Detailed kinetic analysis of oil shale pyrolysis TGA data

There are significant resources of oil shale in the western United States, which if exploited in an environmentally responsible manner would provide secure access to transportation fuels. Understanding the kinetics of kerogen decomposition to oil is critical to designing a viable process. A dataset of thermogravimetric analysis (TGA) of the Green River oil shale is provided and two distinct data analysis approaches—advanced isoconversional method and parameter fitting are used to analyze the data. Activation energy distributions with conversion calculated using the isoconversional method (along with uncertainties) ranged between 93 and 245 kJ/mol. Root mean square errors between the model and experimental data were the lowest for the isoconversional method, but the distributed reactivity models also produced reasonable results. When using parameter fitting approaches, a number of models produce similar results making model choice difficult. Advanced isoconversional method is better in this regard, but maybe applicable to a limited number of reaction pathways. © 2011 American Institute of Chemical Engineers AIChE J, 2012

[1]  Don R. Leavitt,et al.  Kerogen decomposition kinetics of selected Green River and Eastern U.S. oil shales from thermal solution experiments , 1987 .

[2]  J. Smith Oil shale resources of the United States , 1980 .

[3]  Alan K. Burnham,et al.  High-pressure pyrolysis of Green River oil shale , 1983 .

[4]  Paul T. Williams,et al.  Influence of process conditions on the pyrolysis of Pakistani oil shales , 1999 .

[5]  S. D. Probert,et al.  Non-isothermal thermogravimetry and decomposition kinetics of two Jordanian oil shales under different processing conditions , 2000 .

[6]  T. Guo,et al.  Pyrolysis Kinetics of Several Key World Oil Shales , 1983 .

[7]  Alan K. Burnham,et al.  A comparison of isoconversional and model-fitting approaches to kinetic parameter estimation and application predictions , 2006 .

[8]  K. Rajeshwar The kinetics of the thermal decomposition of green river oil shale kerogen by non-isothermal thermogravimetry , 1981 .

[9]  F. H. Constable The mechanism of catalytic decomposition , 1925 .

[10]  Michael D. Vanden Berg BASIN-WIDE EVALUATION OF THE UPPERMOST GREEN RIVER FORMATION'S OIL-SHALE RESOURCE, UINTA BASIN, UTAH AND COLORADO , 2008 .

[11]  Bernard P. Boudreau,et al.  On a reactive continuum representation of organic matter diagenesis , 1991 .

[12]  S. Vyazovkin,et al.  Detecting isokinetic relationships in non-isothermal systems by the isoconversional method☆ , 1995 .

[13]  A. Burnham RELATIONSHIP BETWEEN HYDROUS AND ORDINARY PYROLYSIS , 1995 .

[14]  Sergey Vyazovkin,et al.  Thermal analysis. , 2006, Analytical chemistry.

[15]  P. Landais,et al.  Effects of effluents and water pressure on oil generation during confined pyrolysis and high-pressure hydrous pyrolysis , 1995 .

[16]  Alan K. Burnham,et al.  Analysis of chemical reaction kinetics using a distribution of activation energies and simpler models , 1987 .

[17]  M. Matouq,et al.  Oil shale pyrolysis kinetics and variable activation energy principle , 2010 .

[18]  R. A. Noble,et al.  An appropriate kinetic model for well-preserved algal kerogens , 1996 .

[19]  C. Largeau,et al.  Kerogen origin, evolution and structure , 2007 .

[20]  A. Burnham,et al.  Pyrolysis kinetics for Western and Eastern oil shale , 1982 .

[21]  C. Pan,et al.  Kerogen Pyrolysis in the Presence and Absence of Water and Minerals. 1. Gas Components , 2008 .

[22]  Robert L. Braun,et al.  Global Kinetic Analysis of Complex Materials , 1999 .

[23]  T. Robl,et al.  Chemical and Petrographic Classification of Kerogen/Macerals , 1994 .

[24]  H. Sohn,et al.  NONISOTHERMAL DETERMINATION OF THE INTRINSIC KINETICS OF OIL GENERATION FROM OIL SHALE. , 1980 .

[25]  Sergey Vyazovkin,et al.  Practical application of isoconversional methods , 1992 .

[26]  B. Batts,et al.  A literature review of fuel stability studies with a particular emphasis on shale oil , 1992 .

[27]  R. L. Braun,et al.  Oil-shale pyrolysis: Kinetics and mechanism of oil production , 1975 .

[28]  V. D. Allred Kinetics of oil shale pyrolysis , 1966 .

[29]  S. Vyazovkin,et al.  Estimation of the pre-exponential factor in the isoconversional calculation of effective kinetic parameters , 1988 .

[30]  D. Thakur,et al.  Kinetics of pyrolysis of Moroccan oil shale by thermogravimetry , 1987 .

[31]  Wight,et al.  Estimating realistic confidence intervals for the activation energy determined from thermoanalytical measurements , 2000, Analytical chemistry.

[32]  Confidence intervals for the activation energy estimated by few experiments , 1997 .

[33]  Alan K. Burnham,et al.  Comparison of methods for measuring kerogen pyrolysis rates and fitting kinetic parameters , 1987 .

[34]  P. Sundararaman,et al.  Determination of kerogen activation energy distribution , 1992 .

[35]  J. R. Dyni,et al.  GEOLOGY AND RESOURCES OF SOME WORLD OIL-SHALE DEPOSITS , 2003, Oil Shale.

[36]  M. Lewan,et al.  Comparison of petroleum generation kinetics by isothermal hydrous and nonisothermal open-system pyrolysis , 2002 .

[37]  Alan K. Burnham,et al.  General kinetic model of oil shale pyrolysis , 1984 .

[38]  F. Behar,et al.  Chemical modelling of kerogens , 1987 .

[39]  Alan K. Burnham,et al.  Computational aspects of kinetic analysis: Part A: The ICTAC kinetics project-data, methods and results , 2000 .

[40]  S. Vyazovkin,et al.  Kinetics in solids. , 1997, Annual review of physical chemistry.

[41]  Tom LaTourrette,et al.  Oil Shale Development in the United States , 2005 .

[42]  J. Charlesworth Oil shale pyrolysis. 2. Kinetics and mechanism of hydrocarbon evolution , 1985 .

[43]  Alan K. Burnham,et al.  Computational aspects of kinetic analysis.: Part D: The ICTAC kinetics project — multi-thermal–history model-fitting methods and their relation to isoconversional methods , 2000 .

[44]  Sergey Vyazovkin,et al.  Isothermal and non-isothermal kinetics of thermally stimulated reactions of solids , 1998 .

[45]  A. Burnham Oil evolution from a self-purging reactor: kinetics and composition at 2.degree.C/min and 2.degree.C/h , 1991 .

[46]  J. G. Stainforth Practical kinetic modeling of petroleum generation and expulsion , 2009 .

[47]  H. L. Friedman,et al.  Kinetics of thermal degradation of char-forming plastics from thermogravimetry. Application to a phenolic plastic , 2007 .

[48]  Chittur Chandrasekharan Lakshmanan,et al.  A New Distributed Activation Energy Model Using Weibull Distribution for the Representation of Complex Kinetics , 1994 .

[49]  Shuyuan Li,et al.  Study of pyrolysis kinetics of oil shale , 2003 .

[50]  M. Maciejewski,et al.  Computational aspects of kinetic analysis. Part B: The ICTAC kinetics project : the decomposition kinetics of calcium carbonate revisited, or some tips on survival in the kinetic minefield , 2000 .

[51]  John H. Campbell,et al.  Kinetics of oil generation from Colorado oil shale , 1978 .

[52]  Hyun-Soo Yang,et al.  Effect of reduced pressure on oil shale retorting. 1. Kinetics of oil generation , 1985 .

[53]  Miguel A. Galán,et al.  Kinetics of the thermal decomposition of oil shale from Puertollano (Spain) , 2001 .

[54]  A. Galwey What is meant by the term ‘variable activation energy’ when applied in the kinetic analyses of solid state decompositions (crystolysis reactions)? , 2003 .

[55]  Marco J. Starink,et al.  The determination of activation energy from linear heating rate experiments: a comparison of the accuracy of isoconversion methods , 2003 .

[56]  S. Vyazovkin Computational aspects of kinetic analysis. Part C. The ICTAC Kinetics Project — the light at the end of the tunnel? , 2000 .

[57]  S. Vyazovkin Reply to “What is meant by the term ‘variable activation energy’ when applied in the kinetics analyses of solid state decompositions (crystolysis reactions)?” , 2003 .

[58]  C. D. Doyle Estimating isothermal life from thermogravimetric data , 1962 .

[59]  A. Burnham,et al.  On the mechanism of kerogen pyrolysis , 1984 .

[60]  R. T. Yang,et al.  Rational approximations of the integral of the Arrhenius function , 1977 .

[61]  Shuyuan Li,et al.  Study of different kinetic models for oil shale pyrolysis , 2004 .

[62]  A. Burnham Chemistry and Kinetics of Oil Shale Retorting , 2010 .