U.S. Department of EnergyOffice of Scientific and Technical Information
Materials Data on GaN5O14 by Materials Project
Abstract
Ga(NO3)4NO2 crystallizes in the tetragonal I-4 space group. The structure is zero-dimensional and consists of two hydroxylamine, n-hydroxy- molecules and two Ga(NO3)4 clusters. In each Ga(NO3)4 cluster, Ga3+ is bonded in a tetrahedral geometry to four equivalent O2- atoms. All Ga–O bond lengths are 1.90 Å. N5+ is bonded in a trigonal planar geometry to three O2- atoms. There are a spread of N–O bond distances ranging from 1.23–1.36 Å. There are three inequivalent O2- sites. In the first O2- site, O2- is bonded in a single-bond geometry to one N5+ atom. In the second O2- site, O2- is bonded in a single-bond geometry to one N5+ atom. In the third O2- site, O2- is bonded in a bent 120 degrees geometry to one Ga3+ and one N5+ atom.
- Publication Date:
- Other Number(s):
- mp-557954
- 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; Ga-N-O; GaN5O14; crystal structure
- OSTI Identifier:
- 1270095
- DOI:
- https://doi.org/10.17188/1270095
Citation Formats
Materials Data on GaN5O14 by Materials Project. United States: N. p., 2020.
Web. doi:10.17188/1270095.
Materials Data on GaN5O14 by Materials Project. United States. doi:https://doi.org/10.17188/1270095
2020.
"Materials Data on GaN5O14 by Materials Project". United States. doi:https://doi.org/10.17188/1270095. https://www.osti.gov/servlets/purl/1270095. Pub date:Fri Jul 17 00:00:00 EDT 2020
@article{osti_1270095,
title = {Materials Data on GaN5O14 by Materials Project},
abstractNote = {Ga(NO3)4NO2 crystallizes in the tetragonal I-4 space group. The structure is zero-dimensional and consists of two hydroxylamine, n-hydroxy- molecules and two Ga(NO3)4 clusters. In each Ga(NO3)4 cluster, Ga3+ is bonded in a tetrahedral geometry to four equivalent O2- atoms. All Ga–O bond lengths are 1.90 Å. N5+ is bonded in a trigonal planar geometry to three O2- atoms. There are a spread of N–O bond distances ranging from 1.23–1.36 Å. There are three inequivalent O2- sites. In the first O2- site, O2- is bonded in a single-bond geometry to one N5+ atom. In the second O2- site, O2- is bonded in a single-bond geometry to one N5+ atom. In the third O2- site, O2- is bonded in a bent 120 degrees geometry to one Ga3+ and one N5+ atom.},
doi = {10.17188/1270095},
journal = {},
number = ,
volume = ,
place = {United States},
year = {2020},
month = {7}
}