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  • Wiley-Blackwell  (8,929)
  • American Physical Society (APS)
  • International Union of Crystallography (IUCr)
  • 1985-1989
  • 1980-1984  (10,224)
  • 1982  (10,224)
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  • 1985-1989
  • 1980-1984  (10,224)
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  • 1
    Electronic Resource
    Electronic Resource
    Copenhagen : International Union of Crystallography (IUCr)
    Applied crystallography online 15 (1982), S. 5-14 
    ISSN: 1600-5767
    Source: Crystallography Journals Online : IUCR Backfile Archive 1948-2001
    Topics: Geosciences , Physics
    Notes: A method of measuring accurate cubic lattice parameters is developed which is suited to the type of conditions encountered in high- and low-temperature powder diffractometry. This is based on the fact that the absolute Bragg angle of each line in an indexed cubic diffraction pattern can be determined from a knowledge of the differences in angles between lines. Accurate zero-angle alignment, therefore, is unnecessary. Furthermore, it is shown that the peak or centroid shift of the line profiles arising from the instrumental and physical aberrations can be determined directly from the measured angular data without assuming a specific angular dependence. In practice the accuracy of the method is of the order of 0.0002 Å for a lattice parameter of approximately 8 Å.
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  • 2
    Electronic Resource
    Electronic Resource
    Copenhagen : International Union of Crystallography (IUCr)
    Applied crystallography online 15 (1982), S. 20-26 
    ISSN: 1600-5767
    Source: Crystallography Journals Online : IUCR Backfile Archive 1948-2001
    Topics: Geosciences , Physics
    Notes: Calculations of diffraction line profiles and Scherrer constants for crystallites whose external shape has cubic symmetry are extended to crystallites of cylindrical shape. The analysis includes the limiting cases of acicular crystals and disks and, to a reasonable degree of approximation in many cases, to hexagonal prisms. These shapes have applications in size determination for materials which form prismatic crystallites, particularly those which belong to the hexagonal system or have been derived from substances with this symmetry.
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  • 3
    Electronic Resource
    Electronic Resource
    Copenhagen : International Union of Crystallography (IUCr)
    Applied crystallography online 15 (1982), S. 35-38 
    ISSN: 1600-5767
    Source: Crystallography Journals Online : IUCR Backfile Archive 1948-2001
    Topics: Geosciences , Physics
    Notes: The Warren–Averbach profile analysis was modified to study the deformed state of Al. The X-ray diffraction effect of dislocations locating on cell boundaries may be treated as `size broadening', while that of dislocations inside cells is `strain broadening', which may be treated with Wilkens's theory. X-ray Debye profile measurement was performed on deformed, recovered and annealed samples of commercial pure Al. Some information concerning the dislocation glide systems and distribution as well as the differences between the deformed and recovered state were given by the Debye profile analysis. The results are in good agreement with those obtained by other authors, which prove the reliability and correctness of the method.
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  • 4
    Electronic Resource
    Electronic Resource
    Copenhagen : International Union of Crystallography (IUCr)
    Applied crystallography online 15 (1982), S. 39-47 
    ISSN: 1600-5767
    Source: Crystallography Journals Online : IUCR Backfile Archive 1948-2001
    Topics: Geosciences , Physics
    Notes: The extended structure of the Pt L3 X-ray absorption edge for some platinum compounds was measured and Fourier inverted. It is shown that the way in which the contribution of the isolated atom is subtracted from the absorption spectrum may influence the shape of the first peak in the Fourier transform and possibly lead to erroneous structural interpretations concerning the first-neighbour shell of the absorbing atom. These errors are the more important the smaller the separation between the absorbing atom and its nearest neighbours. An improved method of subtraction of the isolated-atom absorption is proposed and checked.
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  • 5
    Electronic Resource
    Electronic Resource
    Copenhagen : International Union of Crystallography (IUCr)
    Applied crystallography online 15 (1982), S. 251-254 
    ISSN: 1600-5767
    Source: Crystallography Journals Online : IUCR Backfile Archive 1948-2001
    Topics: Geosciences , Physics
    Notes: Changes in the microporosity of several types of Brazilian high-ash coals have been analyzed by small-angle X-ray scattering as a function of thermal treatment. Pore size, determined using Guinier plots, decreased following thermal treatment of the samples. The modification of porosity induced by thermal treatment was similar for high-ash and low-ash coals, from which it may be inferred that mineral content is not a determining factor in the process of pore formation. Internal surface area for the samples was calculated with SAXS data. A correlation is established between the internal surface area values obtained and the carbon content and heat-treatment temperatures of the samples.
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  • 6
    Electronic Resource
    Electronic Resource
    Copenhagen : International Union of Crystallography (IUCr)
    Applied crystallography online 15 (1982), S. 279-281 
    ISSN: 1600-5767
    Source: Crystallography Journals Online : IUCR Backfile Archive 1948-2001
    Topics: Geosciences , Physics
    Notes: Crystal data for the series of piperazinium bis(n-alkanoates) of the type 2[CxH2x − 1O2−] [C4H12N22+] for x = 1 to 16 are presented. Most of these compounds have triclinic unit cells whose dimensions, obtained from single-crystal work, have been used to index their powder diagrams. The a ({\bar a} = 5.718 Å) and b ({\bar b} = 7.481 Å) cell dimensions remain nearly constant while the c dimension and the volume of the unit cell increase linearly with x, the number of carbon atoms in the alkanoate anion. Presumably the aliphatic sequence in the alkanoate anion adopts the fully extended conformation and lies in the bc plane and nearly along the c direction.
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  • 7
    Electronic Resource
    Electronic Resource
    Copenhagen : International Union of Crystallography (IUCr)
    Applied crystallography online 15 (1982), S. 461-462 
    ISSN: 1600-5767
    Source: Crystallography Journals Online : IUCR Backfile Archive 1948-2001
    Topics: Geosciences , Physics
    Notes: Lattice-constant thermal expansions, Δa/a and Δc/c, have been measured on α-HgI2 single crystals from 293 K up to the red-to-yellow transition temperature. The curves Δa/a(T) and Δc/c(T) are linear. The thermal expansion coefficients are determined: α[100] = (1.0 ± 0.1) × 10−5 K−1 and α[001] = (4.6 ± 0.1) × 10−5 K−1. No evidence of a red-to-orange phase transition could be found.
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  • 8
    Electronic Resource
    Electronic Resource
    Copenhagen : International Union of Crystallography (IUCr)
    Applied crystallography online 15 (1982), S. 452-460 
    ISSN: 1600-5767
    Source: Crystallography Journals Online : IUCR Backfile Archive 1948-2001
    Topics: Geosciences , Physics
    Notes: Total neutron scattering data were collected on sputtered YFe2 at 298 K and TbFe2 at 423 K with a wavelength of 0.7 Å. The TbFe2 data were collected above the magnetic ordering temperature of 383 K. In addition, the elastic neutron scattering of TbFe2 was measured with the use of a pyrolytic graphite analyzer at a wavelength of 1.5 Å, and its total X-ray scattering was measured with Mo radiation and a silicon-lithium drifted detector. Experimental radial distribution functions, with statistical error limits, were calculated. Errors due to an incorrect background, scaling of the data and termination effects were minimized. The scale and shape of the experimental background and the coordination numbers, internuclear distances and disorder parameters, for the first six coordination spheres, have been determined. The contribution of paramagnetic inelastic scattering from TbFe2 to the total neutron scattering is quite appreciable. The shape of the background scattering, which goes through a maximum, is indicative of residual coherence and suggests short-range magnetic ordering where neighboring atom spins are aligned. These effects are not observed in YFe2, nor in the elastic TbFe2 data. The metallic glasses have a structural topology which is quite different from that found in their crystalline analogues. The transition-metal substructure, consisting of corner-sharing tetrahedra, is the only aspect of the crystalline topology preserved in the amorphous phase. The structural parameters suggest a tendency of the rare-earth atoms to cluster, thereby decreasing the number of Fe nearest neighbors relative to the crystalline structure.
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  • 9
    Electronic Resource
    Electronic Resource
    Copenhagen : International Union of Crystallography (IUCr)
    Applied crystallography online 15 (1982), S. 55-59 
    ISSN: 1600-5767
    Source: Crystallography Journals Online : IUCR Backfile Archive 1948-2001
    Topics: Geosciences , Physics
    Notes: By using data from the Wallace & Ward [J. Appl. Cryst. (1975), 8, 255–260] cylindrical texture camera integrated with other traditional X-ray powder film techniques for very low and very high diffraction angles, a new high-temperature modification of CeO2 was identified and indexed resulting in a trigonal or hexagonal unit cell with a = 8.36(2) and c = 10.42(2) Å, (axial ratio 1.264) and Z = 16. The new phase is an oxidation product of CeO2-doped hot-pressed silicon nitride. It can be quenched to room temperature under appropriate conditions. Its stability on reheating is strictly related to its interaction with the silicate phase.
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  • 10
    Electronic Resource
    Electronic Resource
    Copenhagen : International Union of Crystallography (IUCr)
    Applied crystallography online 15 (1982), S. 60-64 
    ISSN: 1600-5767
    Source: Crystallography Journals Online : IUCR Backfile Archive 1948-2001
    Topics: Geosciences , Physics
    Notes: Multiple electron scattering between weak beams has been used as the basis for a simple method to determine the absolute polarity of some non-centrosymmetric crystals. For crystals with the sphalerite structure many orientations have been found in which small departures from centrosymmetry produce large effects on the convergent-beam diffraction patterns (microdiffraction). The effects are reasonably independent of thickness and so can be analyzed qualitatively without the use of computers.
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