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Title: Materials Data on Na3Ti by Materials Project

Abstract

Na3Ti is Uranium Silicide structured and crystallizes in the cubic Pm-3m space group. The structure is three-dimensional. Na is bonded to eight equivalent Na and four equivalent Ti atoms to form distorted NaNa8Ti4 cuboctahedra that share corners with twelve equivalent NaNa8Ti4 cuboctahedra, edges with eight equivalent TiNa12 cuboctahedra, edges with sixteen equivalent NaNa8Ti4 cuboctahedra, faces with four equivalent TiNa12 cuboctahedra, and faces with fourteen equivalent NaNa8Ti4 cuboctahedra. All Na–Na bond lengths are 3.47 Å. All Na–Ti bond lengths are 3.47 Å. Ti is bonded to twelve equivalent Na atoms to form TiNa12 cuboctahedra that share corners with twelve equivalent TiNa12 cuboctahedra, edges with twenty-four equivalent NaNa8Ti4 cuboctahedra, faces with six equivalent TiNa12 cuboctahedra, and faces with twelve equivalent NaNa8Ti4 cuboctahedra.

Authors:
Publication Date:
Other Number(s):
mp-1186007
DOE Contract Number:  
AC02-05CH11231; EDCBEE
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)
Collaborations:
MIT; UC Berkeley; Duke; U Louvain
Subject:
36 MATERIALS SCIENCE
Keywords:
crystal structure; Na3Ti; Na-Ti
OSTI Identifier:
1676235
DOI:
https://doi.org/10.17188/1676235

Citation Formats

The Materials Project. Materials Data on Na3Ti by Materials Project. United States: N. p., 2020. Web. doi:10.17188/1676235.
The Materials Project. Materials Data on Na3Ti by Materials Project. United States. doi:https://doi.org/10.17188/1676235
The Materials Project. 2020. "Materials Data on Na3Ti by Materials Project". United States. doi:https://doi.org/10.17188/1676235. https://www.osti.gov/servlets/purl/1676235. Pub date:Sun May 03 00:00:00 EDT 2020
@article{osti_1676235,
title = {Materials Data on Na3Ti by Materials Project},
author = {The Materials Project},
abstractNote = {Na3Ti is Uranium Silicide structured and crystallizes in the cubic Pm-3m space group. The structure is three-dimensional. Na is bonded to eight equivalent Na and four equivalent Ti atoms to form distorted NaNa8Ti4 cuboctahedra that share corners with twelve equivalent NaNa8Ti4 cuboctahedra, edges with eight equivalent TiNa12 cuboctahedra, edges with sixteen equivalent NaNa8Ti4 cuboctahedra, faces with four equivalent TiNa12 cuboctahedra, and faces with fourteen equivalent NaNa8Ti4 cuboctahedra. All Na–Na bond lengths are 3.47 Å. All Na–Ti bond lengths are 3.47 Å. Ti is bonded to twelve equivalent Na atoms to form TiNa12 cuboctahedra that share corners with twelve equivalent TiNa12 cuboctahedra, edges with twenty-four equivalent NaNa8Ti4 cuboctahedra, faces with six equivalent TiNa12 cuboctahedra, and faces with twelve equivalent NaNa8Ti4 cuboctahedra.},
doi = {10.17188/1676235},
journal = {},
number = ,
volume = ,
place = {United States},
year = {2020},
month = {5}
}