Crystal Lattice Structures:	Creation Date: 27 Aug 1998
	Last Modified: 21 Oct 2004

The α ReO₃ (D0₉) Structure

You can now

• see the structure from several perspectives;
• examine the structure with an external viewer; or
• download the coordinates of the atoms in these pictures in XYZ format.
• visualize the structure (Uses the JMOL Applet)

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• This structure is just the Perovskite structure without the calcium atoms. To see this, shift the origin to (½ a , ½ a , ½ a).

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• Prototype: ReO₃ (α)
• Pearson Symbol: cP4
• Strukturbericht Designation: D0₉
• Space Group: Pm3m (Cartesian and lattice coordinate listings available)
• Number: 221
• Other compounds with this Structure: Cu₃N, O₃W, O₃U
• Primitive Vectors:

  A1	=	a X
  A2	=	a Y
  A3	=	a Z

• Basis Vectors:

  B1	=	0			(Re)	(1a)
  B2	=	½ A1	=	½ a X	(O)	(3d)
  B3	=	½ A2	=	½ a Y	(O)	(3d)
  B4	=	½ A3	=	½ a Z	(O)	(3d)

See these vectors in LaTeX output format.

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Structures indexed by: Strukturbericht Symbol Pearson Symbol Space Group Prototype

This is a mirror of an old page created at the Naval Research Laboratory Center for Computational Materials Science The maintained successor is hosted at http://www.aflowlib.org/CrystalDatabase/ and published as M. Mehl et al., Comput. Mater. Sci. 136 (Supp.), S1-S828 (2017).