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Title: Materials Data on LiSn(H2N)3 by Materials Project

Abstract

LiSn(NH2)3 crystallizes in the monoclinic P2_1/c space group. The structure is two-dimensional and consists of one LiSn(NH2)3 sheet oriented in the (1, 0, 0) direction. Li1+ is bonded in a 4-coordinate geometry to four N3- atoms. There are a spread of Li–N bond distances ranging from 2.05–2.44 Å. Sn2+ is bonded in a distorted T-shaped geometry to three N3- atoms. There are a spread of Sn–N bond distances ranging from 2.18–2.22 Å. There are three inequivalent N3- sites. In the first N3- site, N3- is bonded in a distorted water-like geometry to two equivalent Li1+, one Sn2+, and two H1+ atoms. There is one shorter (1.02 Å) and one longer (1.03 Å) N–H bond length. In the second N3- site, N3- is bonded in a distorted water-like geometry to one Li1+, one Sn2+, and two H1+ atoms. There is one shorter (1.02 Å) and one longer (1.03 Å) N–H bond length. In the third N3- site, N3- is bonded in a distorted tetrahedral geometry to one Li1+, one Sn2+, and two H1+ atoms. Both N–H bond lengths are 1.02 Å. There are six inequivalent H1+ sites. In the first H1+ site, H1+ is bonded in a single-bond geometry to onemore » N3- atom. In the second H1+ site, H1+ is bonded in a single-bond geometry to one N3- atom. In the third H1+ site, H1+ is bonded in a single-bond geometry to one N3- atom. In the fourth H1+ site, H1+ is bonded in a single-bond geometry to one N3- atom. In the fifth H1+ site, H1+ is bonded in a single-bond geometry to one N3- atom. In the sixth H1+ site, H1+ is bonded in a single-bond geometry to one N3- atom.« less

Authors:
Publication Date:
Other Number(s):
mp-1197059
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; LiSn(H2N)3; H-Li-N-Sn
OSTI Identifier:
1687352
DOI:
https://doi.org/10.17188/1687352

Citation Formats

The Materials Project. Materials Data on LiSn(H2N)3 by Materials Project. United States: N. p., 2019. Web. doi:10.17188/1687352.
The Materials Project. Materials Data on LiSn(H2N)3 by Materials Project. United States. doi:https://doi.org/10.17188/1687352
The Materials Project. 2019. "Materials Data on LiSn(H2N)3 by Materials Project". United States. doi:https://doi.org/10.17188/1687352. https://www.osti.gov/servlets/purl/1687352. Pub date:Sat Jan 12 00:00:00 EST 2019
@article{osti_1687352,
title = {Materials Data on LiSn(H2N)3 by Materials Project},
author = {The Materials Project},
abstractNote = {LiSn(NH2)3 crystallizes in the monoclinic P2_1/c space group. The structure is two-dimensional and consists of one LiSn(NH2)3 sheet oriented in the (1, 0, 0) direction. Li1+ is bonded in a 4-coordinate geometry to four N3- atoms. There are a spread of Li–N bond distances ranging from 2.05–2.44 Å. Sn2+ is bonded in a distorted T-shaped geometry to three N3- atoms. There are a spread of Sn–N bond distances ranging from 2.18–2.22 Å. There are three inequivalent N3- sites. In the first N3- site, N3- is bonded in a distorted water-like geometry to two equivalent Li1+, one Sn2+, and two H1+ atoms. There is one shorter (1.02 Å) and one longer (1.03 Å) N–H bond length. In the second N3- site, N3- is bonded in a distorted water-like geometry to one Li1+, one Sn2+, and two H1+ atoms. There is one shorter (1.02 Å) and one longer (1.03 Å) N–H bond length. In the third N3- site, N3- is bonded in a distorted tetrahedral geometry to one Li1+, one Sn2+, and two H1+ atoms. Both N–H bond lengths are 1.02 Å. There are six inequivalent H1+ sites. In the first H1+ site, H1+ is bonded in a single-bond geometry to one N3- atom. In the second H1+ site, H1+ is bonded in a single-bond geometry to one N3- atom. In the third H1+ site, H1+ is bonded in a single-bond geometry to one N3- atom. In the fourth H1+ site, H1+ is bonded in a single-bond geometry to one N3- atom. In the fifth H1+ site, H1+ is bonded in a single-bond geometry to one N3- atom. In the sixth H1+ site, H1+ is bonded in a single-bond geometry to one N3- atom.},
doi = {10.17188/1687352},
journal = {},
number = ,
volume = ,
place = {United States},
year = {2019},
month = {1}
}