Inorganic Solid Phases

NaVO3·1.89H2O (NaVO3[H2O]1.89) Crystal Structure

General Information

  • Phase Label(s): NaVO3[H2O]1.89
  • Structure Class(es):
  • Classification by Properties:
  • Mineral Name(s): munirite
  • Pearson Symbol: mP28
  • Space Group: 14
  • Phase Prototype: NaVO3[H2O]1.89
  • Measurement Detail(s): Guinier-Hägg film (determination of cell parameters), automatic diffractometer; Philips PAILRED (determination of structural parameters), X-rays, Cu Kα1; λ = 0.154051 nm (determination of cell parameters), X-rays, Mo Kα; λ = 0.071069 nm (determination of structural parameters), T = 298 K (determination of structural parameters)
  • Phase Class(es):
  • Compound Class(es): oxide, hydrate
  • Interpretation Detail(s): positions of non-H and part of H atoms determined, full-matrix least-squares refinement; 1307 reflections, R = 0.023
  • Sample Detail(s): sample prepared from V2O5, NaOH, atomic emission spectroscopy, chemical analysis; 32.6 wt.% V, 21.4 wt.% H2O; 14.3 wt.% Na, powder (determination of cell parameters), single crystal, 0.10×0.15×0.18 mm3 (determination of structural parameters)

Substance Summary

  • Standard Formula: NaVO3[H2O]1.89
  • Alphabetic Formula: [H2O]1.89NaO3V
  • Published Formula: NaVO3·1.89H2O
  • Refined Formula: H2.89NaO4.89V
  • Wyckoff Sequence: 14,e7
  • Z Formula Units: 4
  • Density: ρ = 2.27 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]

Anisotropic

Site
β11 [nm2]
β22 [nm2]
β33 [nm2]
β12 [nm2]
β13 [nm2]
β23 [nm2]

Experimental Details

Reference

3D Interactive Structure

About this content

  • Database name

    PAULING FILE Multinaries Edition – 2012

  • Dataset ID

    sd_1122394

  • 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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