Inorganic Solid Phases

Na3(Ce1.22Ca1.15Na0.40Sr0.24)(CO3)5 (Na3.3Sr0.25Ca1.15Ce1.3[CO3]5) Crystal Structure

General Information

  • Phase Label(s): Na3.3Sr0.25Ca1.15Ce1.3[CO3]5
  • Structure Class(es):
  • Classification by Properties:
  • Mineral Name(s):
  • Pearson Symbol: oS104
  • Space Group: 36
  • Phase Prototype: Na3(Sr0.33Ca0.33Ce0.33)3[CO3]5
  • Measurement Detail(s): automatic diffractometer; 25 (determination of cell parameters), automatic diffractometer; Philips PW1100 (determination of structural parameters), X-rays, Mo Kα; λ = 0.07107 nm (determination of cell and structural parameters), T = 295 K (determination of cell and structural parameters)
  • Phase Class(es):
  • Compound Class(es): carbonate
  • Interpretation Detail(s): complete structure determined, full-matrix least-squares refinement; 156 variables; 2391 reflections, R = 0.074; wR = 0.091
  • Sample Detail(s): remondite sample from Cameroon, Kribi, Nlende, Na3(Ce0.56La0.44Nd0.12Pr0.06Sm0.02Ca1.15Na0.40Sr0.24)[CO3]5, single crystal (determination of cell parameters), single crystal, 0.55 mm diameter (determination of structural parameters)

Substance Summary

  • Standard Formula: Na3.3Sr0.25Ca1.15Ce1.3[CO3]5
  • Alphabetic Formula: [CO3]5Ca1.15Ce1.3Na3.3Sr0.25
  • Published Formula: Na3(Ce1.22Ca1.15Na0.40Sr0.24)(CO3)5
  • Refined Formula: C5Ca1.14Ce1.32Na3.30O15Sr0.24
  • Wyckoff Sequence: 4,a26
  • Z Formula Units: 2
  • Density: ρ = 3.51 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_1901582

  • 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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