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Title: Materials Data on ZnH6(NO3)2 by Materials Project

Abstract

ZnH4H2(NO3)2 crystallizes in the orthorhombic Pnma space group. The structure is zero-dimensional and consists of four hydrogen molecules, eight nitric acid molecules, and four ZnH4 clusters. In each ZnH4 cluster, Zn2+ is bonded in a square co-planar geometry to four H1+ atoms. There are a spread of Zn–H bond distances ranging from 1.54–1.58 Å. There are three inequivalent H1+ sites. In the first H1+ site, H1+ is bonded in a single-bond geometry to one Zn2+ atom. In the second H1+ site, H1+ is bonded in a single-bond geometry to one Zn2+ atom. In the third H1+ site, H1+ is bonded in a single-bond geometry to one Zn2+ atom.

Publication Date:
Other Number(s):
mp-1207876
DOE Contract Number:  
AC02-05CH11231; EDCBEE
Product Type:
Dataset
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)
Subject:
36 MATERIALS SCIENCE
Keywords:
crystal structure; ZnH6(NO3)2; H-N-O-Zn
OSTI Identifier:
1666466
DOI:
https://doi.org/10.17188/1666466

Citation Formats

The Materials Project. Materials Data on ZnH6(NO3)2 by Materials Project. United States: N. p., 2020. Web. doi:10.17188/1666466.
The Materials Project. Materials Data on ZnH6(NO3)2 by Materials Project. United States. doi:https://doi.org/10.17188/1666466
The Materials Project. 2020. "Materials Data on ZnH6(NO3)2 by Materials Project". United States. doi:https://doi.org/10.17188/1666466. https://www.osti.gov/servlets/purl/1666466. Pub date:Wed Apr 29 00:00:00 EDT 2020
@article{osti_1666466,
title = {Materials Data on ZnH6(NO3)2 by Materials Project},
author = {The Materials Project},
abstractNote = {ZnH4H2(NO3)2 crystallizes in the orthorhombic Pnma space group. The structure is zero-dimensional and consists of four hydrogen molecules, eight nitric acid molecules, and four ZnH4 clusters. In each ZnH4 cluster, Zn2+ is bonded in a square co-planar geometry to four H1+ atoms. There are a spread of Zn–H bond distances ranging from 1.54–1.58 Å. There are three inequivalent H1+ sites. In the first H1+ site, H1+ is bonded in a single-bond geometry to one Zn2+ atom. In the second H1+ site, H1+ is bonded in a single-bond geometry to one Zn2+ atom. In the third H1+ site, H1+ is bonded in a single-bond geometry to one Zn2+ atom.},
doi = {10.17188/1666466},
journal = {},
number = ,
volume = ,
place = {United States},
year = {2020},
month = {4}
}