Ba21M2O5H12+x, x= 0 (M= Zn) (Ba21Zn2O5H12) Crystal Structure
General Information
- Phase Label(s): Ba21Zn2O5H12
- Structure Class(es): –
- Classification by Properties: –
- Mineral Name(s): –
- Pearson Symbol: cF592
- Space Group: 227
- Phase Prototype: Ba21Si2O5H14
- Measurement Detail(s): automatic diffractometer (determination of cell parameters), automatic diffractometer; Rigaku (determination of structural parameters), X-rays, Mo Kα (determination of cell and structural parameters)
- Phase Class(es): –
- Compound Class(es): hydride, oxide
- Interpretation Detail(s): complete structure determined, full-matrix least-squares refinement on F2; 26 variables; I > 2σ(I), R = 0.0944; wR = 0.2110
- Sample Detail(s): sample prepared from Ba, Zn, BaH2, BaO2, amounts of BaO and BaH2, single crystal (determination of cell and structural parameters)
Substance Summary
- Standard Formula: Ba21Zn2O5H12
- Alphabetic Formula: Ba21H12O5Zn2
- Published Formula: Ba21M2O5H12+x, x= 0 (M= Zn)
- Refined Formula: Ba21H12O5Zn2
- Wyckoff Sequence: 227,g3fecba
- Z Formula Units: 8
- Density: ρ = 4.85 Mg·m−3
Crystallographic Data
Cell Parameters
Atom Coordinates
Standardized
Published
Displacement Parameters
Isotropic
Experimental Details
Reference
3D Interactive Structure
About this content
PAULING FILE Multinaries Edition – 2012
sd_1142140
©Springer & Material Phases Data System (MPDS), Switzerland & National Institute for Materials Science (NIMS), Japan, 2016
Pierre Villars, Material Phases Data System (MPDS), CH-6354 Vitznau, Switzerland
SpringerMaterials Release 2016.
Data generated pre-2002: © Springer & MPDS & NIMS; post-2001: © Springer & MPDS
All Rights Reserved. Version 2016.10.
Project Coordinator: Shuichi Iwata
Section-Editor: Karin Cenzual (Crystal Structures)
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