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Diffusion-diffusive phase transformations in alkali feldspar

Diffusion-diffusive phase transformations in alkali feldspar

Rainer Abart (ORCID: 0000-0001-9562-450X)
  • Grant DOI 10.55776/I4404
  • Funding program Einzelprojekte International
  • Status ended
  • Start July 1, 2020
  • End January 31, 2024
  • Funding amount € 283,815

DACH: Österreich - Deutschland - Schweiz

Disciplines

Geosciences (67%); Physics, Astronomy (33%)

Keywords

    Alkali Diffusion, Diffusive Phase Transformations, Alkali Feldspar, Modelling, Experiment

Abstract Final report

In this project, the exsolution of alkali feldspar will be investigated experimentally and by means of thermodynamic and atomistic modelling. Alkali feldspar is one of the most abundant minerals in the Earths crust. At temperatures above about 600C it forms a continuous solid-solution series between a sodium- and a potassium end-member. An alkali feldspar of intermediate composition that was formed at high temperatures tends to unmix during cooling, whereby typically a lamellar intergrowth of more sodium-rich and more potassium-rich feldspar is formed. The extent of chemical segregation between the lamellae and the characteristic lamellar width depend on the cooling rate and thus bear valuable information on the thermal history of the host rock. For a quantitative extraction of the information stored in the lamellar microstructure of exsolved alkali feldspar and in the chemical compositions of the lamellae, the mechanisms underlying the exsolution must be understood and need to be calibrated experimentally. In nature, the cooling of rock units occurs over time spans of millions of years, which makes a direct experimental calibration difficult, because laboratory experiments cannot be run over geological time spans. The only feasible experimental approach is the investigation of small, nanometer-scaled exsolution microstructures, which can be produced in laboratory experiments over well amenable run durations on the order of several weeks or months. We plan exsolution- and diffusion experiments, which will address the mobilities of sodium and potassium within alkali feldspar, on the one hand, and the thermodynamics and kinetics underlying the exsolution process, on the other hand. The experimental run products will be analyzed for their microstructures and chemical compositions on the nanometer scale using analytical techniques with high spatial resolution including scanning- and transmission electron microscopy and atom probe tomography. The analytical data will be integrated into thermodynamic and kinetic model calculations and atomistic simulations to quantify the relevant model parameters such as diffusion coefficients, interfacial energies, and the mechanical stress induced in coherent lamellar intergrowth. Based on an improved understanding of the exsolution process, a comprehensive model will be developed and calibrated, which adequately describes the exsolution of alkali feldspar in a qualitative and in a quantitative sense and which allows for the extraction of cooling rates from natural exsolved alkali feldspars. Considering the ubiquitous occurrence of alkali feldspar, such a geo-speedometer will substantially contribute to an improved understanding of geodynamic processes in the Earths crust.

In this project, the exsolution of alkali feldspar will be investigated experimentally and by means of thermodynamic and atomistic modelling. Alkali feldspar is one of the most abundant minerals in the Earth's crust. At temperatures above about 600C it forms a continuous solid-solution series between a sodium- and a potassium end-member. An alkali feldspar of intermediate composition that was formed at high temperatures tends to unmix during cooling, whereby typically a lamellar intergrowth of more sodium-rich and more potassium-rich feldspar is formed. The extent of chemical segregation between the lamellae and the characteristic lamellar width depend on the cooling rate and thus bear valuable information on the thermal history of the host rock. For a quantitative extraction of the information stored in the lamellar microstructure of exsolved alkali feldspar and in the chemical compositions of the lamellae, the mechanisms underlying the exsolution must be understood and need to be calibrated experimentally. In nature, the cooling of rock units occurs over time spans of millions of years, which makes a direct experimental calibration difficult, because laboratory experiments cannot be run over geological time spans. The only feasible experimental approach is the investigation of small, nanometer-scaled exsolution microstructures, which can be produced in laboratory experiments over well amenable run durations on the order of several weeks or months. We plan exsolution- and diffusion experiments, which will address the mobilities of sodium and potassium within alkali feldspar, on the one hand, and the thermodynamics and kinetics underlying the exsolution process, on the other hand. The experimental run products will be analyzed for their microstructures and chemical compositions on the nanometer scale using analytical techniques with high spatial resolution including scanning- and transmission electron microscopy and atom probe tomography. The analytical data will be integrated into thermodynamic and kinetic model calculations and atomistic simulations to quantify the relevant model parameters such as diffusion coefficients, interfacial energies, and the mechanical stress induced in coherent lamellar intergrowth. Based on an improved understanding of the exsolution process, a comprehensive model will be developed and calibrated, which adequately describes the exsolution of alkali feldspar in a qualitative and in a quantitative sense and which allows for the extraction of cooling rates from natural exsolved alkali feldspars. Considering the ubiquitous occurrence of alkali feldspar, such a geo-speedometer will substantially contribute to an improved understanding of geodynamic processes in the Earth's crust.

Research institution(s)
  • Universität Wien - 100%
Project participants
  • Herbert Hutter, Technische Universität Wien , national collaboration partner
  • Thomas Waitz, Universität Wien , national collaboration partner
International project participants
  • Jiri Svoboda, Academy of Sciences of the Czech Republic - Czechia
  • Baptiste Gault, Max Planck Institut für nachhaltige Materialien - Germany
  • Sergiy V. Divinskiy, Westfälische Wilhelms-Universität - Germany

Research Output

  • 26 Citations
  • 14 Publications
Publications
  • 2024
    Title Mechanism and Kinetics of Sodium Diffusion in Na-Feldspar from Neural Network Based Atomistic Simulations
    DOI 10.2139/ssrn.4889098
    Type Preprint
    Author Abart R
  • 2024
    Title Coherent solvus of disordered alkali feldspar: experiment, atom probe tomography and thermodynamic model.
    DOI 10.1007/s00410-024-02150-z
    Type Journal Article
    Author Dubosq R
    Journal Contributions to mineralogy and petrology. Beitrage zur Mineralogie und Petrologie
    Pages 68
  • 2024
    Title Thermodynamic mixing properties of disordered alkali feldspar solid-solution from Na-K partitioning and low-temperature calorimetry
    DOI 10.1007/s00269-024-01270-z
    Type Journal Article
    Author Heuser D
    Journal Physics and Chemistry of Minerals
  • 2024
    Title Structure and thermodynamics of defects in Na-feldspar from a neural network potential
    DOI 10.1103/physrevmaterials.8.073602
    Type Journal Article
    Author Gorfer A
    Journal Physical Review Materials
    Pages 073602
    Link Publication
  • 2024
    Title Structure and thermodynamics of defects in Na-feldspar from a neural network potential
    Type Journal Article
    Author Abart
    Journal Phys. Rev. Mater.
    Pages 073602
    Link Publication
  • 2023
    Title Coherent lamellar intergrowth in alkali feldspar
    DOI 10.1007/s00410-023-02059-z
    Type Journal Article
    Author Petrishcheva E
    Journal Contributions to Mineralogy and Petrology
    Pages 77
    Link Publication
  • 2024
    Title Exsolution in Alkali Feldspar
    Type PhD Thesis
    Author David Heuser
  • 2023
    Title High-density liquid (HDL) adsorption at the supercooled water/vapor interface and its possible relation to the second surface tension inflection point
    DOI 10.1063/5.0132985
    Type Journal Article
    Author Gorfer A
    Journal The Journal of Chemical Physics
    Pages 054503
    Link Publication
  • 2022
    Title High-density liquid (HDL) adsorption at the supercooled water/vapor interface and its possible relation to the second surface tension inflection point
    DOI 10.48550/arxiv.2211.08865
    Type Preprint
    Author Gorfer A
  • 2021
    Title Effect of chemically induced fracturing on the ice nucleation activity of alkali feldspar
    DOI 10.5194/acp-2021-18
    Type Preprint
    Author Kiselev A
    Pages 1-17
    Link Publication
  • 2022
    Title Evolution of chemically induced cracks in alkali feldspar: thermodynamic analysis
    DOI 10.1007/s00269-022-01183-9
    Type Journal Article
    Author Abart R
    Journal Physics and Chemistry of Minerals
    Pages 14
    Link Publication
  • 0
    DOI 10.5194/acp-2021-18-rc2
    Type Other
  • 0
    DOI 10.5194/acp-2021-18-rc1
    Type Other
  • 0
    DOI 10.5194/acp-2021-18-ac1
    Type Other

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