Tables for
Volume H
Powder diffraction
Edited by C. J. Gilmore, J. A. Kaduk and H. Schenk

International Tables for Crystallography (2018). Vol. H, ch. 3.10, p. 375

Section Single phases

L. León-Reina,a A. Cuesta,b M. García-Maté,c,d G. Álvarez-Pinazo,c,d I. Santacruz,c O. Vallcorba,b A. G. De la Torrec and M. A. G. Arandab,c*

aServicios Centrales de Apoyo a la Investigación, Universidad de Málaga, 29071 Málaga, Spain,bALBA Synchrotron, Carrer de la Llum 2–26, Cerdanyola, 08290 Barcelona, Spain,cDepartamento de Química Inorgánica, Cristalografía y Mineralogía, Universidad de Málaga, 29071 Málaga, Spain, and dX-Ray Data Services S.L., Edificio de institutos universitarios, c/ Severo Ochoa 4, Parque tecnológico de Andalucía, 29590 Málaga, Spain
Correspondence e-mail: Single phases

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Table 3.10.1[link] provides information about the phases used in this work. Further details can be found in the original publication (León-Reina et al., 2016[link]). All of the mixtures were prepared by grinding the weighed phases by hand in an agate pestle and mortar for 20 min to ensure homogeneity.

Table 3.10.1| top | pdf |
Cambridge Structural Database (CSD)/Inorganic Crystal Structure Database (ICSD) reference codes for all phases used for Rietveld refinements in this work and the linear absorption coefficients for the wavelengths used

PhaseChemical formulaCSD/ICSD refcodeμ (cm−1), Cu Kα1, λ = 1.5406 Åμ (cm−1), Mo Kα1, λ = 0.7093 Åμ (cm−1), λ = 0.7744/0.4959 ÅReference
Glucose C6H12O6 Glucsa10 12 1 1.3/— Brown & Levy (1979[link])
Fructose C6H12O6 Fructo11 12 1 1.3/— Kanters et al. (1977[link])
α-Lactose monohydrate C12H22O11·H2O Lactos10 12 1 1.3/— Fries et al. (1971[link])
Xylose C5H10O5 Xylose 12 1 1.2/— Hordvik (1971[link])
Gypsum CaSO4·(H2O)2 151692 141 16 22/— De la Torre et al. (2004[link])
Quartz SiO2 41414 92 10 11/2.9 Will et al. (1988[link])
s-Anhydrite CaSO4 16382 219 24 31/— Kirfel & Will (1980[link])
i-Anhydrite CaSO4 79527 219 24 31/— Bezou et al. (1995[link])
Zincite ZnO 65120 285 244 —/89.1 Albertsson et al. (1989[link])
Calcite CaCO3 80869 194 22 27/7.3 Maslen et al. (1995[link])
SrSO4 SrSO4 22322 299 187 40/— Garske & Peacor (1965[link])


León-Reina, L., García-Maté, M., Álvarez-Pinazo, G., Santacruz, I., Vallcorba, O., De la Torre, A. G. & Aranda, M. A. G. (2016). Accuracy in Rietveld quantitative phase analysis: a comparative study of strictly monochromatic Mo and Cu radiations. J. Appl. Cryst. 49, 722–735.Google Scholar

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