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Preparation and Cha...
Preparation and Characterization of a New 3-Dimensional Zirconium Hydrogen Phosphate, τ-Zr(HPO4)2; Determination of the Complete Crystal Structure Combining Synchrotron X-ray Single Crystal Diffraction and Neutron Powder Diffraction.
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- Krogh Andersen, A.M. (author)
- Stockholms universitet,Institutionen för fysikalisk kemi, oorganisk kemi och strukturkemi
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Norby, P. (author)
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Hanson, J.C. (author)
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Vogt, T. (author)
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(creator_code:org_t)
- 1998-02-18
- 1998
- English.
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In: Inorganic chemistry. - : American Chemical Society. - 1520-510X .- 0020-1669. ; 37:5, s. 876-881
- Related links:
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https://urn.kb.se/re...
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https://doi.org/10.1...
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Abstract
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- A new 3-dimensional zirconium hydrogen phosphate, τ-Zr(HPO4)2, was prepared by hydrothermal syntheses. The preparation, characterization, and determination of the crystal structure of this new material are reported. The structure was solved from single-crystal synchrotron diffraction on a 25 × 25 × 50 μm crystal. The position of the hydrogen atom was found using high-resolution neutron powder diffraction data. The unit cell is tetragonal, space group I41cd (No. 110), with lattice parameters a = 11.259(1) Å, c = 10.764(1) Å, and Z = 8. The structure can be described as a 3-dimensional framework built from ZrO6 octahedra bound together by hydrogen phosphate groups (PO3(OH)). The OH groups form a hydrogen-bonded spiral along the 41 axes, with each hydrogen phosphate both donating and accepting hydrogen bonds. The thermal transformations of τ-Zr(HPO4)2 were studied using in-situ temperature-resolved powder diffraction experiments. Hereby the existence of two new phases was discovered. The new phases have been indexed and the unit cell parameters are as follows. Intermediate I: a = 8.172(1), b = 7.691(1), and c = 10.794(2) Å. Intermediate II: a = 8.283(2), b = 6.620(2), and c = 10.643(2) Å.
Subject headings
- NATURVETENSKAP -- Kemi -- Oorganisk kemi (hsv//swe)
- NATURAL SCIENCES -- Chemical Sciences -- Inorganic Chemistry (hsv//eng)
Keyword
- Inorganic chemistry
- Oorganisk kemi
Publication and Content Type
- ref (subject category)
- art (subject category)
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