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Title: Materials Data on TiNi by Materials Project

Abstract

NiTi is beta-prime cadmium gold structured and crystallizes in the triclinic P-1 space group. The structure is three-dimensional. there are three inequivalent Ti sites. In the first Ti site, Ti is bonded in a 12-coordinate geometry to eight Ni atoms. There are a spread of Ti–Ni bond distances ranging from 2.52–3.05 Å. In the second Ti site, Ti is bonded in a 12-coordinate geometry to seven Ni atoms. There are a spread of Ti–Ni bond distances ranging from 2.56–2.67 Å. In the third Ti site, Ti is bonded in a 12-coordinate geometry to eight Ni atoms. There are a spread of Ti–Ni bond distances ranging from 2.51–3.06 Å. There are three inequivalent Ni sites. In the first Ni site, Ni is bonded in a 12-coordinate geometry to eight Ti and four Ni atoms. There are a spread of Ni–Ni bond distances ranging from 2.68–2.74 Å. In the second Ni site, Ni is bonded in a 12-coordinate geometry to eight Ti and four Ni atoms. There are one shorter (2.62 Å) and three longer (2.74 Å) Ni–Ni bond lengths. In the third Ni site, Ni is bonded in a 12-coordinate geometry to seven Ti and two Ni atoms.

Authors:
Contributors:
Researcher:
Publication Date:
Other Number(s):
mp-640189
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; TiNi; Ni-Ti
OSTI Identifier:
1279910
DOI:
10.17188/1279910

Citation Formats

Persson, Kristin, and Project, Materials. Materials Data on TiNi by Materials Project. United States: N. p., 2020. Web. doi:10.17188/1279910.
Persson, Kristin, & Project, Materials. Materials Data on TiNi by Materials Project. United States. doi:10.17188/1279910.
Persson, Kristin, and Project, Materials. 2020. "Materials Data on TiNi by Materials Project". United States. doi:10.17188/1279910. https://www.osti.gov/servlets/purl/1279910. Pub date:Tue Jul 14 00:00:00 EDT 2020
@article{osti_1279910,
title = {Materials Data on TiNi by Materials Project},
author = {Persson, Kristin and Project, Materials},
abstractNote = {NiTi is beta-prime cadmium gold structured and crystallizes in the triclinic P-1 space group. The structure is three-dimensional. there are three inequivalent Ti sites. In the first Ti site, Ti is bonded in a 12-coordinate geometry to eight Ni atoms. There are a spread of Ti–Ni bond distances ranging from 2.52–3.05 Å. In the second Ti site, Ti is bonded in a 12-coordinate geometry to seven Ni atoms. There are a spread of Ti–Ni bond distances ranging from 2.56–2.67 Å. In the third Ti site, Ti is bonded in a 12-coordinate geometry to eight Ni atoms. There are a spread of Ti–Ni bond distances ranging from 2.51–3.06 Å. There are three inequivalent Ni sites. In the first Ni site, Ni is bonded in a 12-coordinate geometry to eight Ti and four Ni atoms. There are a spread of Ni–Ni bond distances ranging from 2.68–2.74 Å. In the second Ni site, Ni is bonded in a 12-coordinate geometry to eight Ti and four Ni atoms. There are one shorter (2.62 Å) and three longer (2.74 Å) Ni–Ni bond lengths. In the third Ni site, Ni is bonded in a 12-coordinate geometry to seven Ti and two Ni atoms.},
doi = {10.17188/1279910},
journal = {},
number = ,
volume = ,
place = {United States},
year = {2020},
month = {7}
}

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