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DOE OSTI · 1282219

Materials Data on NiC2(SN)2 by Materials Project

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Abstract

NiC2(NS)2 crystallizes in the monoclinic C2/m space group. The structure is two-dimensional and consists of one NiC2(NS)2 sheet oriented in the (0, 0, 1) direction. Ni2+ is bonded to two equivalent N3- and four equivalent S2- atoms to form distorted edge-sharing NiS4N2 octahedra. Both Ni–N bond lengths are 1.93 Å. All Ni–S bond lengths are 2.53 Å. C4+ is bonded in a distorted linear geometry to one N3- and one S2- atom. The C–N bond length is 1.18 Å. The C–S bond length is 1.64 Å. N3- is bonded in a distorted bent 150 degrees geometry to one Ni2+ and one C4+ atom. S2- is bonded in a 3-coordinate geometry to two equivalent Ni2+ and one C4+ atom.

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36 MATERIALS SCIENCEC-N-Ni-Scrystal structureNiC2(SN)2

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2020-07-16. Materials Data on NiC2(SN)2 by Materials Project. https://doi.org/10.17188/1282219

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36 MATERIALS SCIENCE↗