Development of an improved chemical model for the estimation of CaSO 4 solubilities in the HCl-CaCl2-H2O system up to 100°C

Industrial and Engineering Chemistry Research

Volumn 45, Issue 9, 2006, Pages 2914-2922

  Li, Zhibao ^a   Demopoulos, George P ^a  

^a MCGILL UNIVERSITY   (Canada)

Author keywords

[No Author keywords available]

Indexed keywords

COMPUTER SOFTWARE; HYDROCHLORIC ACID; MATHEMATICAL MODELS; REGRESSION ANALYSIS; SOLUBILITY; THERMAL EFFECTS;

ANHYDRITES; BROMLEY-ZEMAITIS MODEL; HEMIHYDRATE MODIFICATIONS; SOLUBILITY CURVES;

CALCIUM COMPOUNDS;

CALCIUM COMPOUNDS; COMPUTER SOFTWARE; HYDROCHLORIC ACID; MATHEMATICAL MODELS; REGRESSION ANALYSIS; SOLUBILITY; THERMAL EFFECTS;

EID: 33646573999     PISSN: 08885885     EISSN: None     Source Type: Journal    
DOI: 10.1021/ie0508280     Document Type: Article

References (41)

1. Sohnel, O.; Garside, J. Precipitation: Basic Principles and Industrial Application; Butterworth-Heinemann: Oxford, U.K., 1995.
2. Raju, K. U. G.; Atkinson, G. The Thermodynamics of "Scale" Mineral Solubilities. 3. Calcium Sulfate in Aqueous NaCl. J. Chem, Eng. Data 1990, 35, 361.
3. Mohan, R.; Myerson, A. S. Growth Kinetics: A Thermodynamics Approach. Chem. Eng. Sci. 2002, 57, 4277.
4. 4. In Proceedings of Fifth International Symposium on Waste Processing and Recycling in Mineral and Metallurgical Industries; Rao, S. R., et al., Eds.; CIM: Montreal, Canada, 2004; pp 453-467.
5. 4. In EPD Congress 2004; Schlesinger, M. E., Ed.; TMS: Warrendale, PA, 2004; pp 627-639.
6. 2O Solutions from 40°C to 200°C, 0 to 4 Molal NaCl. J. Chem. Eng. Data 1964, 9, 187.
7. Marshall, W. L.; Slusher, R. Thermodynamics of Calcium Sulfate Dihydrate in Aqueous Sodium Chloride Solutions, 0-110°C. J. Phys. Chem. 1966, 70, 4015.
8. Marshall, W. L.; Slusher, R. Aqueous Systems at High Temperature. Solubility to 200°C of Calcium Sulfate and Its Hydrates in Seawater and Saline Water Concentrates, and Temperature-Concentration Limits. J. Chem. Eng. Data 1968, 13, 83.
9. 4 Solubility in Multicomponent Aqueous Solutions. Chem. Eng. J. 1982, 24, 191.
10. 2O. J. Chem. Eng. Data 1984, 29, 42.
11. Pitzer, K. S. Activity Coefficients in Electrolyte Solution; CRC Press: Boca Raton, FL, 1991.
12. 2O System from Zero to High Concentration at 25°C. Geochim. Cosmochim. Acta 1980, 44, 981.
13. Meijer, J. A. M.; Rosmalen, G. M. Solubilities and Supersaturations of Calcium Sulfate and Its Hydrates in Seawater. Desalination 1984, 51, 255.
14. Zemaitis, J. F.; Clark, D. M.; Rafal, M.; Scrivner, N. C. Handbook of Aqueous Electrolyte Thermodynamics: Theory & Application; American Institute of Chemical Engineers (AIChE): New York, 1986.
15. Demopoulos, G. P.; Kondos, P.; Papangelakis, V. G. Prediction of Solubility in Chemical Compound Precipitation Systems. In Crystallization and Precipitation: Proceedings of the International Symposium, Saskatoon, Saskatchewan, Canada, October 5-7, 1987; Strathdee, G. L., Klein, M. O., Melis, L. A., Eds.; Pergamon: Oxford, U.K., 1987; p 231.
16. Scrivner, N. C.; Staples, B. R. Equilibria in Aqueous Solutions: Industrial Application. Chemical Engineering Thermodynamics; Newman, S. A., Ed.; Ann Arbor Science: Ann Arbor, MI, 1983; p 349.
17. Anderko, A.; Wang, P.; Rafal, M. Electrolyte Solutions: From Thermodynamic and Transport Property Models to the Simulation of Industrial Processes. Fluid Phase Equilib. 2002, 194-197, 123.
18. Chen, C. C.; Mathias, P. M. Applied Thermodynamics for Process Modeling. AIChE J. 2002, 48, 194.
19. Prausnitz, J. M.; Tavares, F. W. Thermodynamics of Fluid-Phase Equilibria for Standard Chemical Engineering Operations. AIChE J. 2004, 50, 739.
20. Bromley, L. A. J. Thermodynamic Properties of Strong Electrolytes in Aqueous Solutions. AIChE J. 1973, 19, 313.
21. Rafal, M.; Berthold, J. W.; Scrivner, N. C.; Grise, S. L. Models for Electrolyte Solutions. In Models for Thermodynamic and Phase Equilibria Calculations; Sandier, S. I., Ed.; Marcel Dekker: New York, 1994.
22. Zemaitis, J. F. Predicting Vapor-Liquid-Equilibria in Multicomponent Aqueous Solutions of Electrolytes. In Thermodynamics of Aqueous Systems with Industrial Applications; Newman, S. A., Barner, H. E., Klein, M., Eds.; ACS Symposium Series 133; American Chemical Society: Washington, DC, 1980; p 227.
23. 4 Solubilities in Concentrated Aqueous Chloride Solutions. In Chloride Metallurgy 2002: International Conference on the Practice and Theory of Chloride/Metal Interaction, 32nd Annual Hydrometallurgy Meeting, October 19-23, 2002; Peek, E., Van Weert, G., Eds; Canadian Institute of Mining (CIM): Montreal, 2002; p 561.
24. 2 Solutions from 283 to 353 K. J. Chem. Eng. Data 2005, 50, 1971.
25. Aqueous System Modeling Course and Workshop, OLI manual; OLI Systems, Inc.: Morris Plains, NJ, 2002.
26. Shock, E. L.; Helgeson, H. C. Calculation of the Thermodynamic and Transport Properties of Aqueous Species at High Pressures and Temperatures: Correlation Algorithms for Ionic Species and Equation of State Predictions to 5 kb and 1000°C. Geochim. Cosmochim. Acta 1988, 52, 2009.
27. Gurvich, L. V., Veyts, I. V., Alcock, C. B., Eds. Thermodynamic Properties of Individual Substances; 4th Edition; Hemisphere Publishing Corporation: New York, 1989; Vol. 1 (Parts 1 and 2).
28. Glushko, V. P.; Medvedev, V. A. et al. Thermal Constants of Compounds; Academy of Sciences: USSR, 1979; Vol. 9 (Part 1).
29. Anderson, G. M.; Crerar, D. A. Thermodynamics in Geochemistry the Equilibrium Model; Oxford University Press: New York, 1993.
30. Helgeson, H. C.; Kirkham, D. H.; Flowers, G. C. Theoretical Prediction of the Thermodynamic Behavior of Aqueous Electrolytes at High Pressures and Temperatures: IV. Calculation of Activity Coefficients, Osmotic Coefficients, and Apparent Molal and Standard and Relative Partial Molal Properties to 600°C and 5 kb. Am. J. Sci. 1981, 281, 1249.
31. Tanger, J. C., IV; Helgeson, H. C. Calculation of the Thermodynamic and Transport Properties of Aqueous Species at High Pressures and Temperatures: Revised Equations of State for the Standard Partial Molal Properties of Ions and Electrolytes. Am. J. Sci. 1988, 288, 19.
32. Shock, E. L.; Helgeson, H. C.; Sverjensky, D. A. Calculation of the Thermodynamic and Transport Properties of Aqueous Species at High Pressures and Temperatures: Standard Partial Molal Properties of Inorganic Neutral Species. Geochim. Cosmochim. Acta 1989, 53, 2157.
33. Shock, E. L.; Sassani, D. C.; Willis, M.; Sverjensky, D. A. Inorganic Species in Geologic Fluids: Correlations among Standard Molal Thermodynamic Properties of Aqueous Ions and Hydroxide Complexes. Geochim. Cosmochim. Acta 1997, 61, 907.
34. Meissner, H. P.; Kusik, C. L. Aqueous Solutions of Two or More Strong Electrolytes: Vapor Pressure and Solubilities. Ind. Eng. Chem. Process Des. Dev. 1973, 12, 205.
35. Dickson, A. G.; Wesolowski, D. J.; Palmer, D. A.; Mesmer, R. E. Dissociation Constant of Bisulfate Ion in Aqueous Sodium Chloride Solutions to 250°C. J. Phys. Chem. 1990, 94, 7978.
36. - from 10 to 50°C and Calculation of the Second Dissociation Constant to 350°C. J. Chem. Soc., Faraday Trans. 1990, 86 (16), 2831.
37. 2O in Water between 0 and 100°C. J. Appl. Chem. (USSR) 1967, 12, 1101.
38. Yasue, T.; Kojima, Y.; Kishimoto, Y.; Arai, Y. Preparation of α-Gypsum Hemihydrate and Control of Its Crystal Shape under Atmospheric Pressure. Gypsum Lime (Jpn.) 1992, 239, 230.
39. Kruchenko, V. P.; Beremzhanov, B. A. The Solubility of Salts in the Calcium Sulfate-Hydrochloric Acid-Water System at 25°C. RUSS. J. Inorg. Chem. 1976, 21 (1), 281.
40. 2O System. In EPD Congress 2004; Schlesinger, M. E., Ed.; TMS: Warrendale, PA, 2004; p 477.
41. Langmuir, D.; Melchior, D. The Geochemistry of Calcium, Strontium, Barium and Radium Sulfates and in Some Deep Brines from the Palo Duro Basin, Texas. Geochim. Cosmochim. Acta 1985, 49, 2423.