1979
DOI: 10.1107/s056774087900409x
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Die Kristallstruktur von Antimon(V)-oxid

Abstract: Single crystals of Sb205 were obtained by high oxygen pressure synthesis [P(O2) = 200 MPa]. The crystal structure has been refined by full-matrix least-squares procedures using diffractometer data to a final R value of 0.033 for 695 reflexions; the unit cell is monoclinic, space group C2/c, with dimensions a = 12.646 (1), b --4.7820 (4), c = 5.4247 (5) ,/k, fl = 103.91 (1) °. Sb205 is isostructural with B-Nb205 and consists of distortedcorner and edge-sharing SbO 6 octahedra; the crystal structure can be deriv… Show more

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Cited by 55 publications
(27 citation statements)
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“…Although it was reported in earlier studies that ␦-V 2 O 5 is isostructural with B-Nb 2 O 5 [14], respectively Sb 2 O 5 [16], no refinement of the crystal structure was reported. We provide here the first Rietveld refinement of the crystal structure for ␦-V 2 O 5 .…”
Section: High Pressure Crystal Structuresmentioning
confidence: 63%
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“…Although it was reported in earlier studies that ␦-V 2 O 5 is isostructural with B-Nb 2 O 5 [14], respectively Sb 2 O 5 [16], no refinement of the crystal structure was reported. We provide here the first Rietveld refinement of the crystal structure for ␦-V 2 O 5 .…”
Section: High Pressure Crystal Structuresmentioning
confidence: 63%
“…We provide here the first Rietveld refinement of the crystal structure for ␦-V 2 O 5 . The refined lattice parameters are a = 11.972Å, b = 4.702Å, c = 5.325Å and β = 104.41 • , and correspond well with the data given in former articles [14,16]. The detailed results of the refinement are given in Table 1, the atomic positions and bond lengths and angles in Appendix D. The structure is a three dimensional framework of edge and corner sharing VO 6 octahedra.…”
Section: High Pressure Crystal Structuresmentioning
confidence: 91%
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“…The monoclinic phase can only be prepared under extreme conditions [38] and is metastable in aqueous solutions at ambient temperatures with respect to cubic 'antimonic acid', Sb 2 O 5 ·4H 2 O. [31] No thermochemical data are available for the latter phase and this too represents a marked gap in our knowledge of the simple chemistry of antimony.…”
Section: Solubility Issuesmentioning
confidence: 99%
“…The crystallographic data of 1 and 2 [61], and that of ZnO and Sb 2 O 5 provided [62,67], were used for theoretical calculations. The total energy was calculated using exchange--correlation parameters of the hybrid B3LYP functional.…”
Section: Band Structures and Electronic Originations Of Shgmentioning
confidence: 99%