
Published in Print: 1996-3-1

© 2015 by Walter de Gruyter Berlin/Boston

Articles in the same Issue

  1. Four-membered rings in silica and aluminosilicate glasses
  2. An in situ Raman spectroscopic study of Na2Si2O5 at high pressures and temperatures: Structures of compressed liquids and glasses
  3. Molecular dynamics simulations of liquids and glasses in the system NaAlSiO4-SiO2: Physical properties and transport mechanisms
  4. Molecular dynamics of NaCl (B1 and B2) and MgO (B1) melting: Two-phase simulation
  5. Synthesis of high-pressure hydrous magnesium silicates: Observations and analysis
  6. High-pressure crystal chemistry of LiScSiO4: An olivine with nearly isotropic compression
  7. Volume behavior of hydrous minerals at high pressure and temperature: I. Thermal expansion of lawsonite, zoisite, clinozoisite, and diaspore
  8. Volume behavior of hydrous minerals at high pressure and temperature: II. Compressibilities of lawsonite, zoisite, clinozoisite, and epidote
  9. The phenomenon of low Al-Si ordering temperatures in aluminosilicate framework structures
  10. Crystal structure of a P21/m ferromagnesian cummingtonite at 140 K
  11. Monoclinic-orthorhombic phase transition in the K2MgSi5O12 leucite analog
  12. Magnetic properties of the magnetite-spinel solid solution: Curie temperatures, magnetic susceptibilities, and cation ordering
  13. Protons in the magnesium phosphates phosphoellenbergerite and holtedahlite: An IR and NMR study
  14. Channel occupancy in an alkali-poor beryl from Serra Branca (Goias, Brazil): Spectroscopic characterization
  15. New short-range biopyribole polysomes from the Lepontine Alps, Switzerland
  16. Single-crystal IR spectroscopy of pyrope-almandine garnets with minor amounts of Mn and Ca
  17. Parameterization of energy and interactions in garnets: End-member properties
  18. Ca self-diffusion in grossular garnet
  19. Compositional dependence of H2O solubility along the joins NaAlSi3O8-KAlSi3O8, NaAlSi3O8-LiAlSi3O8, and KAlSi3O8-LiAlSi3O8
  20. Epidote in calc-alkaline magmas: An experimental study of stability, phase relationships, and the role of epidote in magmatic evolution
  21. Reinvestigation of the annite = sanidine + magnetite + H2 reaction using the fH₂-sensor technique
  22. Three novel isograds in metamorphosed siliceous dolomites from the Ballachulish aureole, Scotland
  23. Cl-rich biotite and amphibole from Black Rock Forest, Cornwall, New York
  24. Medenbachite, Bi2Fe(Cu,Fe)(O,OH)2(OH)2(AsO4)2, a new mineral species: Its description and crystal structure
  25. Mechanism of CO2-3 substitution in carbonate-fluorapatite: Evidence from FTIR spectroscopy, 13C NMR, and quantum mechanical calculations- Discussion
  26. Mechanism of CO2-3 substitution in carbonate-fluorapatite: Evidence from FTIR spectroscopy, 13C NMR, and quantum mechanical calculations-Reply to Nathan
  27. New Mineral Names
  28. Memorial of Sturges William Bailey 1919–1994
  29. Book Review
https://doi.org/10.2138/am-1996-3-403

Articles in the same Issue

  1. Four-membered rings in silica and aluminosilicate glasses
  2. An in situ Raman spectroscopic study of Na2Si2O5 at high pressures and temperatures: Structures of compressed liquids and glasses
  3. Molecular dynamics simulations of liquids and glasses in the system NaAlSiO4-SiO2: Physical properties and transport mechanisms
  4. Molecular dynamics of NaCl (B1 and B2) and MgO (B1) melting: Two-phase simulation
  5. Synthesis of high-pressure hydrous magnesium silicates: Observations and analysis
  6. High-pressure crystal chemistry of LiScSiO4: An olivine with nearly isotropic compression
  7. Volume behavior of hydrous minerals at high pressure and temperature: I. Thermal expansion of lawsonite, zoisite, clinozoisite, and diaspore
  8. Volume behavior of hydrous minerals at high pressure and temperature: II. Compressibilities of lawsonite, zoisite, clinozoisite, and epidote
  9. The phenomenon of low Al-Si ordering temperatures in aluminosilicate framework structures
  10. Crystal structure of a P21/m ferromagnesian cummingtonite at 140 K
  11. Monoclinic-orthorhombic phase transition in the K2MgSi5O12 leucite analog
  12. Magnetic properties of the magnetite-spinel solid solution: Curie temperatures, magnetic susceptibilities, and cation ordering
  13. Protons in the magnesium phosphates phosphoellenbergerite and holtedahlite: An IR and NMR study
  14. Channel occupancy in an alkali-poor beryl from Serra Branca (Goias, Brazil): Spectroscopic characterization
  15. New short-range biopyribole polysomes from the Lepontine Alps, Switzerland
  16. Single-crystal IR spectroscopy of pyrope-almandine garnets with minor amounts of Mn and Ca
  17. Parameterization of energy and interactions in garnets: End-member properties
  18. Ca self-diffusion in grossular garnet
  19. Compositional dependence of H2O solubility along the joins NaAlSi3O8-KAlSi3O8, NaAlSi3O8-LiAlSi3O8, and KAlSi3O8-LiAlSi3O8
  20. Epidote in calc-alkaline magmas: An experimental study of stability, phase relationships, and the role of epidote in magmatic evolution
  21. Reinvestigation of the annite = sanidine + magnetite + H2 reaction using the fH₂-sensor technique
  22. Three novel isograds in metamorphosed siliceous dolomites from the Ballachulish aureole, Scotland
  23. Cl-rich biotite and amphibole from Black Rock Forest, Cornwall, New York
  24. Medenbachite, Bi2Fe(Cu,Fe)(O,OH)2(OH)2(AsO4)2, a new mineral species: Its description and crystal structure
  25. Mechanism of CO2-3 substitution in carbonate-fluorapatite: Evidence from FTIR spectroscopy, 13C NMR, and quantum mechanical calculations- Discussion
  26. Mechanism of CO2-3 substitution in carbonate-fluorapatite: Evidence from FTIR spectroscopy, 13C NMR, and quantum mechanical calculations-Reply to Nathan
  27. New Mineral Names
  28. Memorial of Sturges William Bailey 1919–1994
  29. Book Review
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