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Title: Materials Data on Sr2ZnP2 by Materials Project

Abstract

Sr2ZnP2 crystallizes in the hexagonal P-6m2 space group. The structure is three-dimensional. Sr2+ is bonded to six P3- atoms to form a mixture of distorted edge, face, and corner-sharing SrP6 octahedra. The corner-sharing octahedra tilt angles range from 41–48°. There are three shorter (2.99 Å) and three longer (3.50 Å) Sr–P bond lengths. Zn2+ is bonded in a trigonal planar geometry to three equivalent P3- atoms. All Zn–P bond lengths are 2.45 Å. There are two inequivalent P3- sites. In the first P3- site, P3- is bonded to six equivalent Sr2+ atoms to form distorted edge-sharing PSr6 pentagonal pyramids. In the second P3- site, P3- is bonded in a distorted trigonal planar geometry to six equivalent Sr2+ and three equivalent Zn2+ atoms.

Publication Date:
Other Number(s):
mp-1218384
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; Sr2ZnP2; P-Sr-Zn
OSTI Identifier:
1746677
DOI:
https://doi.org/10.17188/1746677

Citation Formats

The Materials Project. Materials Data on Sr2ZnP2 by Materials Project. United States: N. p., 2020. Web. doi:10.17188/1746677.
The Materials Project. Materials Data on Sr2ZnP2 by Materials Project. United States. doi:https://doi.org/10.17188/1746677
The Materials Project. 2020. "Materials Data on Sr2ZnP2 by Materials Project". United States. doi:https://doi.org/10.17188/1746677. https://www.osti.gov/servlets/purl/1746677. Pub date:Sun May 03 00:00:00 EDT 2020
@article{osti_1746677,
title = {Materials Data on Sr2ZnP2 by Materials Project},
author = {The Materials Project},
abstractNote = {Sr2ZnP2 crystallizes in the hexagonal P-6m2 space group. The structure is three-dimensional. Sr2+ is bonded to six P3- atoms to form a mixture of distorted edge, face, and corner-sharing SrP6 octahedra. The corner-sharing octahedra tilt angles range from 41–48°. There are three shorter (2.99 Å) and three longer (3.50 Å) Sr–P bond lengths. Zn2+ is bonded in a trigonal planar geometry to three equivalent P3- atoms. All Zn–P bond lengths are 2.45 Å. There are two inequivalent P3- sites. In the first P3- site, P3- is bonded to six equivalent Sr2+ atoms to form distorted edge-sharing PSr6 pentagonal pyramids. In the second P3- site, P3- is bonded in a distorted trigonal planar geometry to six equivalent Sr2+ and three equivalent Zn2+ atoms.},
doi = {10.17188/1746677},
journal = {},
number = ,
volume = ,
place = {United States},
year = {2020},
month = {5}
}