Application of the Rietveld method to the analysis of anhydrous cement

Cement and Concrete Research

Volumn 41, Issue 2, 2011, Pages 133-148

  Le Saoût, Gwenn ^a,b   Kocaba, Vanessa ^a   Scrivener, Karen ^a  

^a EPFL   (Switzerland)

^b SWISS FEDERAL LABORATORIES FOR MATERIALS SCIENCE AND TECHNOLOGY   (Switzerland)

Author keywords

Cement (D); X Ray Diffraction (B)

Indexed keywords

RIETVELD METHOD; SCANNING ELECTRON MICROSCOPY; X RAY DIFFRACTION; X RAY POWDER DIFFRACTION;

BOGUE CALCULATION; CEMENTS (D); DIRECT MEASUREMENT; PHASE CONTENT; REPRODUCIBILITIES; X-RAY POWDER;

CEMENTS;

EID: 78650750347     PISSN: 00088846     EISSN: None     Source Type: Journal    
DOI: 10.1016/j.cemconres.2010.10.003     Document Type: Review

References (100)

1. R.H. Bogue Calculation of the compounds in Portland cement Ind. Eng. Chem. 1 1929 192 197
2. H.F.W. Taylor Modification of the Bogue calculation Adv. Cem. Res. 2 1989 73 77
3. D. Sorrentino, F. Sorrentino, and E. Gartner Prediction of a Portland cement's properties from its chemical and mineralogical composition F. Young, J. Skalny, Materials Science of Concrete VII 2005 The American Ceramic Society 1 35
4. H.M. Rietveld A profile refinement method for nuclear and magnetic structures J. Appl. Cryst. 2 1969 65 71
5. P. Stutzman, and S. Leigh Phase analysis of hydraulic cements by X-ray powder diffraction: precision, bias, and qualification J. ASTM Int. 4 2007 1 11
6. L. León-Reina, A.G. de la Torre, J.M. Porras-Vásquez, M. Cruz, L.M. Ordonez, X. Alcobé, F. Gispert-Guirado, A. Larrañaga-Varga, M. Paul, T. Fuellmann, R. Schmidt, and M.A.G. Aranda Round robin on Rietveld quantitative phase analysis of Portland cements J. Appl. Cryst. 42 2009 1 11
7. T. Füllmann, H. Pöllmann, G. Walenta, M. Gimenez, C. Lauzon, S. Hagopian-Babikian, T. Dalrymple, and P. Noon Analytical methods Int. Cem. Rev. 2001 January 41 43
8. G. Walenta, T. Füllmann, and M. Gimenez Quantitative Rietveld analysis of cement and clinker Int. Cem. Rev. 2001 June 51 54
9. T. Westphal, G. Walenta, T. Füllmann, M. Gimenez, E. Bermejo, K. Scrivener, and H. Pöllmann Characterisation of cementitious materials - Part III Int. Cem. Rev. 2002 July 47 51
10. th International Congress on the Chemistry of cement 1997 1i039
11. th International Congress on the Chemistry of Cement 2003 135 145
12. th International Congress on the Chemistry of Cement 2003 115 124
13. th International Congress on the Chemistry of cement 1997 3v007
14. M. Enders, and M. Berger Quantitative XRD (Rietveld-method) in cement plants: quality control of clinker production ZKG Int. 5 2007 50 59
15. A. Godek, D. Crutchfield, F. Blackmam, P. Storer, C. Manias, and I. Madsen Proactive not reactive World Cement 2002 51 55
16. K.W. Meyer, J. Neubauer, and S. Malovrh New quality control with standardless clinker phase determination using the Rietveld refinement ZKG Int. 3 1998 152 162
17. th International Conference on Cement Microscopy 1997 295 305
18. th International Conference on Cement Microscopy 1998 103 119
19. R. Schmidt, and T. Feldmann Breakthrough in phase analysis World Cement 2003 77 80
20. T. Füllmann, and G. Walenta Die quantitative Rietveld - Phaseanalyse in industrieller Anwendung ZKG Int. 56 2003 1 9
21. I.C. Madsen, and N.V.Y. Scarlett Cement: quantitative phase analysis of Portland cement clinker F.H. Chung, D.K. Smith, Industrial Applications of X-Ray Diffraction 2000 Marcel Dekker 415 440
22. Q.I. Roode-Gutzmer, and Y. Ballim Phase composition and quantitative X-ray powder diffraction analysis of Portland cement and clinker J. Skalny, Materials Science of Concrete VI 2001 The American Ceramic Society 1 48
23. J.C. Taylor, L.P. Aldridge, C.E. Matulis, and I. Hinczak X-ray powder diffraction analysis of cements J. Bensted, P. Barnes, Structure and Performance of Cements 2001 Taylor and Francis 420 441
24. V.A. Hackley, L.-S. Lum, V. Gintaudas, and C.F. Ferraris Particle size analysis by laser diffraction spectrometry: application to cementitious powders NIST IR 7097 2004 1 66
25. J.I. Goldstein, D. Newbury, D. Joy, C. Lyman, P. Echlin, E. Lifshin, L. Sawyer, and J. Michael Scanning Electron Microscopy and X-Ray Microanalysis Third Edition 2003 Springer
26. R.A. Young Introduction to the Rietveld method R.A. Young, The Rietveld method IUCr Monographs on crystallography 5 2002 Oxford Univ. Press 1 38
27. J.I. Langford, and D. Louër Powder diffraction Rep. Prog. Phys. 59 1996 131 234
28. M. Regourd Crystal chemistry of Portland cement phases P. Barnes, Structure and Performance of Cements 1983 Applied Science Publishers 109 138
29. H.F.W. Taylor Cement Chemistry 1997 Academic Press New York
30. H. Pöllmann Composition of cement phases J. Bensted, P. Barnes, Structure and Performance of Cements 2001 Taylor and Francis 25 56
31. F. Dunstetter, M.-N. de Noirfontaine, and M. Courtial Polymorphism of tricalcium silicate, the major compound of Portland cement clinker, 1. Structural data: review and unified analysis Cem. Concr. Res. 36 2006 39 53 (Pubitemid 41773613)
32. M.-N. de Noirfontaine, F. Dunstetter, M. Courtial, G. Gasecki, and M. Signes-Frehel Polymorphism of tricalcium silicate, the major compound of Portland cement clinker, 2. modelling alite for Rietveld analysis, an industrial challenge Cem. Concr. Res. 36 2006 54 64 (Pubitemid 41773614)
33. 3S from synchrotron and neutron powder diffraction and its role in quantitative analysis Cem. Concr. Res. 32 2002 1347 1356
34. T. Tsurumi, Y. Hirano, H. Kato, T. Kamiya, and M. Daimon Crystal structure and hydration of belite Ceram. Trans. 40 1994 19 25
35. W.G. Mumme, R.J. Hill, G. Bushnell-Wye, and E.R. Segnit Rietveld crystal structure refinements, crystal chemistry and calculated powder diffraction data for the polymorphs of dicalcium silicate and related phases N. Jb. Miner. Abh. 169 1995 35 68
36. 6 Acta Cryst. B 31 1975 689 697
37. 18 Acta Cryst. B 31 1975 1169 1173
38. 5 Acta Cryst. B 27 1971 2311 2315
39. 12+δ at room temperature and at 10 K Phys. C 227 1994 1 9
40. 2, as indicated by the electron distribution Acta Cryst. 14 1961 950 957
41. D. Taylor Thermal expansion data. I. binary oxides with the sodium chloride and wurtzite structure, M O Trans. J. Brit. Ceram. Soc. 83 1984 5 9
42. R. Wartchow Datensammlung nach der "Learnt profile"-methode(LP) für calcit und vergleich mit der "background peak background"-methode (BPB) Zeit. Kristall. 186 1989 300 302
43. 2 Mineral. Petrol. 31 1983 151 164
44. 2 J. Appl. Phys. 49 1978 5473 5478
45. A.G. de la Torre, M.-G. Lopez-Olmo, C. Alvarez-Rua, S. Garcia-Granda, and M.A.G. Aranda Structure and microstructure of gypsum and its relevance to Rietveld quantitative phase analyses Powder Diffr. 19 2004 240 246
46. H. Weiss, and M.F. Bräu How much water does calcined gypsum contain? Angew. Chem. Int. Ed. 48 2009 3520 3524
47. F.C. Hawthorne, and R.B. Ferguson Anhydrous sulfates II. Refinement of the crystal structure of anhydrite Can. Miner. 13 1975 289 292
48. J.A. McGinnety Redetermination of the structures of potassium sulphate and potassium chromate: the effect of electrostatic crystal forces upon observed bond lengths Acta Cryst. B 28 1972 2845 2852
49. K. Okada, and J. Ossaka Structures of potassium sodium sulphate and tripotassium sodium disulphate Acta Cryst. B 24 1980 919 921
50. 2O) from X-ray powder diffraction data Neues Jb Mineral. 182 2005 15 21
51. A.M. Il'inets, Yu.A. Malinovskii, and N.N. Nevskii The crystal structure of the rhombohedral modification of tricalcium silicate Sov. Phys. Dokl. 30 1985 191
52. F. Nishi, and Y. Takeuchi The rhombohedral structure of tricalcium silicate at 1200 degrees C Z. Kristallogr. 168 1984 197 212
53. J.W. Jeffery The crystal structure of tricalcium silicate Acta Cryst. 5 1952 26 35
54. 2 N. Jb. Miner. Mh. 1950 108 111
55. 4): the monoclinic superstructure Z. Kristallogr. 172 1985 297 314
56. W.G. Mumme Crystal structure of tricalcium silicate from a Portland cement clinker and its application to quantitative XRD analysis N. Jb. Miner. Mh. 4 1995 145 160
57. A.G. de La Torre, R.N. De Vera, A.J.M. Cuberos, and M.A.G. Aranda Crystal structure of low magnesium-content alite: application to Rietveld quantitative phase analysis Cem. Concr. Res. 38 2008 1261 1269
58. 2 polymorphic investigations: Rietveld refinement at various temperatures using synchrotron powder diffraction J. Am. Ceram. Soc. 87 2004 1625 1634
59. 3S Sov. Phys. Crystallogr. 20 1975 441 445
60. M. Courtial, M.-N. de Noirfontaine, F. Dunstetter, G. Gasecki, and M. Signes-Frehel Polymorphism of tricalcium silicate in Portland cement: a fast visual identification of structure and superstructure Pow. Diffr. 18 2003 7 15
61. I. Maki, and K. Goto Factors influencing the phase constitution of alite in Portland cement clinker Cem. Concr. Res. 12 1982 301 308
62. nd International Conference on Cement Microscopy 2000 54 64
63. th International Conference on Cement Microscopy 1996 100 111
64. W.A. Gutteridge On the dissolution of the interstitial phases in Portland cement Cem. Concr. Res. 9 1979 319 324
65. H.F.W. Taylor Cement Chemistry 2nd edition 1997 Thomas Teldford
66. R.L. Snyder, and D.L. Bish Quantitative Analysis D.L. Bish, J.E. Post, Modern Powder Diffraction Reviews in Mineralogy 20 1989 Mineralogical Society of America 101 144
67. G.W. Brindley The effect of grain or particle size on X-ray reflections from mixed powders and alloys considered in relation to the quantitative determination of crystalline substances by X-ray methods Phil. Mag. 36 1945 347 369
68. J.C. Taylor, and C.E. Matulis Absorption contrast effects in the quantitative XRD analysis of powders by full multiphase profile refinement J. Appl. Cryst. 24 1991 14 17
69. I.C. Madsen, N.V.Y. Scarlett, L.M.D. Cranswick, and T. Lwin Outcomes of the international union of crystallography commission on powder diffraction round robin on quantitative phase analysis: samples 1a to 1 h J. Appl. Cryst. 34 2001 409 426
70. A.G. de la Torre, and M.A.G. Aranda Accuracy in Rietveld quantitative phase analysis of Portland cements J. Appl. Cryst. 36 2003 1169 1176
71. A.G. de la Torre, A. Cabeza, E.R. Losilla, and M.A.G. Aranda Quantitative phase analysis of ordinary Portland cements using synchrotron radiation powder diffraction Z. Kristallogr. Suppl. 23 2006 587 592
72. G. Caglioti, A. Paoletti, and F.P. Ricci Choice of collimators for a crystal spectrometer for neutron diffraction Nucl. Inst. 3 1958 223 228
73. R.W. Cheary, A.A. Coelho, and J.P. Cline Fundamental parameters line profile fitting in laboratory diffractometers J. Res. Natl. Inst. Stand. Tech. 109 2004 1 25
74. A. Zuev Instrumental contributions to the line profile in X-ray powder diffraction. Example of the diffractometer with Bragg-Brentano geometry R.E. Dinnebier, S.J.L. Billinge, Powder Difffraction, Theory and Practice, Royal Society of Chemistry 2008 166 205
75. J.P. Cline, D. Balck, D. Gil, A. Henins, and D. Windover The application of the fundamental parameters approach as implemented in TOPAS to divergent beam powder diffraction data Mat. Sci. Forum 651 2010 201 219
76. T. Füllmann, personal communication.
77. P. Scardi Diffraction line profile analysis of nanocrystalline powders and deformed materials A. Guagliardi, N. Masciocchi, Diffraction at the Nanoscale, Nanocrystals, Defective and Amorphous Materials 2010 Insubria University Press 165 175
78. L.W. Finger, D.E. Cox, and A.P. Jephcoat A correction for powder diffraction peak asymmetry due to axial divergence J. Appl. Cryst. 27 1994 892 900
79. O. Pritula, L. Smrcok, and B. Baumgartner On reproducibility of Rietveld analysis of reference Portland cement clinkers Powder Diffr. 18 2003 16 22
80. D.L. Bish, and R.C. Reynolds Jr. Sample preparation for X-ray diffraction D.L. Bish, J.E. Post, Modern Powder Diffraction Reviews in Mineralogy 20 1989 Mineralogical Society of America 73 99
81. R. Jenkins, T.G. Fawcett, D.K. Smith, J.W. Visser, M.C. Morris, and L.K. Frevel JCPDS - international centre for diffraction data sample preparation methods in X-Ray Powder Diffraction Powder Diffr. 1 1986 51 63
82. H.P. Klug, and L.E. Alexander X-Ray Diffraction Procedures for Polycrystalline and Amorphous Materials 2nd edition 1974 Wiley
83. th International Congress on the Chemistry of Cement 2007
84. M. Enders Quantitative phase analysis World Cem. 2007 45 49
85. W.A. Gutteridge Quantitative X-ray powder diffraction in the study of some cementive materials Brit. Ceram. Proc. 35 1984 11 23
86. M. Enders Sample preparation for quantitative X-ray diffraction in cement plants: sources of errors and solutions ZKG Int. 58 2005 28 37
87. S. Seufert, C. Hesse, F. Goetz-Neunhoffer, and J. Neubauer Quantitative determination of anhydrite III from dehydrated gypsum by XRD Cem. Concr. Res. 39 2009 936 941
88. R. Jenkins, and R.L. Snyder Introduction to X-ray powder diffractometry J.D. Winefordner, Chemical Analysis a series of monographs on chemistry and its applications 1996 Wiley 231
89. W.A. Dollase Correction of intensities for preferred orientation in powder diffractometry: application of the March model J. Appl. Cryst. 19 1986 267 272
90. N.C. Popa Microstructural properties: texture and macrostress effects R.E. Dinnebier, S.J.L. Billinge, Powder Difffraction 2008 Royal Society of Chemistry Theory and Practice 332 375
91. H. Sitepu, B.H. O'Connor, and D. Li Comparative evaluation of the March and generalized spherical harmonic preferred orientation models using X-ray diffraction data for molybdite and calcite powders J. Appl. Cryst. 38 2005 158 167
92. T. Moederl Improved backloading for better results Mat. Sci. For. 378-381 2001 240 245
93. P.E. Stutzman Guide for X-ray powder diffraction analysis of Portland cement and clinker NIST Intern. Rep. 5755 1996 1 38
94. th International Congress on the Chemistry of cement 1997 1i056
95. B. Lothenbach, G. Le Saout, E. Gallucci, and K. Scrivener Influence of limestone on the hydration of Portland cements Cem. Concr. Res. 38 2008 848 860
96. J. Neubauer, Application of Rietveld quantitative X-ray diffraction analysis on technically produced OPC clinkers, OPC's and OPC/HAC blends, in: F.A. Finger-Institute for Building Materials Science, Bauhaus-University Weimar (Ed.), Proceedings of the 17th Internationale Baustofftagung (IBAUSIL), 1 (1997) 127-136.
97. L.P. Aldridge Accuracy and precision of an X-ray diffraction method for analyzing Portland cements Cem. Concr. Res. 12 1982 437 446
98. 29Si MAS NMR: effects of paramagnetic ions Solid State NMR 36 2009 32 44
99. L.P. Aldridge Effects of analytical errors on the Bogue calculation of compound composition Cem. Tech. 4 1973 177 183
100. D.H. Campbell, and J.S. Galehouse Quantitative clinker microscopy with the light microscope Cem. Concr. Aggr. 13 1991 94 96