Materials Data on Eu(Ni3S4)2 by Materials Project
Abstract
Eu(Ni3S4)2 crystallizes in the triclinic P1 space group. The structure is three-dimensional. Eu3+ is bonded in a body-centered cubic geometry to eight S2- atoms. There are a spread of Eu–S bond distances ranging from 2.77–3.06 Å. There are six inequivalent Ni+2.17+ sites. In the first Ni+2.17+ site, Ni+2.17+ is bonded to five S2- atoms to form a mixture of edge and corner-sharing NiS5 trigonal bipyramids. There are a spread of Ni–S bond distances ranging from 2.21–2.32 Å. In the second Ni+2.17+ site, Ni+2.17+ is bonded to five S2- atoms to form a mixture of edge and corner-sharing NiS5 trigonal bipyramids. There are a spread of Ni–S bond distances ranging from 2.21–2.32 Å. In the third Ni+2.17+ site, Ni+2.17+ is bonded to five S2- atoms to form a mixture of edge and corner-sharing NiS5 trigonal bipyramids. There are a spread of Ni–S bond distances ranging from 2.21–2.32 Å. In the fourth Ni+2.17+ site, Ni+2.17+ is bonded to five S2- atoms to form a mixture of edge and corner-sharing NiS5 trigonal bipyramids. There are a spread of Ni–S bond distances ranging from 2.21–2.32 Å. In the fifth Ni+2.17+ site, Ni+2.17+ is bonded to five S2- atoms to form a mixture of edgemore »
- Authors:
- Publication Date:
- Other Number(s):
- mp-695771
- DOE Contract Number:
- AC02-05CH11231; EDCBEE
- Research Org.:
- Lawrence Berkeley National Lab. (LBNL), Berkeley, CA (United States). LBNL Materials Project
- Sponsoring Org.:
- USDOE Office of Science (SC), Basic Energy Sciences (BES)
- Collaborations:
- MIT; UC Berkeley; Duke; U Louvain
- Subject:
- 36 MATERIALS SCIENCE
- Keywords:
- crystal structure; Eu(Ni3S4)2; Eu-Ni-S
- OSTI Identifier:
- 1284878
- DOI:
- https://doi.org/10.17188/1284878
Citation Formats
The Materials Project. Materials Data on Eu(Ni3S4)2 by Materials Project. United States: N. p., 2020.
Web. doi:10.17188/1284878.
The Materials Project. Materials Data on Eu(Ni3S4)2 by Materials Project. United States. doi:https://doi.org/10.17188/1284878
The Materials Project. 2020.
"Materials Data on Eu(Ni3S4)2 by Materials Project". United States. doi:https://doi.org/10.17188/1284878. https://www.osti.gov/servlets/purl/1284878. Pub date:Wed Jul 15 00:00:00 EDT 2020
@article{osti_1284878,
title = {Materials Data on Eu(Ni3S4)2 by Materials Project},
author = {The Materials Project},
abstractNote = {Eu(Ni3S4)2 crystallizes in the triclinic P1 space group. The structure is three-dimensional. Eu3+ is bonded in a body-centered cubic geometry to eight S2- atoms. There are a spread of Eu–S bond distances ranging from 2.77–3.06 Å. There are six inequivalent Ni+2.17+ sites. In the first Ni+2.17+ site, Ni+2.17+ is bonded to five S2- atoms to form a mixture of edge and corner-sharing NiS5 trigonal bipyramids. There are a spread of Ni–S bond distances ranging from 2.21–2.32 Å. In the second Ni+2.17+ site, Ni+2.17+ is bonded to five S2- atoms to form a mixture of edge and corner-sharing NiS5 trigonal bipyramids. There are a spread of Ni–S bond distances ranging from 2.21–2.32 Å. In the third Ni+2.17+ site, Ni+2.17+ is bonded to five S2- atoms to form a mixture of edge and corner-sharing NiS5 trigonal bipyramids. There are a spread of Ni–S bond distances ranging from 2.21–2.32 Å. In the fourth Ni+2.17+ site, Ni+2.17+ is bonded to five S2- atoms to form a mixture of edge and corner-sharing NiS5 trigonal bipyramids. There are a spread of Ni–S bond distances ranging from 2.21–2.32 Å. In the fifth Ni+2.17+ site, Ni+2.17+ is bonded to five S2- atoms to form a mixture of edge and corner-sharing NiS5 trigonal bipyramids. There are a spread of Ni–S bond distances ranging from 2.21–2.32 Å. In the sixth Ni+2.17+ site, Ni+2.17+ is bonded to five S2- atoms to form a mixture of edge and corner-sharing NiS5 trigonal bipyramids. There are a spread of Ni–S bond distances ranging from 2.21–2.32 Å. There are six inequivalent S2- sites. In the first S2- site, S2- is bonded in a 5-coordinate geometry to one Eu3+ and four Ni+2.17+ atoms. In the second S2- site, S2- is bonded in a 5-coordinate geometry to one Eu3+ and four Ni+2.17+ atoms. In the third S2- site, S2- is bonded in a 4-coordinate geometry to one Eu3+ and three Ni+2.17+ atoms. In the fourth S2- site, S2- is bonded in a 5-coordinate geometry to one Eu3+ and four Ni+2.17+ atoms. In the fifth S2- site, S2- is bonded in a 5-coordinate geometry to one Eu3+ and four Ni+2.17+ atoms. In the sixth S2- site, S2- is bonded in a 5-coordinate geometry to one Eu3+ and four Ni+2.17+ atoms.},
doi = {10.17188/1284878},
journal = {},
number = ,
volume = ,
place = {United States},
year = {Wed Jul 15 00:00:00 EDT 2020},
month = {Wed Jul 15 00:00:00 EDT 2020}
}