Inorganic Solid Phases

[Bi₂(Bi_1.56K_0.44)O₃]K_0.88(PO₄)₂ (K_1.32Bi_3.56[PO₄]₂O₃) Crystal Structure

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General Information

Phase Label(s): K_1.32Bi_3.56[PO₄]₂O₃
Structure Class(es): –
Classification by Properties: –
Mineral Name(s): –
Pearson Symbol: tP84
Space Group: 114
Phase Prototype: K_1.32Bi_3.56[PO₄]₂O₃
Measurement Detail(s): automatic diffractometer (determination of cell parameters), automatic diffractometer; Bruker AXS APEX DUO (determination of structural parameters), X-rays, Mo Kα; λ = 0.071073 nm (determination of cell and structural parameters)
Phase Class(es): –
Compound Class(es): orthophosphate, oxide
Interpretation Detail(s): complete structure determined, full-matrix least-squares refinement; 88 variables; 2261 reflections; I > 3σ(I), R = 0.0314; wR = 0.0364
Sample Detail(s): sample prepared from K₂CO₃, Bi₂O₃, [NH₄]₂HPO₄, energy-dispersive X-ray analysis; K/Bi/P ratio 1.3/3.4/2, single crystal (determination of cell parameters), single crystal, 0.05×0.07×0.77 mm³ (determination of structural parameters)

Substance Summary

Standard Formula: K_1.32Bi_3.56[PO₄]₂O₃
Alphabetic Formula: Bi_3.56K_1.32O₃[PO₄]₂
Published Formula: [Bi₂(Bi_1.56K_0.44)O₃]K_0.88(PO₄)₂
Refined Formula: Bi_3.56K_1.32O₁₁P₂
Wyckoff Sequence: 114,e⁹dc²
Z Formula Units: 4
Density: ρ = 6.46 Mg·m⁻³

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Crystallographic Data

Cell Parameters

	Published Data	Standardized Data
	Published Data	Unit Cell	Niggli-Reduced Cell
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a
b
c
α
β
γ
a/b
b/c
c/a
V

Atom Coordinates

Standardized

Site	Element	Wyckoff Symbol	Symmetry	X	Y	Z	Occupation	Co-ord. No.	Atomic Env.
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Published

Site	Element	Wyckoff Symbol	Symmetry	X	Y	Z	Occupation
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Displacement Parameters

Isotropic

Site	Published U [nm²]	Type	Computed B_eq [nm²]
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Anisotropic

Site	U₁₁ [nm²]	U₂₂ [nm²]	U₃₃ [nm²]	U₁₂ [nm²]	U₁₃ [nm²]	U₂₃ [nm²]
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Experimental Details

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Reference

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3D Interactive Structure

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About this content

Database name

PAULING FILE Multinaries Edition – 2012

Dataset ID

sd_1639072

Copyright

©Springer & Material Phases Data System (MPDS), Switzerland & National Institute for Materials Science (NIMS), Japan, 2016

Chief Editor

Pierre Villars, Material Phases Data System (MPDS), CH-6354 Vitznau, Switzerland

villars.mpds@bluewin.ch

Credits

SpringerMaterials Release 2016.

Project Coordinator: Shuichi Iwata

Section-Editor: Karin Cenzual (Crystal Structures)

Cite this content

Pierre Villars (Chief Editor), PAULING FILE in: Inorganic Solid Phases, SpringerMaterials (online database), Springer, Heidelberg (ed.) SpringerMaterials [Bi2(Bi1.56K0.44)O3]K0.88(PO4)2 (K1.32Bi3.56[PO4]2O3) Crystal Structure sd_1639072 (Springer-Verlag GmbH, Heidelberg, © 2016)

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