DOE Data Explorer title logo U.S. Department of Energy
Office of Scientific and Technical Information

Title: Materials Data on ZrTi by Materials Project

Abstract

TiZr is Tetraauricupride structured and crystallizes in the tetragonal P4/mmm space group. The structure is three-dimensional. Zr is bonded to four equivalent Zr and eight equivalent Ti atoms to form distorted ZrZr4Ti8 cuboctahedra that share corners with twelve equivalent ZrZr4Ti8 cuboctahedra, edges with eight equivalent ZrZr4Ti8 cuboctahedra, edges with sixteen equivalent TiZr8Ti4 cuboctahedra, faces with eight equivalent TiZr8Ti4 cuboctahedra, and faces with ten equivalent ZrZr4Ti8 cuboctahedra. All Zr–Zr bond lengths are 3.11 Å. All Zr–Ti bond lengths are 3.04 Å. Ti is bonded to eight equivalent Zr and four equivalent Ti atoms to form distorted TiZr8Ti4 cuboctahedra that share corners with twelve equivalent TiZr8Ti4 cuboctahedra, edges with eight equivalent TiZr8Ti4 cuboctahedra, edges with sixteen equivalent ZrZr4Ti8 cuboctahedra, faces with eight equivalent ZrZr4Ti8 cuboctahedra, and faces with ten equivalent TiZr8Ti4 cuboctahedra. All Ti–Ti bond lengths are 3.11 Å.

Authors:
Publication Date:
Other Number(s):
mp-1215236
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; ZrTi; Ti-Zr
OSTI Identifier:
1742150
DOI:
https://doi.org/10.17188/1742150

Citation Formats

The Materials Project. Materials Data on ZrTi by Materials Project. United States: N. p., 2020. Web. doi:10.17188/1742150.
The Materials Project. Materials Data on ZrTi by Materials Project. United States. doi:https://doi.org/10.17188/1742150
The Materials Project. 2020. "Materials Data on ZrTi by Materials Project". United States. doi:https://doi.org/10.17188/1742150. https://www.osti.gov/servlets/purl/1742150. Pub date:Sat May 02 00:00:00 EDT 2020
@article{osti_1742150,
title = {Materials Data on ZrTi by Materials Project},
author = {The Materials Project},
abstractNote = {TiZr is Tetraauricupride structured and crystallizes in the tetragonal P4/mmm space group. The structure is three-dimensional. Zr is bonded to four equivalent Zr and eight equivalent Ti atoms to form distorted ZrZr4Ti8 cuboctahedra that share corners with twelve equivalent ZrZr4Ti8 cuboctahedra, edges with eight equivalent ZrZr4Ti8 cuboctahedra, edges with sixteen equivalent TiZr8Ti4 cuboctahedra, faces with eight equivalent TiZr8Ti4 cuboctahedra, and faces with ten equivalent ZrZr4Ti8 cuboctahedra. All Zr–Zr bond lengths are 3.11 Å. All Zr–Ti bond lengths are 3.04 Å. Ti is bonded to eight equivalent Zr and four equivalent Ti atoms to form distorted TiZr8Ti4 cuboctahedra that share corners with twelve equivalent TiZr8Ti4 cuboctahedra, edges with eight equivalent TiZr8Ti4 cuboctahedra, edges with sixteen equivalent ZrZr4Ti8 cuboctahedra, faces with eight equivalent ZrZr4Ti8 cuboctahedra, and faces with ten equivalent TiZr8Ti4 cuboctahedra. All Ti–Ti bond lengths are 3.11 Å.},
doi = {10.17188/1742150},
journal = {},
number = ,
volume = ,
place = {United States},
year = {2020},
month = {5}
}