Information card for entry 4101248

Structure parameters

• Formula: P S4 Sb
• Calculated formula: P S4 Sb
• Title of publication: Inorganic single wall nanotubes of SbPS(4-x)Se(x) (0 < or = x < or = 3) with tunable band gap.
• Authors of publication: Malliakas, Christos D; Kanatzidis, Mercouri G
• Journal of publication: Journal of the American Chemical Society
• Year of publication: 2006
• Journal volume: 128
• Journal issue: 20
• Pages of publication: 6538 - 6539
• a: 6.2719 ± 0.0014 Å
• b: 13.059 ± 0.004 Å
• c: 22.493 ± 0.006 Å
• α: 90.09 ± 0.02°
• β: 90.065 ± 0.019°
• γ: 91.76 ± 0.02°
• Cell volume: 1841.4 ± 0.8 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 3
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.1512
• Residual factor for significantly intense reflections: 0.117
• Weighted residual factors for significantly intense reflections: 0.2657
• Weighted residual factors for all reflections included in the refinement: 0.2808
• Goodness-of-fit parameter for all reflections included in the refinement: 1.222
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No