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Title: Materials Data on Y12Ni6Pb by Materials Project

Dataset ·
DOI:https://doi.org/10.17188/1277301· OSTI ID:1277301

Y12Ni6Pb crystallizes in the triclinic P1 space group. The structure is three-dimensional. there are twelve inequivalent Y sites. In the first Y site, Y is bonded in a 1-coordinate geometry to four Ni and one Pb atom. There are a spread of Y–Ni bond distances ranging from 2.67–3.51 Å. The Y–Pb bond length is 3.50 Å. In the second Y site, Y is bonded in a 1-coordinate geometry to four Ni and one Pb atom. There are a spread of Y–Ni bond distances ranging from 2.66–3.53 Å. The Y–Pb bond length is 3.51 Å. In the third Y site, Y is bonded in a 1-coordinate geometry to four Ni and one Pb atom. There are a spread of Y–Ni bond distances ranging from 2.67–3.52 Å. The Y–Pb bond length is 3.49 Å. In the fourth Y site, Y is bonded in a 1-coordinate geometry to four Ni and one Pb atom. There are a spread of Y–Ni bond distances ranging from 2.67–3.52 Å. The Y–Pb bond length is 3.52 Å. In the fifth Y site, Y is bonded in a 1-coordinate geometry to four Ni and one Pb atom. There are a spread of Y–Ni bond distances ranging from 2.67–3.51 Å. The Y–Pb bond length is 3.52 Å. In the sixth Y site, Y is bonded in a 1-coordinate geometry to four Ni and one Pb atom. There are a spread of Y–Ni bond distances ranging from 2.67–3.54 Å. The Y–Pb bond length is 3.52 Å. In the seventh Y site, Y is bonded in a 1-coordinate geometry to four Ni and one Pb atom. There are a spread of Y–Ni bond distances ranging from 2.66–3.52 Å. The Y–Pb bond length is 3.50 Å. In the eighth Y site, Y is bonded in a 1-coordinate geometry to four Ni and one Pb atom. There are a spread of Y–Ni bond distances ranging from 2.67–3.54 Å. The Y–Pb bond length is 3.49 Å. In the ninth Y site, Y is bonded in a 1-coordinate geometry to four Ni and one Pb atom. There are a spread of Y–Ni bond distances ranging from 2.67–3.54 Å. The Y–Pb bond length is 3.51 Å. In the tenth Y site, Y is bonded in a 1-coordinate geometry to four Ni and one Pb atom. There are a spread of Y–Ni bond distances ranging from 2.66–3.52 Å. The Y–Pb bond length is 3.50 Å. In the eleventh Y site, Y is bonded in a 1-coordinate geometry to four Ni and one Pb atom. There are a spread of Y–Ni bond distances ranging from 2.67–3.53 Å. The Y–Pb bond length is 3.52 Å. In the twelfth Y site, Y is bonded in a 1-coordinate geometry to four Ni and one Pb atom. There are a spread of Y–Ni bond distances ranging from 2.67–3.51 Å. The Y–Pb bond length is 3.51 Å. There are six inequivalent Ni sites. In the first Ni site, Ni is bonded in a 2-coordinate geometry to eight Y and one Ni atom. The Ni–Ni bond length is 2.38 Å. In the second Ni site, Ni is bonded in a 2-coordinate geometry to eight Y and one Ni atom. The Ni–Ni bond length is 2.38 Å. In the third Ni site, Ni is bonded in a 2-coordinate geometry to eight Y and one Ni atom. In the fourth Ni site, Ni is bonded in a 2-coordinate geometry to eight Y and one Ni atom. In the fifth Ni site, Ni is bonded in a 2-coordinate geometry to eight Y and one Ni atom. The Ni–Ni bond length is 2.39 Å. In the sixth Ni site, Ni is bonded in a 2-coordinate geometry to eight Y and one Ni atom. Pb is bonded in a cuboctahedral geometry to twelve Y atoms.

Research Organization:
Lawrence Berkeley National Lab. (LBNL), Berkeley, CA (United States). LBNL Materials Project
Sponsoring Organization:
USDOE Office of Science (SC), Basic Energy Sciences (BES)
Contributing Organization:
MIT; UC Berkeley; Duke; U Louvain
DOE Contract Number:
AC02-05CH11231; EDCBEE
OSTI ID:
1277301
Report Number(s):
mp-600480
Resource Relation:
Related Information: https://materialsproject.org/citing
Country of Publication:
United States
Language:
English

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