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The time-temperature-maturity relationship: A chemical kinetic model of kerogen evolution based on a developed molecule-maturity index

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Abstract Kerogen maturity is an important indicator for evaluating source rocks. We propose a kerogen maturity index (molecule-maturity index, MMI) based on the changes in the molecular structure of organic… Click to show full abstract

Abstract Kerogen maturity is an important indicator for evaluating source rocks. We propose a kerogen maturity index (molecule-maturity index, MMI) based on the changes in the molecular structure of organic matter during thermal evolution. The MMI has a positive correlation with vitrinite reflectance. Molecular dynamics simulations indicate that the weight loss is with a positive linear correlation with the MMI, demonstrating the ability of the index to reflect the hydrocarbon generation of organic matter. In addition, a new conversion is introduced by the MMI to analyze the kinetics of kerogen thermal evolution. The activation energy is expressed as a continuous function of the MMI linking by the new conversion. The activation energy was calculated at the isoconversional points of previous conversion, which was not defined as a continuous function before. A linear relationship between the activation energy of kerogen is observed, and a new chemical kinetic model of kerogen thermal maturity is established based on the MMI (kinetic model of the maturity evolution, MEKM). The MEKM equation has a simple form and is convenient for engineering applications. Our findings provide insights into the kinetics of kerogen thermal maturation and guide the choice of temperature and time for artificial maturity.

Keywords: maturity index; evolution; maturity; kinetic model; kerogen

Journal Title: Fuel
Year Published: 2020

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