Materials Data on Zr3S2 by Materials Project
Zr3S2 is Ilmenite-derived structured and crystallizes in the trigonal R32 space group. The structure is three-dimensional. Zr is bonded in a 4-coordinate geometry to four equivalent S atoms. There are two shorter (2.61 Å) and two longer (2.62 Å) Zr–S bond lengths. S is bonded to six equivalent Zr atoms to form a mixture of distorted face, edge, and corner-sharing SZr6 pentagonal pyramids.
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