Information card for entry 4118800

Structure parameters

• Formula: C0.11 Al0.1 Na0.1 O1.21 Si0.4
• Calculated formula: C0.105255 Al0.1 Na0.0958333 O1.21051 Si0.4
• Title of publication: Understanding Carbon Dioxide Adsorption on Univalent Cation Forms of the Flexible Zeolite Rho at Conditions Relevant to Carbon Capture from Flue Gases
• Authors of publication: Magdalena M. Lozinska; Enzo Mangano; John P. S. Mowat; Ashley M. Shepherd; Russell F. Howe; Stephen P. Thompson; Julia E. Parker; Stefano Brandani; Paul A. Wright
• Journal of publication: Journal of the American Chemical Society
• Year of publication: 2012
• Journal volume: 134
• Pages of publication: 17628 - 17642
• a: 14.62823 ± 0.00006 Å
• b: 14.62823 Å
• c: 14.62823 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 3130.22 ± 0.013 ų
• Cell temperature: 298 K
• Ambient diffraction temperature: 298 K
• Number of distinct elements: 5
• Space group number: 217
• Hermann-Mauguin space group symbol: I -4 3 m
• Hall space group symbol: I -4 2 3
• RFsqd: 0.07395
• Goodness-of-fit parameter for all reflections: 2.43
• Method of determination: powder diffraction
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.827159 Å
• Diffraction radiation type: synchrotron
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes