Inorganic Solid Phases

Ca9.827(PO4)6Cl1.654 (Ca5[PO4]3Cl ht) Crystal Structure

General Information

  • Phase Label(s): Ca5[PO4]3Cl ht
  • Structure Class(es): apatite family
  • Classification by Properties:
  • Mineral Name(s): chlorapatite high
  • Pearson Symbol: hP44
  • Space Group: 176
  • Phase Prototype: Ca5[PO4]3[OH]
  • Measurement Detail(s): automatic diffractometer; 10 (determination of cell parameters), X-rays (determination of cell parameters)
  • Phase Class(es):
  • Compound Class(es): orthophosphate, chloride
  • Interpretation Detail(s): cell parameters determined and structure type assigned; composition dependence studied
  • Sample Detail(s): sample prepared from Ca10[PO4]6Cl2, chemical analysis; Ca9.827[PO4]6Cl1.654, powder (determination of cell parameters)

Substance Summary

  • Standard Formula: Ca4.9[PO4]3Cl0.8
  • Alphabetic Formula: Ca4.9Cl0.8[PO4]3
  • Published Formula: Ca9.827(PO4)6Cl1.654
  • Refined Formula:
  • Wyckoff Sequence:
  • Z Formula Units: 2
  • Density: ρ = 3.13 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.

Experimental Details

Reference

3D Interactive Structure

About this content

  • Database name

    PAULING FILE Multinaries Edition – 2012

  • Dataset ID

    sd_1501780

  • 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

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