Materials Data on YCuPbS3 by Materials Project

Kristin Persson
YCuPbS3 crystallizes in the orthorhombic Pnma space group. The structure is three-dimensional. Y3+ is bonded to six S2- atoms to form YS6 octahedra that share corners with two equivalent YS6 octahedra, edges with two equivalent YS6 octahedra, and edges with four equivalent CuS4 tetrahedra. The corner-sharing octahedral tilt angles are 41°. There are four shorter (2.75 Å) and two longer (2.76 Å) Y–S bond lengths. Cu1+ is bonded to four S2- atoms to form CuS4...
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