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Title: Materials Data on Ti5Mn3 by Materials Project

Abstract

Ti5Mn3 crystallizes in the hexagonal P6_3/mcm space group. The structure is three-dimensional. there are two inequivalent Ti sites. In the first Ti site, Ti is bonded in a 8-coordinate geometry to eight Ti and six equivalent Mn atoms. There are two shorter (2.63 Å) and six longer (3.09 Å) Ti–Ti bond lengths. All Ti–Mn bond lengths are 2.56 Å. In the second Ti site, Ti is bonded in a 3-coordinate geometry to ten Ti and five equivalent Mn atoms. There are two shorter (2.96 Å) and four longer (3.14 Å) Ti–Ti bond lengths. There are a spread of Ti–Mn bond distances ranging from 2.49–2.87 Å. Mn is bonded in a 11-coordinate geometry to nine Ti atoms.

Authors:
Publication Date:
Other Number(s):
mp-1208237
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; Ti5Mn3; Mn-Ti
OSTI Identifier:
1688123
DOI:
https://doi.org/10.17188/1688123

Citation Formats

The Materials Project. Materials Data on Ti5Mn3 by Materials Project. United States: N. p., 2019. Web. doi:10.17188/1688123.
The Materials Project. Materials Data on Ti5Mn3 by Materials Project. United States. doi:https://doi.org/10.17188/1688123
The Materials Project. 2019. "Materials Data on Ti5Mn3 by Materials Project". United States. doi:https://doi.org/10.17188/1688123. https://www.osti.gov/servlets/purl/1688123. Pub date:Sat Jan 12 00:00:00 EST 2019
@article{osti_1688123,
title = {Materials Data on Ti5Mn3 by Materials Project},
author = {The Materials Project},
abstractNote = {Ti5Mn3 crystallizes in the hexagonal P6_3/mcm space group. The structure is three-dimensional. there are two inequivalent Ti sites. In the first Ti site, Ti is bonded in a 8-coordinate geometry to eight Ti and six equivalent Mn atoms. There are two shorter (2.63 Å) and six longer (3.09 Å) Ti–Ti bond lengths. All Ti–Mn bond lengths are 2.56 Å. In the second Ti site, Ti is bonded in a 3-coordinate geometry to ten Ti and five equivalent Mn atoms. There are two shorter (2.96 Å) and four longer (3.14 Å) Ti–Ti bond lengths. There are a spread of Ti–Mn bond distances ranging from 2.49–2.87 Å. Mn is bonded in a 11-coordinate geometry to nine Ti atoms.},
doi = {10.17188/1688123},
journal = {},
number = ,
volume = ,
place = {United States},
year = {2019},
month = {1}
}