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X-ray single-crystal structure refinement of the 129 K superconductor HgxPb1−xBa2Ca3Cu4O10+δ

✍ Scribed by H. Schwer; J. Karpinski; K. Conder; L. Lesne; C. Rossel; A. Morawski; T. Lada; A. Paszewin


Publisher
Elsevier Science
Year
1995
Tongue
English
Weight
698 KB
Volume
243
Category
Article
ISSN
0921-4534

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✦ Synopsis


Crystals of

Hgo.sPbo.zBa2Ca3Cu4OloA4

were measured on an X-ray four-circle single-crystal diffractometer and the crystal structure was refined to R = 0.023. The space group is P4/mmm and the lattice parameters are a = 3.8530 (5) .A, and c = 18.968 (3) /~. Lead is incorporated at the Hg site, but it is shifted slightly from the origin in the z = 0 plane. A model of Pb 4 ÷ clusters in the basal plane is proposed, which is in agreement with recent TEM results. A reduction of electron density at the Hg site is attributed to the substitution by Cu or CO3 groups. Stacking faults of 1223 or 1245 material are manifested in the Fourier maps, and it was possible to refine the amount to 3.8%. However, these stacking faults induce additional electron density at the 0(4) site (½, ½, 0), and cause an overestimation of the excess oxygen content, if it is not corrected carefully. The bondlengths and distances are in agreement with those of other members of the Hg-12(n -1 )n series, and show systematic changes with increasing number n of Cut2 layers. The effect of stacking faults on the diffraction of all members of the Hg-12(n -1 )n family is discussed, and a method for their determination is given.


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X-ray single crystal structure analysis
✍ H. Schwer; J. Karpinski; L. Lesne; C. Rossel; A. Morawski; T. Lada; A. Paszewin 📂 Article 📅 1995 🏛 Elsevier Science 🌐 English ⚖ 603 KB

Crystals of Hgo.sPbo.sBa2Ca4CusO12+ 8 were measured on an X-ray four-circle single-crystal diffractometer and the crystal structure was refined to R -0.033. The onset of the superconducting transition of the crystals ranges from 101 K-115 K. The space group is P4/mmm and lattice parameters of the fi