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Title: Materials Data on Ta2InC by Materials Project

Abstract

Ta2InC is H-Phase structured and crystallizes in the hexagonal P6_3/mmc space group. The structure is three-dimensional. Ta is bonded in a 3-coordinate geometry to three equivalent In and three equivalent C atoms. All Ta–In bond lengths are 3.04 Å. All Ta–C bond lengths are 2.19 Å. In is bonded to six equivalent Ta and six equivalent In atoms to form distorted InTa6In6 cuboctahedra that share corners with six equivalent InTa6In6 cuboctahedra, corners with six equivalent CTa6 octahedra, edges with six equivalent InTa6In6 cuboctahedra, edges with six equivalent CTa6 octahedra, and faces with six equivalent InTa6In6 cuboctahedra. The corner-sharing octahedral tilt angles are 20°. All In–In bond lengths are 3.17 Å. C is bonded to six equivalent Ta atoms to form CTa6 octahedra that share corners with six equivalent InTa6In6 cuboctahedra, edges with six equivalent InTa6In6 cuboctahedra, and edges with six equivalent CTa6 octahedra.

Authors:
Publication Date:
Other Number(s):
mp-22144
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; Ta2InC; C-In-Ta
OSTI Identifier:
1197373
DOI:
https://doi.org/10.17188/1197373

Citation Formats

The Materials Project. Materials Data on Ta2InC by Materials Project. United States: N. p., 2020. Web. doi:10.17188/1197373.
The Materials Project. Materials Data on Ta2InC by Materials Project. United States. doi:https://doi.org/10.17188/1197373
The Materials Project. 2020. "Materials Data on Ta2InC by Materials Project". United States. doi:https://doi.org/10.17188/1197373. https://www.osti.gov/servlets/purl/1197373. Pub date:Thu Jul 23 00:00:00 EDT 2020
@article{osti_1197373,
title = {Materials Data on Ta2InC by Materials Project},
author = {The Materials Project},
abstractNote = {Ta2InC is H-Phase structured and crystallizes in the hexagonal P6_3/mmc space group. The structure is three-dimensional. Ta is bonded in a 3-coordinate geometry to three equivalent In and three equivalent C atoms. All Ta–In bond lengths are 3.04 Å. All Ta–C bond lengths are 2.19 Å. In is bonded to six equivalent Ta and six equivalent In atoms to form distorted InTa6In6 cuboctahedra that share corners with six equivalent InTa6In6 cuboctahedra, corners with six equivalent CTa6 octahedra, edges with six equivalent InTa6In6 cuboctahedra, edges with six equivalent CTa6 octahedra, and faces with six equivalent InTa6In6 cuboctahedra. The corner-sharing octahedral tilt angles are 20°. All In–In bond lengths are 3.17 Å. C is bonded to six equivalent Ta atoms to form CTa6 octahedra that share corners with six equivalent InTa6In6 cuboctahedra, edges with six equivalent InTa6In6 cuboctahedra, and edges with six equivalent CTa6 octahedra.},
doi = {10.17188/1197373},
journal = {},
number = ,
volume = ,
place = {United States},
year = {2020},
month = {7}
}