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Title: Materials Data on RbTaO3 by Materials Project

Abstract

RbTaO3 is (Cubic) Perovskite structured and crystallizes in the cubic Pm-3m space group. The structure is three-dimensional. Rb1+ is bonded to twelve equivalent O2- atoms to form RbO12 cuboctahedra that share corners with twelve equivalent RbO12 cuboctahedra, faces with six equivalent RbO12 cuboctahedra, and faces with eight equivalent TaO6 octahedra. All Rb–O bond lengths are 2.88 Å. Ta5+ is bonded to six equivalent O2- atoms to form TaO6 octahedra that share corners with six equivalent TaO6 octahedra and faces with eight equivalent RbO12 cuboctahedra. The corner-sharing octahedral tilt angles are 0°. All Ta–O bond lengths are 2.04 Å. O2- is bonded in a distorted linear geometry to four equivalent Rb1+ and two equivalent Ta5+ atoms.

Publication Date:
Other Number(s):
mp-1076534
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; RbTaO3; O-Rb-Ta
OSTI Identifier:
1475776
DOI:
10.17188/1475776

Citation Formats

The Materials Project. Materials Data on RbTaO3 by Materials Project. United States: N. p., 2020. Web. doi:10.17188/1475776.
The Materials Project. Materials Data on RbTaO3 by Materials Project. United States. doi:10.17188/1475776.
The Materials Project. 2020. "Materials Data on RbTaO3 by Materials Project". United States. doi:10.17188/1475776. https://www.osti.gov/servlets/purl/1475776. Pub date:Thu Jul 23 00:00:00 EDT 2020
@article{osti_1475776,
title = {Materials Data on RbTaO3 by Materials Project},
author = {The Materials Project},
abstractNote = {RbTaO3 is (Cubic) Perovskite structured and crystallizes in the cubic Pm-3m space group. The structure is three-dimensional. Rb1+ is bonded to twelve equivalent O2- atoms to form RbO12 cuboctahedra that share corners with twelve equivalent RbO12 cuboctahedra, faces with six equivalent RbO12 cuboctahedra, and faces with eight equivalent TaO6 octahedra. All Rb–O bond lengths are 2.88 Å. Ta5+ is bonded to six equivalent O2- atoms to form TaO6 octahedra that share corners with six equivalent TaO6 octahedra and faces with eight equivalent RbO12 cuboctahedra. The corner-sharing octahedral tilt angles are 0°. All Ta–O bond lengths are 2.04 Å. O2- is bonded in a distorted linear geometry to four equivalent Rb1+ and two equivalent Ta5+ atoms.},
doi = {10.17188/1475776},
journal = {},
number = ,
volume = ,
place = {United States},
year = {2020},
month = {7}
}

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