U.S. Department of EnergyOffice of Scientific and Technical Information
Materials Data on Tb4(Al8Pt3)3 by Materials Project
Abstract
Tb4(Pt3Al8)3 crystallizes in the triclinic P-1 space group. The structure is three-dimensional. there are two inequivalent Tb sites. In the first Tb site, Tb is bonded in a 12-coordinate geometry to six Pt and eleven Al atoms. There are a spread of Tb–Pt bond distances ranging from 3.30–3.55 Å. There are a spread of Tb–Al bond distances ranging from 3.08–3.24 Å. In the second Tb site, Tb is bonded in a 9-coordinate geometry to six Pt and eleven Al atoms. There are a spread of Tb–Pt bond distances ranging from 3.30–3.55 Å. There are a spread of Tb–Al bond distances ranging from 3.08–3.23 Å. There are five inequivalent Pt sites. In the first Pt site, Pt is bonded in a 8-coordinate geometry to two Tb and eight Al atoms. There are a spread of Pt–Al bond distances ranging from 2.53–2.75 Å. In the second Pt site, Pt is bonded in a 8-coordinate geometry to two Tb and eight Al atoms. There are a spread of Pt–Al bond distances ranging from 2.53–2.76 Å. In the third Pt site, Pt is bonded in a 8-coordinate geometry to four Tb and eight Al atoms. There are a spread of Pt–Al bond distances rangingmore »
- Publication Date:
- Other Number(s):
- mp-1208449
- DOE Contract Number:
- AC02-05CH11231
- Research Org.:
- LBNL Materials Project; Lawrence Berkeley National Laboratory (LBNL), Berkeley, CA (United States)
- Sponsoring Org.:
- USDOE Office of Science (SC), Basic Energy Sciences (BES) (SC-22)
- Collaborations:
- The Materials Project; MIT; UC Berkeley; Duke; U Louvain
- Subject:
- 36 MATERIALS SCIENCE; Al-Pt-Tb; Tb4(Al8Pt3)3; crystal structure
- OSTI Identifier:
- 1683186
- DOI:
- https://doi.org/10.17188/1683186
Citation Formats
Materials Data on Tb4(Al8Pt3)3 by Materials Project. United States: N. p., 2019.
Web. doi:10.17188/1683186.
Materials Data on Tb4(Al8Pt3)3 by Materials Project. United States. doi:https://doi.org/10.17188/1683186
2019.
"Materials Data on Tb4(Al8Pt3)3 by Materials Project". United States. doi:https://doi.org/10.17188/1683186. https://www.osti.gov/servlets/purl/1683186. Pub date:Fri Jan 11 23:00:00 EST 2019
@article{osti_1683186,
title = {Materials Data on Tb4(Al8Pt3)3 by Materials Project},
abstractNote = {Tb4(Pt3Al8)3 crystallizes in the triclinic P-1 space group. The structure is three-dimensional. there are two inequivalent Tb sites. In the first Tb site, Tb is bonded in a 12-coordinate geometry to six Pt and eleven Al atoms. There are a spread of Tb–Pt bond distances ranging from 3.30–3.55 Å. There are a spread of Tb–Al bond distances ranging from 3.08–3.24 Å. In the second Tb site, Tb is bonded in a 9-coordinate geometry to six Pt and eleven Al atoms. There are a spread of Tb–Pt bond distances ranging from 3.30–3.55 Å. There are a spread of Tb–Al bond distances ranging from 3.08–3.23 Å. There are five inequivalent Pt sites. In the first Pt site, Pt is bonded in a 8-coordinate geometry to two Tb and eight Al atoms. There are a spread of Pt–Al bond distances ranging from 2.53–2.75 Å. In the second Pt site, Pt is bonded in a 8-coordinate geometry to two Tb and eight Al atoms. There are a spread of Pt–Al bond distances ranging from 2.53–2.76 Å. In the third Pt site, Pt is bonded in a 8-coordinate geometry to four Tb and eight Al atoms. There are a spread of Pt–Al bond distances ranging from 2.58–2.62 Å. In the fourth Pt site, Pt is bonded in a 10-coordinate geometry to two Tb and eight Al atoms. There are a spread of Pt–Al bond distances ranging from 2.53–2.76 Å. In the fifth Pt site, Pt is bonded in a 8-coordinate geometry to four Tb and eight Al atoms. There are a spread of Pt–Al bond distances ranging from 2.55–2.64 Å. There are twelve inequivalent Al sites. In the first Al site, Al is bonded in a 3-coordinate geometry to three Tb and three Pt atoms. In the second Al site, Al is bonded to four Pt atoms to form distorted AlPt4 tetrahedra that share corners with six AlTbPt4 tetrahedra and edges with three AlPt4 tetrahedra. In the third Al site, Al is bonded to one Tb and four Pt atoms to form a mixture of distorted edge and corner-sharing AlTbPt4 tetrahedra. In the fourth Al site, Al is bonded in a 3-coordinate geometry to two Tb and three Pt atoms. In the fifth Al site, Al is bonded in a 3-coordinate geometry to two Tb and three Pt atoms. In the sixth Al site, Al is bonded in a 3-coordinate geometry to two Tb and three Pt atoms. In the seventh Al site, Al is bonded in a 3-coordinate geometry to three Tb and three Pt atoms. In the eighth Al site, Al is bonded in a 3-coordinate geometry to two Tb and three Pt atoms. In the ninth Al site, Al is bonded to one Tb and four Pt atoms to form a mixture of distorted edge and corner-sharing AlTbPt4 tetrahedra. In the tenth Al site, Al is bonded in a 2-coordinate geometry to two Tb and two Pt atoms. In the eleventh Al site, Al is bonded in a 2-coordinate geometry to two Tb and two Pt atoms. In the twelfth Al site, Al is bonded in a 2-coordinate geometry to two Tb and two Pt atoms.},
doi = {10.17188/1683186},
journal = {},
number = ,
volume = ,
place = {United States},
year = {Fri Jan 11 23:00:00 EST 2019},
month = {Fri Jan 11 23:00:00 EST 2019}
}