Materials Data on NdNiSnH by Materials Project
Abstract
NdNiSnH crystallizes in the orthorhombic Pnma space group. The structure is three-dimensional. Nd is bonded in a 3-coordinate geometry to six equivalent Sn and three equivalent H atoms. There are a spread of Nd–Sn bond distances ranging from 3.25–3.39 Å. There are one shorter (2.31 Å) and two longer (2.43 Å) Nd–H bond lengths. Ni is bonded in a single-bond geometry to four equivalent Sn and one H atom. There are a spread of Ni–Sn bond distances ranging from 2.65–2.94 Å. The Ni–H bond length is 1.60 Å. Sn is bonded in a 12-coordinate geometry to six equivalent Nd and four equivalent Ni atoms. H is bonded to three equivalent Nd and one Ni atom to form a mixture of edge and corner-sharing HNd3Ni tetrahedra.
- Publication Date:
- Other Number(s):
- mp-510580
- DOE Contract Number:
- AC02-05CH11231;
- Research Org.:
- LBNL Materials Project; Lawrence Berkeley National Laboratory (LBNL), Berkeley, CA (United States)
- Sponsoring Org.:
- USDOE Office of Science (SC), Basic Energy Sciences (BES) (SC-22)
- Collaborations:
- The Materials Project; MIT; UC Berkeley; Duke; U Louvain
- Subject:
- 36 MATERIALS SCIENCE; crystal structure; H-Nd-Ni-Sn; NdNiSnH
- OSTI Identifier:
- 1263013
- DOI:
- https://doi.org/10.17188/1263013
Citation Formats
Materials Data on NdNiSnH by Materials Project. United States: N. p., 2020.
Web. doi:10.17188/1263013.
Materials Data on NdNiSnH by Materials Project. United States. doi:https://doi.org/10.17188/1263013
2020.
"Materials Data on NdNiSnH by Materials Project". United States. doi:https://doi.org/10.17188/1263013. https://www.osti.gov/servlets/purl/1263013. Pub date:Fri May 01 20:00:00 EDT 2020
@article{osti_1263013,
title = {Materials Data on NdNiSnH by Materials Project},
abstractNote = {NdNiSnH crystallizes in the orthorhombic Pnma space group. The structure is three-dimensional. Nd is bonded in a 3-coordinate geometry to six equivalent Sn and three equivalent H atoms. There are a spread of Nd–Sn bond distances ranging from 3.25–3.39 Å. There are one shorter (2.31 Å) and two longer (2.43 Å) Nd–H bond lengths. Ni is bonded in a single-bond geometry to four equivalent Sn and one H atom. There are a spread of Ni–Sn bond distances ranging from 2.65–2.94 Å. The Ni–H bond length is 1.60 Å. Sn is bonded in a 12-coordinate geometry to six equivalent Nd and four equivalent Ni atoms. H is bonded to three equivalent Nd and one Ni atom to form a mixture of edge and corner-sharing HNd3Ni tetrahedra.},
doi = {10.17188/1263013},
journal = {},
number = ,
volume = ,
place = {United States},
year = {2020},
month = {5}
}
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