issue contents

Journal logoJOURNAL OF
ISSN: 1600-5767

April 1996 issue

Highlighted illustration

Cover illustration: Neutron scattering pattern in the (hk0) reciprocal-lattice plane from alpha-AgI at 520 K. The portion shown extends from 0 to 5.4 reciprocal-lattice units in both h and k. Courtesy of D. A. Keen, V. M. Nield and R. L. McGreevy.

lead articles

J. Appl. Cryst. (1996). 29, 81-99
doi: 10.1107/S0021889895007126
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A basic theory and recent experiments of magnetic Compton scattering using synchrotron radiation are reviewed.

research papers

J. Appl. Cryst. (1996). 29, 100-104
doi: 10.1107/S002188989501421X
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The current practice of restraining all B factors equal to their bonded neighbors is reviewed. A restraint is proposed that uses the patterns of B factors of low-resolution refinements.

J. Appl. Cryst. (1996). 29, 105-109
doi: 10.1107/S0021889894011878
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A method is described of digitizing an X-ray film image by the use of a charge-coupled device. The use of an analytic representation of the observed film response is demonstrated.

J. Appl. Cryst. (1996). 29, 110-117
doi: 10.1107/S0021889895008144
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The origins of distortions of diffraction patterns recorded on image-plate detectors are analyzed, and two methods for two-dimensional desmearing are proposed and discussed.

J. Appl. Cryst. (1996). 29, 118-124
doi: 10.1107/S0021889895009733
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Microtexture analysis of a lithographically prepared alloy sample (LIGA process) has been performed with a 7 μm synchrotron-radiation beam.

J. Appl. Cryst. (1996). 29, 125-133
doi: 10.1107/S0021889895011289
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X-ray examination of c-axis oriented thin films of YBa2Cu3- O7−δ on various substrates revealed changes induced by oxidation/reduction, doping with Fe and irradiation with heavy ions. The rotation effects originate in changes of the YBCO film microstructure and do not correlate with the substrate type used.

J. Appl. Cryst. (1996). 29, 134-146
doi: 10.1107/S0021889895011605
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A scattering function is obtained that describes mass-fractal scattering over a wide range of angle in terms of the radius of gyration, contrast factor and fractal dimension. Applications to organic polymer blends as well as low-density ceramics and organic materials are also discussed.

J. Appl. Cryst. (1996). 29, 147-151
doi: 10.1107/S0021889895011757
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The melt-textured growth process under a magnetic field of Bi2Sr2Ca0.8Dy0.2Cu2O8−y ceramics has been studied. The chemical composition of the different microstructural features has been put into evidence, and correlated with the mechanism of formation.

J. Appl. Cryst. (1996). 29, 152-158
doi: 10.1107/S0021889895012751
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Two methods to calculate the resolution function for two-axis specular neutron reflectivity are presented and compared with measured reflectivity curves of a well defined sample with pronounced oscillations.

J. Appl. Cryst. (1996). 29, 159-163
doi: 10.1107/S0021889895013434
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The X-ray method for determination of the additional CuO atomic layer density in the AB2Cu3O7 structure and local changes of interplanar distances is described.

J. Appl. Cryst. (1996). 29, 164-169
doi: 10.1107/S0021889895013641
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Distributions of rotation axes corresponding to the smallest rotation angles for symmetric objects (crystallites) are given. All proper symmetries in three-dimensional space are considered. A uniform orientation distribution of objects is assumed.

J. Appl. Cryst. (1996). 29, 170-177
doi: 10.1107/S0021889895013719
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Both the indirect transform and maximum-entropy methods are developed for recovering the length distribution of polydisperse rods from their small-angle scattering data.

J. Appl. Cryst. (1996). 29, 178-185
doi: 10.1107/S0021889895014191
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Theoretical X-ray diffraction patterns have been calculated for powders of very small faujasite and ZSM-5 crystallites. These calculated patterns give the first realistic picture of the expected appearance of X-ray powder diffraction patterns of ultrasmall crystals of these well known commercial zeolites.

J. Appl. Cryst. (1996). 29, 186-197
doi: 10.1107/S0021889895015561
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A method is discussed to determine both qualitatively and quantitatively the polarization dependent X-ray absorption due to anisotropic anomalous scattering from fluorescence measurements.

computer programs

J. Appl. Cryst. (1996). 29, 198-201
doi: 10.1107/S0021889895014567
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Following the method proposed by Marín & Diéguez [J. Appl. Cryst. (1995). 28, 889–840], an algorithm has been developed for the complete simulation of any X-ray back-reflection Laue pattern.

J. Appl. Cryst. (1996). 29, 202-203
doi: 10.1107/S0021889895013732
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A graphical user interface for X-PLOR has been developed so that users can interact with the program via World Wide Web browsers.

laboratory notes

J. Appl. Cryst. (1996). 29, 204-205
doi: 10.1107/S0021889895011599
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An airtight 15 ml pressure reaction tube has been modified to hold a mounted crystal. Firmly packed in foam rubber, these crystal shipping tubes have been successfully used to ship macromolecular crystals by overnight courier.

J. Appl. Cryst. (1996). 29, 206-207
doi: 10.1107/S0021889895013720
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A new technique for making spheres of single crystals is briefly described. It is confirmed that this method is very effective when used to prepare spherical specimens of LaB6, a refractory material that is widely used as a thermo-radiated material.

cryocrystallography papers

J. Appl. Cryst. (1996). 29, 208-210
doi: 10.1107/S002188989501315X
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A simple device for the transfer of a flash-cooled crystal from the goniometer head, where it is positioned in the cold gas stream, to the storage dewar and vice versa is described.

fast communications

J. Appl. Cryst. (1996). 29, 211-214
doi: 10.1107/S0021889895017195
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A Monte Carlo technique has been successfully applied to solve the crystal structure of p-methoxybenzoic acid from X-ray powder diffraction data

J. Appl. Cryst. (1996). 29, 215-218
doi: 10.1107/S0021889895015263
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The crystal structure of cubic iron monosilicide, ∊-FeSi, has been determined at six pressures between 0 and 8.5 GPa by time-of-flight neutron powder diffraction, using the POLARIS diffractometer at the ISIS spallation neutron source.
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