U.S. Department of EnergyOffice of Scientific and Technical Information
Materials Data on MoRu3 by Materials Project
Abstract
MoRu3 is Magnesium-derived structured and crystallizes in the hexagonal P6_3/mmc space group. The structure is three-dimensional. Mo is bonded to twelve equivalent Ru atoms to form MoRu12 cuboctahedra that share corners with six equivalent MoRu12 cuboctahedra, corners with twelve equivalent RuMo4Ru8 cuboctahedra, edges with eighteen equivalent RuMo4Ru8 cuboctahedra, faces with eight equivalent MoRu12 cuboctahedra, and faces with twelve equivalent RuMo4Ru8 cuboctahedra. There are six shorter (2.71 Å) and six longer (2.76 Å) Mo–Ru bond lengths. Ru is bonded to four equivalent Mo and eight equivalent Ru atoms to form RuMo4Ru8 cuboctahedra that share corners with four equivalent MoRu12 cuboctahedra, corners with fourteen equivalent RuMo4Ru8 cuboctahedra, edges with six equivalent MoRu12 cuboctahedra, edges with twelve equivalent RuMo4Ru8 cuboctahedra, faces with four equivalent MoRu12 cuboctahedra, and faces with sixteen equivalent RuMo4Ru8 cuboctahedra. There are four shorter (2.70 Å) and four longer (2.76 Å) Ru–Ru bond lengths.
- Publication Date:
- Other Number(s):
- mp-975834
- 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; crystal structure; Mo-Ru; MoRu3
- OSTI Identifier:
- 1314893
- DOI:
- https://doi.org/10.17188/1314893
Citation Formats
Materials Data on MoRu3 by Materials Project. United States: N. p., 2017.
Web. doi:10.17188/1314893.
Materials Data on MoRu3 by Materials Project. United States. doi:https://doi.org/10.17188/1314893
2017.
"Materials Data on MoRu3 by Materials Project". United States. doi:https://doi.org/10.17188/1314893. https://www.osti.gov/servlets/purl/1314893. Pub date:Thu May 18 20:00:00 EDT 2017
@article{osti_1314893,
title = {Materials Data on MoRu3 by Materials Project},
abstractNote = {MoRu3 is Magnesium-derived structured and crystallizes in the hexagonal P6_3/mmc space group. The structure is three-dimensional. Mo is bonded to twelve equivalent Ru atoms to form MoRu12 cuboctahedra that share corners with six equivalent MoRu12 cuboctahedra, corners with twelve equivalent RuMo4Ru8 cuboctahedra, edges with eighteen equivalent RuMo4Ru8 cuboctahedra, faces with eight equivalent MoRu12 cuboctahedra, and faces with twelve equivalent RuMo4Ru8 cuboctahedra. There are six shorter (2.71 Å) and six longer (2.76 Å) Mo–Ru bond lengths. Ru is bonded to four equivalent Mo and eight equivalent Ru atoms to form RuMo4Ru8 cuboctahedra that share corners with four equivalent MoRu12 cuboctahedra, corners with fourteen equivalent RuMo4Ru8 cuboctahedra, edges with six equivalent MoRu12 cuboctahedra, edges with twelve equivalent RuMo4Ru8 cuboctahedra, faces with four equivalent MoRu12 cuboctahedra, and faces with sixteen equivalent RuMo4Ru8 cuboctahedra. There are four shorter (2.70 Å) and four longer (2.76 Å) Ru–Ru bond lengths.},
doi = {10.17188/1314893},
journal = {},
number = ,
volume = ,
place = {United States},
year = {2017},
month = {5}
}