Materials Data on TbOsO3 by Materials Project

doi:10.17188/1722136

Title: Materials Data on TbOsO3 by Materials Project

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Abstract

TbOsO3 is (Cubic) Perovskite structured and crystallizes in the cubic Pm-3m space group. The structure is three-dimensional. Tb3+ is bonded to twelve equivalent O2- atoms to form TbO12 cuboctahedra that share corners with twelve equivalent TbO12 cuboctahedra, faces with six equivalent TbO12 cuboctahedra, and faces with eight equivalent OsO6 octahedra. All Tb–O bond lengths are 2.80 Å. Os3+ is bonded to six equivalent O2- atoms to form OsO6 octahedra that share corners with six equivalent OsO6 octahedra and faces with eight equivalent TbO12 cuboctahedra. The corner-sharing octahedral tilt angles are 0°. All Os–O bond lengths are 1.98 Å. O2- is bonded to four equivalent Tb3+ and two equivalent Os3+ atoms to form a mixture of distorted edge, face, and corner-sharing OTb4Os2 octahedra. The corner-sharing octahedra tilt angles range from 0–60°.

Authors:: The Materials Project

Publication Date:: 2020-05-03

Other Number(s):: mp-1187359

DOE Contract Number:: AC02-05CH11231; EDCBEE

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)

Collaborations:: MIT; UC Berkeley; Duke; U Louvain

Subject:: 36 MATERIALS SCIENCE

Keywords:: crystal structure; TbOsO3; O-Os-Tb

OSTI Identifier:: 1722136

DOI:: https://doi.org/10.17188/1722136

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                    The Materials Project. Materials Data on TbOsO3 by Materials Project.  United States: N. p., 2020. 
        Web.  doi:10.17188/1722136.

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                    The Materials Project. Materials Data on TbOsO3 by Materials Project.  United States.  doi:https://doi.org/10.17188/1722136

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                    The Materials Project. 2020.  
"Materials Data on TbOsO3 by Materials Project".  United States.  doi:https://doi.org/10.17188/1722136.  https://www.osti.gov/servlets/purl/1722136. Pub date:Sun May 03 00:00:00 EDT 2020

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@article{osti_1722136,

  title        = {Materials Data on TbOsO3 by Materials Project},

  author       = {The Materials Project},

  abstractNote = {TbOsO3 is (Cubic) Perovskite structured and crystallizes in the cubic Pm-3m space group. The structure is three-dimensional. Tb3+ is bonded to twelve equivalent O2- atoms to form TbO12 cuboctahedra that share corners with twelve equivalent TbO12 cuboctahedra, faces with six equivalent TbO12 cuboctahedra, and faces with eight equivalent OsO6 octahedra. All Tb–O bond lengths are 2.80 Å. Os3+ is bonded to six equivalent O2- atoms to form OsO6 octahedra that share corners with six equivalent OsO6 octahedra and faces with eight equivalent TbO12 cuboctahedra. The corner-sharing octahedral tilt angles are 0°. All Os–O bond lengths are 1.98 Å. O2- is bonded to four equivalent Tb3+ and two equivalent Os3+ atoms to form a mixture of distorted edge, face, and corner-sharing OTb4Os2 octahedra. The corner-sharing octahedra tilt angles range from 0–60°.},

  doi          = {10.17188/1722136},

  journal      = {},

  number       = ,

  volume       = ,

  place        = {United States},

  year         = {2020},

  month        = {5}

}

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DOI: https://doi.org/10.17188/1722136

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