The Crystal Structure of Scorodite
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The crystal structure of scorodite was determined by means of the Laue and the rotating-crystal methods. Xyiay data obtained from oscillation photographs taken with MoKoc radiation showed the structure to be built upon a simple orthorhombic unit cell with dimensions: <I>a</I>=10.40kX, <I>b</I>=8.94kX, <I>c</I>=10.13kX, containing eight units of the chemical formula, FeAsO<SUB>4</SUB>⋅2H<SUB>2</SUB>O. All the atoms are in general positions of the space group <I>D</I><SUP>16</SUP><SUB>2<I>h</I></SUB> <I>Pbca</I>. The values of atomic parameters were &termined by the method of trial and error. The arsenate group has the configuration of a slightly distorted tetrahedron. Each iron atom is surrounded by four oxygen atoms, each hem four different arsenate groups, and two water molecules at the corners of a distorted octahedron, the latter occupying its adjacent corners.
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