Materials Data on La2(Ga3Ru)3 by Materials Project
La2(RuGa3)3 crystallizes in the orthorhombic Cmcm space group. The structure is three-dimensional. La is bonded in a 11-coordinate geometry to eleven Ga atoms. There are a spread of La–Ga bond distances ranging from 3.12–3.21 Å. There are two inequivalent Ru sites. In the first Ru site, Ru is bonded in a 8-coordinate geometry to eight Ga atoms. There are a spread of Ru–Ga bond distances ranging from 2.62–2.70 Å. In the second Ru site, Ru is bonded in a 8-coordinate geometry to eight Ga atoms. There are a spread of Ru–Ga bond distances ranging from 2.62–2.69 Å. There are four inequivalent Ga sites. In the first Ga site, Ga is bonded in a 10-coordinate geometry to two equivalent La, two equivalent Ru, and six Ga atoms. There are two shorter (2.73 Å) and four longer (2.81 Å) Ga–Ga bond lengths. In the second Ga site, Ga is bonded in a 3-coordinate geometry to three equivalent La, three Ru, and five Ga atoms. There are a spread of Ga–Ga bond distances ranging from 2.79–3.00 Å. In the third Ga site, Ga is bonded in a 3-coordinate geometry to two equivalent La, three Ru, and five Ga atoms. There are one shorter (2.69 Å) and two longer (2.93 Å) Ga–Ga bond lengths. In the fourth Ga site, Ga is bonded in a 10-coordinate geometry to two equivalent La, two equivalent Ru, and six Ga atoms. The Ga–Ga bond length is 2.71 Å.
- Research Organization:
- LBNL Materials Project; Lawrence Berkeley National Laboratory (LBNL), Berkeley, CA (United States)
- Sponsoring Organization:
- USDOE Office of Science (SC), Basic Energy Sciences (BES) (SC-22)
- Contributing Organization:
- The Materials Project; MIT; UC Berkeley; Duke; U Louvain
- DOE Contract Number:
- AC02-05CH11231
- OSTI ID:
- 1736428
- Report Number(s):
- mp-1211948
- Country of Publication:
- United States
- Language:
- English
Similar Records
Materials Data on Pr2(Ga3Ru)3 by Materials Project
Materials Data on Tb2(Ga3Ru)3 by Materials Project
Materials Data on Dy2(Ga3Ru)3 by Materials Project
Dataset
·
Sat May 02 00:00:00 EDT 2020
·
OSTI ID:1752590
Materials Data on Tb2(Ga3Ru)3 by Materials Project
Dataset
·
Thu Sep 03 00:00:00 EDT 2020
·
OSTI ID:1757559
Materials Data on Dy2(Ga3Ru)3 by Materials Project
Dataset
·
Sat Jul 18 00:00:00 EDT 2020
·
OSTI ID:1198835