JESS, a Joint Expert Speciation System - IV: A large database of aqueous solution physicochemical properties with an automatic means of achieving thermodynamic consistency

Talanta

Volumn 81, Issue 1-2, 2010, Pages 142-148

  May, Peter M ^a   Rowland, Darren ^a   Königsberger, Erich ^a   Hefter, Glenn ^a  

^a MURDOCH UNIVERSITY   (Australia)

Author keywords

Aquatic chemistry; Chemical species; Densities; Heat capacities; Physicochemical properties; Water activity

Indexed keywords

COMPUTATIONAL CHEMISTRY; DENSITY (SPECIFIC GRAVITY); ELECTROLYTES; SOLUTIONS; SPECIFIC HEAT;

AQUEOUS ENVIRONMENT; CHEMICAL SPECIES; COMPREHENSIVE PREDICTION; ELECTROLYTE MIXING; PHYSICOCHEMICAL PROPERTY; STRONG ELECTROLYTE; THERMODYNAMIC CONSISTENCY; WATER ACTIVITY;

CHEMICAL SPECIATION;

EID: 77049116247     PISSN: 00399140     EISSN: None     Source Type: Journal    
DOI: 10.1016/j.talanta.2009.11.049     Document Type: Article

References (58)

1. May P.M., and Murray K. Talanta 40 (1993) 819
2. May P.M. Mar. Chem. 99 (2006) 62
3. Rowland D., and May P.M. Talanta 80 (2009)
4. A. Olin, B. Nolang, L.-O. Ohman, E.G. Osadchii, E. Rosen, OECD Chemical Thermodynamics Series, Vol. 7: Chemical Thermodynamics of Selenium, 2005.
5. Brown P.L., Curti E., Grambow B., and Ekberg C. OECD Chemical Thermodynamics Series, Vol. 8: Chemical Thermodynamics of Zirconium (2005), Elsevier Science
6. Hummel W., Anderegg G., Puigdomenech I., Rao L., and Tochiyama O. OECD Chemical Thermodynamics Series, Vol. 9: Chemical Thermodynamics of Compounds and Complexes of U, Np, Pu, Am, Tc, Se, Ni and Zr with Selected Organic Ligands (2005), Elsevier Science
7. Portanova R., Lajunen L.H.J., Tolazzi M., and Piispanen J. Pure Appl. Chem. 75 (2003) 495
8. Anderegg G., Arnaud-Neu F., Delgado R., Felcman J., and Popov K. Pure Appl. Chem. 77 (2005) 1445
9. Powell K.J., Brown P.L., Byrne R.H., Gajda T., Hefter G., Sjoberg S., and Wanner H. Pure Appl. Chem. 77 (2005) 739
10. Powell K.J., Brown P.L., Byrne R.H., Gajda T., Hefter G., Sjoberg S., and Wanner H. Pure Appl. Chem. 79 (2007) 895
11. Barin I., and Platzki G. Thermochemical Data of Pure Substances. 3rd edn (1995), Weinheim, Germany
12. Krumgalz B.S., Pogorelsky R., and Pitzer K.S. J. Phys. Chem. Ref. Data 25 (1996) 663
13. Krumgalz B.S., Pogorelsky R., Sokolov A., and Pitzer K.S. J. Phys. Chem. Ref. Data 29 (2000) 1123
14. May P.M., and Murray K. J. Chem. Eng. Data 46 (2001) 1035
15. May P.M., and Murray K. Talanta 38 (1991) 1409
16. May P.M., and Murray K. Talanta 38 (1991) 1419
17. May P.M., Linder P.W., and Williams D.R. J. Chem. Soc., Dalton Trans. (1977) 588
18. Gianguzza A., Milea D., Millero F.J., and Sammartano S. Mar. Chem. 85 (2004) 103
19. Königsberger E., Eriksson G., May P.M., and Hefter G. Ind. Eng. Chem. Res. 44 (2005) 5805
20. Königsberger E., May P.M., and Harris B. Hydrometallurgy 90 (2008) 177
21. Fortier J.-L., Leduc P.-A., and Desnoyers J.E. J. Sol. Chem. 3 (1974) 323
22. Biedermann G., Bruno J., Ferri D., Grenthe I., Salvatore F., and Spahiu K. Mater. Res. Soc. Symp. Proc. 11 (1982) 791
23. Grenthe I., Plyasunov A.V., and Spahiu K. Estimation of medium effects on thermodynamic data. In: Grenthe I., and Puigdomenech I. (Eds). Modelling in Aquatic Chemistry (1997), Nuclear Energy Agency, OECD, Paris, France 325-426
24. Pitzer K.S. Ion interaction approach: theory and data correlation. In: Pitzer K.S. (Ed). Activity Coefficients in Electrolyte Solutions. 2nd edn (1991), CRC Press, Boca Raton, FL, USA 75-153
25. Partanen J.I., and Covington A.K. J. Sol. Chem. 31 (2002) 187
26. Partanen J.I., and Covington A.K. J. Chem. Eng. Data 51 (2006) 777
27. Partanen J.I., and Covington A.K. J. Chem. Eng. Data 54 (2009) 208
28. Press W.H., Teukolsky S.A., Vetterling W.T., and Flannery B.P. Numerical Recipes in FORTRAN: The Art of Scientific Computing. 2nd edn (1992), Cambridge Univ. Press, Cambridge, UK
29. Marshall S.L., May P.M., and Hefter G.T. J. Chem. Eng. Data 40 (1995) 1041
30. Pitzer K.S., Peiper J.C., and Busey R.H. J. Phys. Chem. Ref. Data 13 (1984) 1
31. Königsberger E. Monatsh. Chem. 132 (2001) 1363
32. Gibbard Jr. H.F., and Scatchard G. J. Chem. Eng. Data 18 (1973) 293
33. Hubert N., Gabes Y., Bourdet J.-B., and Schuffenecker L. J. Chem. Eng. Data 40 (1995) 891
34. Harned H.S., and Owen B.B. The Physical Chemistry of Electrolytic Solutions, American Chemical Society Monograph Series No. 137. 3rd edn (1958), Reinhold Publishing Corp., New York
35. Robinson R.A., and Stokes R.H. Electrolyte Solutions. 2nd edn (1970), Butterworth and Co., London (Revised)
36. Millero F.J. Effects of Pressure and Temperature on Activity Coefficients, Activity Coefficients in Electrolyte Solutions vol. II (1979) pp. 63-151
37. Zemaitis Jr. J.F., Clark D.M., Rafal M., and Scrivner N.C. Handbook of Aqueous Electrolyte Thermodynamics, Theory and Application (1986), Am. Inst. Chem. Eng., New York, USA
38. Archer D.G. J. Phys. Chem. Ref. Data 21 (1992) 793
39. Hamer W.J., and Wu Y.C. J. Phys. Chem. Ref. Data 1 (1972) 1047
40. Bradley D.J., and Pitzer K.S. J. Phys. Chem. 83 (1979) 1599
41. Archer D.G. J. Phys. Chem. Ref. Data 28 (1999) 1
42. Partanen J.I. Acta Chem. Scand. 45 (1991) 993
43. Davis T.M., Duckett L.M., Owen J.F., Patterson C.S., and Saleeby R. J. Chem. Eng. Data 30 (1985) 432
44. Moore J.T., Humphries W.T., and Patterson C.S. J. Chem. Eng. Data 17 (1972) 180
45. Humphries W.T., Kohrt C.F., and Patterson C.S. J. Chem. Eng. Data 13 (1968) 327
46. Hellams K.L., Patterson C.S., Prentice III B.H., and Taylor M.J. J. Chem. Eng. Data 10 (1965) 323
47. Tanner J.E., and Lamb F.W. J. Sol. Chem. 7 (1978) 303
48. Pabalan R.T., and Pitzer K.S. J. Chem. Eng. Data 33 (1988) 354
49. Ruterjans H., Schreiner F., Sage U., and Ackermann Th. J. Phys. Chem. 73 (1969) 986
50. V.B. Parker, Thermal Properties of Aqueous Uni-univalent Electrolytes, U.S. Department of Commerce, National Bureau of Standards Rep. NSRDS-NBS-2, 1965.
51. Duckett L.M., Hollifield J.M., and Patterson C.S. J. Chem. Eng. Data 31 (1986) 213
52. Davis T.M., Duckett L.M., Garvey C.E., Hollifield J.M., and Patterson C.S. J. Chem. Eng. Data 31 (1986) 54
53. Rard J.A., and Spedding F.H. J. Chem. Eng. Data 22 (1977) 56
54. Rard J.A., Habenschuss A., and Spedding F.H. J. Chem. Eng. Data 22 (1977) 180
55. Staples B.R., and Nuttall R.L. J. Phys. Chem. Ref. Data 6 (1977) 385
56. Gruszkiewicz M.S., and Simonson J.M. J. Chem. Thermodyn. 37 (2005) 906
57. Rard J.A., and Clegg S.L. J. Chem. Eng. Data 42 (1997) 819
58. Manya J.J., and Antal Jr. M.J. J. Chem. Eng. Data 54 (2009) 2158