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

Title: Materials Data on P2Ru by Materials Project

Abstract

RuP2 is zeta iron carbide structured and crystallizes in the orthorhombic Pnnm space group. The structure is three-dimensional. Ru6+ is bonded to six equivalent P3- atoms to form RuP6 octahedra that share corners with eight equivalent RuP6 octahedra, corners with six equivalent PPRu3 tetrahedra, and edges with two equivalent RuP6 octahedra. The corner-sharing octahedral tilt angles are 56°. There are two shorter (2.36 Å) and four longer (2.39 Å) Ru–P bond lengths. P3- is bonded to three equivalent Ru6+ and one P3- atom to form PPRu3 tetrahedra that share corners with three equivalent RuP6 octahedra, corners with thirteen equivalent PPRu3 tetrahedra, and an edgeedge with one PPRu3 tetrahedra. The corner-sharing octahedra tilt angles range from 68–71°. The P–P bond length is 2.25 Å.

Publication Date:
Other Number(s):
mp-1413
DOE Contract Number:  
AC02-05CH11231; EDCBEE
Product Type:
Dataset
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)
Subject:
36 MATERIALS SCIENCE
Keywords:
crystal structure; P2Ru; P-Ru
OSTI Identifier:
1190179
DOI:
10.17188/1190179

Citation Formats

The Materials Project. Materials Data on P2Ru by Materials Project. United States: N. p., 2020. Web. doi:10.17188/1190179.
The Materials Project. Materials Data on P2Ru by Materials Project. United States. doi:10.17188/1190179.
The Materials Project. 2020. "Materials Data on P2Ru by Materials Project". United States. doi:10.17188/1190179. https://www.osti.gov/servlets/purl/1190179. Pub date:Tue Jul 14 00:00:00 EDT 2020
@article{osti_1190179,
title = {Materials Data on P2Ru by Materials Project},
author = {The Materials Project},
abstractNote = {RuP2 is zeta iron carbide structured and crystallizes in the orthorhombic Pnnm space group. The structure is three-dimensional. Ru6+ is bonded to six equivalent P3- atoms to form RuP6 octahedra that share corners with eight equivalent RuP6 octahedra, corners with six equivalent PPRu3 tetrahedra, and edges with two equivalent RuP6 octahedra. The corner-sharing octahedral tilt angles are 56°. There are two shorter (2.36 Å) and four longer (2.39 Å) Ru–P bond lengths. P3- is bonded to three equivalent Ru6+ and one P3- atom to form PPRu3 tetrahedra that share corners with three equivalent RuP6 octahedra, corners with thirteen equivalent PPRu3 tetrahedra, and an edgeedge with one PPRu3 tetrahedra. The corner-sharing octahedra tilt angles range from 68–71°. The P–P bond length is 2.25 Å.},
doi = {10.17188/1190179},
journal = {},
number = ,
volume = ,
place = {United States},
year = {2020},
month = {7}
}

Dataset:

Save / Share: