DOE Data Explorer title logo U.S. Department of Energy
Office of Scientific and Technical Information

Title: Materials Data on Na3PO4 by Materials Project

Abstract

Na3PO4 crystallizes in the tetragonal I4/mmm space group. The structure is three-dimensional. there are two inequivalent Na1+ sites. In the first Na1+ site, Na1+ is bonded in a square co-planar geometry to four equivalent O2- atoms. All Na–O bond lengths are 2.30 Å. In the second Na1+ site, Na1+ is bonded in a body-centered cubic geometry to eight equivalent O2- atoms. All Na–O bond lengths are 2.56 Å. P5+ is bonded in a square co-planar geometry to four equivalent O2- atoms. All P–O bond lengths are 1.64 Å. O2- is bonded in a 6-coordinate geometry to five Na1+ and one P5+ atom.

Publication Date:
Other Number(s):
mp-1221205
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; Na3PO4; Na-O-P
OSTI Identifier:
1677727
DOI:
https://doi.org/10.17188/1677727

Citation Formats

The Materials Project. Materials Data on Na3PO4 by Materials Project. United States: N. p., 2020. Web. doi:10.17188/1677727.
The Materials Project. Materials Data on Na3PO4 by Materials Project. United States. doi:https://doi.org/10.17188/1677727
The Materials Project. 2020. "Materials Data on Na3PO4 by Materials Project". United States. doi:https://doi.org/10.17188/1677727. https://www.osti.gov/servlets/purl/1677727. Pub date:Sun May 03 00:00:00 EDT 2020
@article{osti_1677727,
title = {Materials Data on Na3PO4 by Materials Project},
author = {The Materials Project},
abstractNote = {Na3PO4 crystallizes in the tetragonal I4/mmm space group. The structure is three-dimensional. there are two inequivalent Na1+ sites. In the first Na1+ site, Na1+ is bonded in a square co-planar geometry to four equivalent O2- atoms. All Na–O bond lengths are 2.30 Å. In the second Na1+ site, Na1+ is bonded in a body-centered cubic geometry to eight equivalent O2- atoms. All Na–O bond lengths are 2.56 Å. P5+ is bonded in a square co-planar geometry to four equivalent O2- atoms. All P–O bond lengths are 1.64 Å. O2- is bonded in a 6-coordinate geometry to five Na1+ and one P5+ atom.},
doi = {10.17188/1677727},
journal = {},
number = ,
volume = ,
place = {United States},
year = {2020},
month = {5}
}