U.S. Department of EnergyOffice of Scientific and Technical Information
Materials Data on NaZnP by Materials Project
Abstract
NaZnP is Matlockite structured and crystallizes in the tetragonal P4/nmm space group. The structure is three-dimensional. Na1+ is bonded to five equivalent P3- atoms to form distorted NaP5 trigonal bipyramids that share corners with twelve equivalent ZnP4 tetrahedra, corners with four equivalent NaP5 trigonal bipyramids, edges with four equivalent ZnP4 tetrahedra, and edges with eight equivalent NaP5 trigonal bipyramids. There are one shorter (2.99 Å) and four longer (3.05 Å) Na–P bond lengths. Zn2+ is bonded to four equivalent P3- atoms to form ZnP4 tetrahedra that share corners with four equivalent ZnP4 tetrahedra, corners with twelve equivalent NaP5 trigonal bipyramids, edges with four equivalent ZnP4 tetrahedra, and edges with four equivalent NaP5 trigonal bipyramids. All Zn–P bond lengths are 2.51 Å. P3- is bonded in a 9-coordinate geometry to five equivalent Na1+ and four equivalent Zn2+ atoms.
- Publication Date:
- Other Number(s):
- mp-4824
- 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; Na-P-Zn; NaZnP; crystal structure
- OSTI Identifier:
- 1208427
- DOI:
- https://doi.org/10.17188/1208427
Citation Formats
Materials Data on NaZnP by Materials Project. United States: N. p., 2020.
Web. doi:10.17188/1208427.
Materials Data on NaZnP by Materials Project. United States. doi:https://doi.org/10.17188/1208427
2020.
"Materials Data on NaZnP by Materials Project". United States. doi:https://doi.org/10.17188/1208427. https://www.osti.gov/servlets/purl/1208427. Pub date:Thu Jul 16 00:00:00 EDT 2020
@article{osti_1208427,
title = {Materials Data on NaZnP by Materials Project},
abstractNote = {NaZnP is Matlockite structured and crystallizes in the tetragonal P4/nmm space group. The structure is three-dimensional. Na1+ is bonded to five equivalent P3- atoms to form distorted NaP5 trigonal bipyramids that share corners with twelve equivalent ZnP4 tetrahedra, corners with four equivalent NaP5 trigonal bipyramids, edges with four equivalent ZnP4 tetrahedra, and edges with eight equivalent NaP5 trigonal bipyramids. There are one shorter (2.99 Å) and four longer (3.05 Å) Na–P bond lengths. Zn2+ is bonded to four equivalent P3- atoms to form ZnP4 tetrahedra that share corners with four equivalent ZnP4 tetrahedra, corners with twelve equivalent NaP5 trigonal bipyramids, edges with four equivalent ZnP4 tetrahedra, and edges with four equivalent NaP5 trigonal bipyramids. All Zn–P bond lengths are 2.51 Å. P3- is bonded in a 9-coordinate geometry to five equivalent Na1+ and four equivalent Zn2+ atoms.},
doi = {10.17188/1208427},
journal = {},
number = ,
volume = ,
place = {United States},
year = {2020},
month = {7}
}