IntersecT: a Python script for quantitative isopleth thermobarometry of equilibrium and disequilibrium systems

Isopleth thermobarometry involves comparing compositional isopleths generated from forward thermodynamic models with the measured mineral compositions in a specific assemblage to retrieve the pressure and temperature conditions of equilibration. This technique has been used extensively in the last two decades to constrain the conditions of metamorphism for natural rock samples. However, this method is often applied qualitatively, relying on the intersection of a limited number of isopleths for a few selected phases. Recent works have introduced software solutions with more quantitative approaches; these use statistical methods to derive optimal P–T conditions and provide a more accurate interpretation of forward modelling results. Despite these advances, these methods are not commonly used. IntersecT aims at distributing a tool for statistically quantifying the quality of fit using the WERAMI output of Perple_X and applying multiple approaches, including the quality factor concept from Bingo-Antidote. This formulation allows the propagation of measurement uncertainty in isopleth thermobarometry. In addition, IntersecT applies reduced χ 2 statistics to assess the weight of the considered phases, enabling the down-weighting of outlier data due to model inaccuracies or incorrect assumptions, such as disequilibrium features. The quality factor approach helps to visualize discrepancies resulting from these issues. IntersecT provides a quantitative framework to improve the interpretation of Perple_X isopleth thermobarometry results, allowing compositional uncertainties in the measured mineral composition to be considered. This approach can also help interpret how phase equilibrium experiments reproduce the observed compositions for magmatic and metamorphic systems. • IntersecT uses a statistical framework to apply isopleth thermobarometry • A quality factor approach is integrated with reduced chi-squared statistic • IntersecT helps recognize each element and phase contribution to the overall fit • The quality factor easily displays discrepancies • IntersecT is optimized for isopleth thermobarometry for Perple_X models

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Publication Details

Journal
Computers & Geosciences
Published
2025-05-02
DOI
https://doi.org/10.1016/j.cageo.2025.105949
Citations
3
Primary Topic
Geological and Geochemical Analysis
Type
article
Field-Weighted Citation Impact
5.60

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article

IntersecT: a Python script for quantitative isopleth thermobarometry of equilibrium and disequilibrium systems

Pierre Lanari, Hugo Domínguez, Jacob B. Forshaw, Chiara Groppo et al.
3 citations
Computers & Geosciences
Geological and Geochemical Analysis
5.60
article

IntersecT: a Python script for quantitative isopleth thermobarometry of equilibrium and disequilibrium systems

Pierre Lanari, Hugo Domínguez, Jacob B. Forshaw, Chiara Groppo, Franco Rolfo, Sara Nerone
article en
3 citations

Abstract

Isopleth thermobarometry involves comparing compositional isopleths generated from forward thermodynamic models with the measured mineral compositions in a specific assemblage to retrieve the pressure and temperature conditions of equilibration. This technique has been used extensively in the last two decades to constrain the conditions of metamorphism for natural rock samples. However, this method is often applied qualitatively, relying on the intersection of a limited number of isopleths for a few selected phases. Recent works have introduced software solutions with more quantitative approaches; these use statistical methods to derive optimal P–T conditions and provide a more accurate interpretation of forward modelling results. Despite these advances, these methods are not commonly used. IntersecT aims at distributing a tool for statistically quantifying the quality of fit using the WERAMI output of Perple_X and applying multiple approaches, including the quality factor concept from Bingo-Antidote. This formulation allows the propagation of measurement uncertainty in isopleth thermobarometry. In addition, IntersecT applies reduced χ 2 statistics to assess the weight of the considered phases, enabling the down-weighting of outlier data due to model inaccuracies or incorrect assumptions, such as disequilibrium features. The quality factor approach helps to visualize discrepancies resulting from these issues. IntersecT provides a quantitative framework to improve the interpretation of Perple_X isopleth thermobarometry results, allowing compositional uncertainties in the measured mineral composition to be considered. This approach can also help interpret how phase equilibrium experiments reproduce the observed compositions for magmatic and metamorphic systems. • IntersecT uses a statistical framework to apply isopleth thermobarometry • A quality factor approach is integrated with reduced chi-squared statistic • IntersecT helps recognize each element and phase contribution to the overall fit • The quality factor easily displays discrepancies • IntersecT is optimized for isopleth thermobarometry for Perple_X models

Computers & GeosciencesVol. 202
University of Bern (CH), Johannes Gutenberg University Mainz (DE), Institute of Geological Sciences (AM), University of Turin (IT), University of Lausanne (CH)
University of Bern, European Commission, Ministero dell’Istruzione, dell’Università e della Ricerca, Horizon 2020 Framework Programme, European Research Council
Openalex Percentile: Top 5%
Geological and Geochemical Analysis
5.60
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