Inorganic Solid Phases

Gd3(BO3)2F3 (Gd3[BO3]2F3 rt) Crystal Structure

General Information

  • Phase Label(s): Gd3[BO3]2F3 rt
  • Structure Class(es):
  • Classification by Properties:
  • Mineral Name(s):
  • Pearson Symbol: mS56
  • Space Group: 15
  • Phase Prototype: Gd3[BO3]2F3
  • Measurement Detail(s): automatic diffractometer (determination of cell parameters), automatic diffractometer; Siemens D500 (determination of structural parameters), X-rays, Cu Kα (determination of cell and structural parameters)
  • Phase Class(es):
  • Compound Class(es): orthoborate, fluoride
  • Interpretation Detail(s): complete structure determined, Rietveld refinement, multiphase; 41 variables; 553 reflections, RP = 0.121; wRP = 0.147; RB = 0.095
  • Sample Detail(s): sample prepared from B2O3, Gd2O3, GdF3, considering weight loss during preparation, energy-dispersive X-ray analysis; weight loss during preparation 1-2 wt.%; amounts of GdBO3 (30 wt.%), powder (determination of cell and structural parameters)

Substance Summary

  • Standard Formula: Gd3[BO3]2F3
  • Alphabetic Formula: [BO3]2F3Gd3
  • Published Formula: Gd3(BO3)2F3
  • Refined Formula: B2F3Gd3O6
  • Wyckoff Sequence: 15,f6e2
  • Z Formula Units: 4
  • Density: ρ = 6.62 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_1613772

  • 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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