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- W2088532173 abstract "Abstract The average structure of ternary sulfide Cu2Gd2/3S2 has been refined using single-crystal X-ray diffraction data: space group P 3 , a=b=3.899(1), c=6.421(2) A, Z=1, RF=0.036, and wRF=0.041 for 418 reflections and 8 structural parameters. The average structure is based on hexagonal close packing of S with Cu in tetrahedral sites and Gd in octahedral sites, the latter sites being occupied to 2/3. Diffuse streaks observed by electron diffraction, however, indicate a trigonal strict periodicity of A=6.753 A=√3a within (001) and a vague period of C=12.842 A=2c, suggesting a layer structure with an intralayer order and interlayer short-range order of Gd vacancies. A model of the real structure has been proposed, and the diffuse scattering has been simulated by the matrix method for one-dimensional disorder. The calculated intensity distribution corresponds to the observed distribution of the diffuse streaks in the electron diffraction pattern and to the intensity distribution measured on an X-ray single-crystal diffractometer; the total X-ray powder diffraction pattern of Cu2Gd2/3S2 can be reproduced almost completely by calculation." @default.
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- W2088532173 date "2000-07-01" @default.
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- W2088532173 title "Crystal Structure of Cu2Gd2/3S2: Interlayer Short-Range Order of Gd Vacancies" @default.
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- W2088532173 doi "https://doi.org/10.1006/jssc.2000.8652" @default.
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