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Title: Materials Data on Mg3TiH8 by Materials Project

Abstract

Mg3TiH8 is Fluorite-derived structured and crystallizes in the cubic Pm-3m space group. The structure is three-dimensional. Mg2+ is bonded in a body-centered cubic geometry to eight equivalent H1- atoms. All Mg–H bond lengths are 2.02 Å. Ti2+ is bonded in a body-centered cubic geometry to eight equivalent H1- atoms. All Ti–H bond lengths are 1.95 Å. H1- is bonded to three equivalent Mg2+ and one Ti2+ atom to form a mixture of edge and corner-sharing HMg3Ti tetrahedra.

Publication Date:
Other Number(s):
mp-1101846
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; Mg3TiH8; H-Mg-Ti
OSTI Identifier:
1757484
DOI:
https://doi.org/10.17188/1757484

Citation Formats

The Materials Project. Materials Data on Mg3TiH8 by Materials Project. United States: N. p., 2020. Web. doi:10.17188/1757484.
The Materials Project. Materials Data on Mg3TiH8 by Materials Project. United States. doi:https://doi.org/10.17188/1757484
The Materials Project. 2020. "Materials Data on Mg3TiH8 by Materials Project". United States. doi:https://doi.org/10.17188/1757484. https://www.osti.gov/servlets/purl/1757484. Pub date:Thu Sep 03 00:00:00 EDT 2020
@article{osti_1757484,
title = {Materials Data on Mg3TiH8 by Materials Project},
author = {The Materials Project},
abstractNote = {Mg3TiH8 is Fluorite-derived structured and crystallizes in the cubic Pm-3m space group. The structure is three-dimensional. Mg2+ is bonded in a body-centered cubic geometry to eight equivalent H1- atoms. All Mg–H bond lengths are 2.02 Å. Ti2+ is bonded in a body-centered cubic geometry to eight equivalent H1- atoms. All Ti–H bond lengths are 1.95 Å. H1- is bonded to three equivalent Mg2+ and one Ti2+ atom to form a mixture of edge and corner-sharing HMg3Ti tetrahedra.},
doi = {10.17188/1757484},
journal = {},
number = ,
volume = ,
place = {United States},
year = {2020},
month = {9}
}