Inorganic Solid Phases

Mn0.68Fe2.35Zn0.72Mn0.46Al0.28Mg0.19Ca2Be4(PO4)6(OH)4(H2O,O)2·4H2O (CaMg0.095Be2Zn0.36Mn0.57Fe1.175Al0.14[PO4]3[OH]2[H2O]3) Crystal Structure

General Information

  • Phase Label(s): CaMg0.095Be2Zn0.36Mn0.57Fe1.175Al0.14[PO4]3[OH]2[H2O]3
  • Structure Class(es):
  • Classification by Properties:
  • Mineral Name(s): greifensteinite
  • Pearson Symbol: mS104
  • Space Group: 15
  • Phase Prototype: Ca(Mg0.05Zn0.18Fe0.59Al0.07Mn0.12)2Be2Mn0.34[PO4]3[OH]2[H2O]3
  • Measurement Detail(s): automatic diffractometer; KM-4 (determination of structural parameters), X-rays, Mo Kα; λ = 0.071073 nm (determination of structural parameters)
  • Phase Class(es):
  • Compound Class(es): hydroxide, orthophosphate, hydrate
  • Interpretation Detail(s): positions of non-H and part of H atoms determined, 562 reflections; F > 2σ(F), R = 0.046
  • Sample Detail(s): greifensteinite sample from Brazil, Minas Gerais, Pireneus mine, energy-dispersive X-ray analysis; Fe2.3Mn1.2Zn1.6Mg0.5Sl0.4Ca2Be4[PO4]6[OH]4[H2O]x, single crystal, 0.125×0.25×0.25 mm3 (determination of structural parameters)

Substance Summary

  • Standard Formula: CaMg0.095Be2Zn0.36Mn0.57Fe1.175Al0.14[PO4]3[OH]2[H2O]3
  • Alphabetic Formula: Al0.14Be2CaFe1.175[H2O]3Mg0.095Mn0.57[OH]2[PO4]3Zn0.36
  • Published Formula: Mn0.68Fe2.35Zn0.72Mn0.46Al0.28Mg0.19Ca2Be4(PO4)6(OH)4(H2O,O)2·4H2O
  • Refined Formula: Al0.14Be2CaFe1.18H8Mg0.09Mn0.57O17P3Zn0.36
  • Wyckoff Sequence: 15,f11e3a
  • Z Formula Units: 4
  • Density: ρ = 2.96 Mg·m−3

Crystallographic Data

Cell Parameters

Published Data
Standardized Data
Unit Cell
Niggli-Reduced Cell
Space Group
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.

Published

Site
Element
Wyckoff Symbol
Symmetry
X
Y
Z
Occupation

Displacement Parameters

Isotropic

Site
Published
B [nm2]
Type
Computed
Beq [nm2]

Experimental Details

Reference

3D Interactive Structure

About this content

  • Database name

    PAULING FILE Multinaries Edition – 2012

  • Dataset ID

    sd_1907198

  • 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.

    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)

  • Cite this content

    Citation copied