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Title: Kinetics of Pyrolysis and Thermal Evolution of Negev Desert Lithologies

Journal Article · · ACS Earth and Space Chemistry
ORCiD logo [1];  [2]; ORCiD logo [3];  [4];  [5]; ORCiD logo [2];  [6]; ORCiD logo [6];  [7];  [5]; ORCiD logo [5]; ORCiD logo [5]; ORCiD logo [8]; ORCiD logo [2]; ORCiD logo [5]
  1. Los Alamos National Laboratory (LANL), Los Alamos, NM (United States); Washington State Univ., Pullman, WA (United States); Lawrence Livermore National Laboratory (LLNL), Livermore, CA (United States)
  2. Washington State Univ., Pullman, WA (United States)
  3. Los Alamos National Laboratory (LANL), Los Alamos, NM (United States); Washington State Univ., Pullman, WA (United States)
  4. Argonne National Laboratory (ANL), Argonne, IL (United States). Advanced Photon Source (APS)
  5. Los Alamos National Laboratory (LANL), Los Alamos, NM (United States)
  6. Geological Survey of Israel, Jerusalem (Israel)
  7. Nuclear Research Centre Negev, Beer Sheva (Israel); Ben Gurion Univ. of the Negev, Beer Sheva (Israel)
  8. Los Alamos National Laboratory (LANL), Los Alamos, NM (United States); Arizona State Univ., Tempe, AZ (United States)

The Negev desert in Israel is home to large quantities of organic-rich, shallow marine sedimentary lithologies that could potentially accommodate the disposal of spent nuclear fuel. Previous thermal analyses of Negev carbonates have focused on industrially relevant considerations such as natural gas and oil extraction or pyrolysis for recovering hydrocarbon fuels. Here, this study addresses thermal evolution of the Negev organic-rich carbonate, siliceous, and phosphorite rocks and associated chemical, mineralogical, and microstructural changes that may occur under prolonged thermal loading in the vicinity of spent nuclear fuel disposal systems. Our employed methods include high-temperature X-ray diffraction, high-temperature infrared spectroscopy, and thermal analysis integrating thermogravimetry, differential scanning calorimetry, and mass spectrometry. Further, we apply iterative iso-conversional model-free methods to derive kinetic parameters for thermal decomposition of the Negev organic-rich carbonate rocks from 200 to 550 °C. Our results have provided mechanistic insights into the thermal evolution encompassing water desorption, decomposition of organic matter, and decarbonation of carbonate phases.

Research Organization:
Los Alamos National Laboratory (LANL), Los Alamos, NM (United States)
Sponsoring Organization:
USDOE National Nuclear Security Administration (NNSA); USDOE Office of Science (SC), Basic Energy Sciences (BES). Scientific User Facilities (SUF)
Grant/Contract Number:
89233218CNA000001; AC52-07NA27344; AC02-06CH11357
OSTI ID:
2500877
Report Number(s):
LA-UR--24-27796
Journal Information:
ACS Earth and Space Chemistry, Journal Name: ACS Earth and Space Chemistry Journal Issue: 1 Vol. 9; ISSN 2472-3452
Publisher:
American Chemical Society (ACS)Copyright Statement
Country of Publication:
United States
Language:
English

References (80)

Compositional and kinetic study of thermal degradation of kerogen using TG‐FTIR, NMR, and microscopic study journal August 2021
Raman and infrared spectra of carbonates of calcite structure journal January 2006
A quick, direct method for the determination of activation energy from thermogravimetric data journal May 1966
Natural and Laboratory-Simulated Thermal Geochemical Processes book January 2003
Carbonate release from carbonated hydroxyapatite in the wide temperature rage journal July 2006
Application of a Fickian model of diffusion to the dehydration of graded specimens of a precious Australian sedimentary opal derived from Coober Pedy journal June 2009
TG–DSC analysis of pyrolysis process of two Chinese oil shales journal November 2013
Mineralogical characterization and non-isothermal pyrolysis kinetics of Moroccan Rif oil shale journal August 2017
Non-isothermal thermogravimetric analysis of pyrolysis kinetics of four oil shales using Sestak–Berggren method journal May 2018
Thermal decomposition of natural dolomite journal August 2007
Type I kerogen-rich oil shale from the Democratic Republic of the Congo: mineralogical description and pyrolysis kinetics journal November 2019
Thermal effects in “oil shales” — Naturally occurring kaolinite and metakaolinite organic associations journal April 1979
Kinetics of oil generation from Colorado oil shale journal June 1978
Analysis of a retort oil from an Israeli shale by gas chromatography-mass spectrometry-selected ion monitoring journal January 1985
The structure of quartz at 25 and 590°C determined by neutron diffraction journal March 1981
Thermochemical reactions in subcritical and supercritical interaction between Mishor Rotem oil shale and toluene journal September 1986
A computer program for kinetic analysis of non-isothermal thermoanalytical data journal February 1989
The thermal decomposition of dolomite journal August 1990
Formation of immature asphalt from organic-rich carbonate rocks—I. Geochemical correlation journal January 1985
Gasification of oil shales by solar energy journal December 1991
The chemistry of CaO and Ca(OH)2 relating to the Bayer process journal November 1996
The subsurface geology of Central and Northern Negev with possible implications on the regional ground water flow pattern journal February 1992
Sedimentary: Phosphates book January 2017
Oil Shale book January 2004
Kinetic study of the thermal decomposition of polypropylene, oil shale, and their mixture journal October 2000
The chemistry and mineralogy of the Negev oil shale ashes1 journal June 2002
Heat capacities and enthalpies for some Australian oil shales from non-isothermal modulated DSC journal August 2000
The ‘Temperature Integral’ — Its use and abuse journal October 1997
Pyrolysis and gasification kinetics of Jordanian oil-shales journal August 1999
FTIR techniques in clay mineral studies journal January 2003
Iterative linear integral isoconversional method: Theory and application journal January 2012
A comprehensive kinetics study on non-isothermal pyrolysis of kerogen from Green River oil shale journal December 2019
Multistep process kinetics of the non-isothermal pyrolysis of Moroccan Rif oil shale journal November 2016
Thermal oxidation study of Moroccan oil shale: A new approach to non-isothermal kinetics based on deconvolution procedure journal September 2016
The time-temperature-maturity relationship: A chemical kinetic model of kerogen evolution based on a developed molecule-maturity index journal October 2020
Stable sulfur isotope partitioning during simulated petroleum formation as determined by hydrous pyrolysis of Ghareb Limestone, Israel journal November 2005
Energetic and structural studies of amorphous Ca1−xMgxCO3·nH2O (0⩽x⩽1) journal August 2012
Examination of Kissinger's equation for solid-state transformation journal April 2009
Kinetic study of calcite particle (powder) thermal decomposition: Part I journal December 2008
Thermal decomposition of calcium carbonate (calcite polymorph) as examined by in-situ high-temperature X-ray powder diffraction journal November 2019
Rapid identification of dolomite using a Fourier Transform Infrared Spectrophotometer (FTIR): A fast method for identifying Heinrich events in IODP Site U1308 journal March 2009
Paleoenvironments of the latest Cretaceous oil shale sequence, Southern Tethys, Israel, as an integral part of the prevailing upwelling system journal May 2011
Paleoceanographic reconstruction of the late Cretaceous oil shale of the Negev, Israel: Integration of geochemical, and stable isotope records of the organic matter journal February 2012
Experimental investigation of thermal decomposition of Bazhenov formation kerogen: Mechanism and application for thermal enhanced oil recovery journal February 2017
ICTAC Kinetics Committee recommendations for performing kinetic computations on thermal analysis data journal June 2011
Opal, cristobalite, and tridymite: Noncrystallinity versus crystallinity, nomenclature of the silica minerals and bibliography journal March 1998
Evolution of Shale Microstructure under in Situ Heat Treatment: Synchrotron Small-Angle X-ray Scattering journal February 2021
Oil Shale Pyrolysis: Conversion Dependence of Kinetic Parameters journal June 2017
Pyrolysis of Kerogen of Bazhenov Shale: Kinetics and Influence of Inherent Pyrite journal June 2017
Probing the Influence of Thermally Induced Structural Changes on the Microstructural Evolution in Shale using Multiscale X-ray Scattering Measurements journal June 2018
Thermal Degradations and Processes of Four Kerogens via Thermogravimetric–Fourier-Transform Infrared: Pyrolysis Performances, Products, and Kinetics journal February 2020
Unveiling the Interfacial and Structural Heterogeneity of Ti3C2Tx MXene Etched with CoF2/HCl by Integrated in Situ Thermal Analysis journal August 2021
Thermal Evolutions and Resulting Microstructural Changes in Kerogen-Rich Marcellus Shale journal November 2020
Kinetics of the CaO/Ca(OH) 2 Hydration/Dehydration Reaction for Thermochemical Energy Storage Applications journal July 2014
Kinetic Parameters from Thermogravimetric Data journal January 1964
1,3-Diamino-2-hydroxypropane-N,N,N′,N′-tetraacetic acid stabilized amorphous calcium carbonate: nucleation, transformation and crystal growth journal January 2010
Characteristics and Kinetics of Huadian Oil Shale Pyrolysis via Non-isothermal Thermogravimetric and Gray Relational Analysis journal February 2019
Oil Shale as an Energy Source in Israel journal January 1996
DIOPTAS : a program for reduction of two-dimensional X-ray diffraction data and data exploration journal May 2015
Crystallography Open Database (COD): an open-access collection of crystal structures and platform for world-wide collaboration journal November 2011
Crystallography Open Database – an open-access collection of crystal structures journal May 2009
Profex : a graphical user interface for the Rietveld refinement program BGMN journal August 2015
COD::CIF::Parser : an error-correcting CIF parser for the Perl language journal February 2016
Validation of the Crystallography Open Database using the Crystallographic Information Framework journal February 2021
Thermal decomposition of natural dolomite journal November 2011
Using SMILES strings for the description of chemical connectivity in the Crystallography Open Database journal May 2018
Practices for modeling oil shale pyrolysis and kinetics journal March 2017
Thermal desulfurization of pyrite: An in situ high-T neutron diffraction and DTA–TGA study journal June 2019
Late Quaternary deposition and erosion processes along the margins of the Yamin Plain, northeast Negev, Israel journal December 2008
Recharge processes of the Neogene aquifer at Yamin-Rotem Plateau, northeast Negev, Israel journal January 2005
Salt as a Host Rock for the Geological Repository for Nuclear Waste journal July 2016
Thermal decomposition of calcite: Mechanisms of formation and textural evolution of CaO nanocrystals journal April 2009
Shale disposal of U.S. high-level radioactive waste report May 2010
Sulfur sinks and organic carbon relationships in Cretaceous organic-rich carbonates; implications for evaluation of oxygen-poor depositional environments journal October 1990
Study of the Kinetics and Mechanisms of Thermal Decomposition of Moroccan Tarfaya oil Shale and its Kerogen journal January 2008
Decomposition Kinetics of American, Chinese and Estonian oil Shales Kerogen journal January 2016
Uranium Retardation Capacity of Lithologies from the Negev Desert, Israel—Rock Characterization and Sorption Experiments journal June 2022
Assessment of effective infiltration in the deep arid vadose zone of the Negev, Israel journal May 2020
Uncertainty Underground: Yucca Mountain and the Nation's High-Level Nuclear Waste book April 2006
A Study on Thermal Load Management in a Deep Geological Repository for Efficient Disposal of High Level Radioactive Waste journal December 2022