Materials Data on Tb2O3 by Materials Project

doi:10.17188/1206448

Title: Materials Data on Tb2O3 by Materials Project

Dataset
Other Related Research

Abstract

Tb2O3 crystallizes in the cubic Pn-3m space group. The structure is three-dimensional. Tb3+ is bonded in a 6-coordinate geometry to six equivalent O2- atoms. All Tb–O bond lengths are 2.33 Å. O2- is bonded to four equivalent Tb3+ atoms to form a mixture of edge and corner-sharing OTb4 tetrahedra.

Publication Date:: Thu Jul 23 04:00:00 UTC 2020

Other Number(s):: mp-32927

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; O-Tb; Tb2O3; crystal structure

OSTI Identifier:: 1206448

DOI:: https://doi.org/10.17188/1206448

Citation Formats


                    Materials Data on Tb2O3 by Materials Project.  United States: N. p., 2020. 
        Web.  doi:10.17188/1206448.

Copy to clipboard


                    Materials Data on Tb2O3 by Materials Project.  United States.  doi:https://doi.org/10.17188/1206448

Copy to clipboard


                    2020.  
"Materials Data on Tb2O3 by Materials Project".  United States.  doi:https://doi.org/10.17188/1206448.  https://www.osti.gov/servlets/purl/1206448. Pub date:Thu Jul 23 04:00:00 UTC 2020

Copy to clipboard


                    
@article{osti_1206448,

  title        = {Materials Data on Tb2O3 by Materials Project},

  
  abstractNote = {Tb2O3 crystallizes in the cubic Pn-3m space group. The structure is three-dimensional. Tb3+ is bonded in a 6-coordinate geometry to six equivalent O2- atoms. All Tb–O bond lengths are 2.33 Å. O2- is bonded to four equivalent Tb3+ atoms to form a mixture of edge and corner-sharing OTb4 tetrahedra.},

  doi          = {10.17188/1206448},

  journal      = {},

  number       = ,

  volume       = ,

  place        = {United States},

  year         = {Thu Jul 23 04:00:00 UTC 2020},

  month        = {Thu Jul 23 04:00:00 UTC 2020}

}

Copy to clipboard

Dataset:

View Dataset

DOI: https://doi.org/10.17188/1206448

Save / Share:

Export Metadata

Save to My Library

Similar records in DOE Data Explorer and OSTI.GOV collections:

Materials Data on Tb2O3 by Materials Project

Dataset

Tb2O3 crystallizes in the monoclinic C2/m space group. The structure is three-dimensional. there are three inequivalent Tb3+ sites. In the first Tb3+ site, Tb3+ is bonded to six O2- atoms to form a mixture of distorted corner and edge-sharing TbO6 octahedra. The corner-sharing octahedral tilt angles are 0°. There are a spread of Tb–O bond distances ranging from 2.22–2.50 Å. In the second Tb3+ site, Tb3+ is bonded in a 7-coordinate geometry to seven O2- atoms. There are a spread of Tb–O bond distances ranging from 2.26–2.75 Å. In the third Tb3+ site, Tb3+ is bonded in a 7-coordinate geometrymore »« less
Materials Data on Tb2O3 by Materials Project

Dataset

Tb2O3 is Corundum-like structured and crystallizes in the cubic Ia-3 space group. The structure is three-dimensional. there are two inequivalent Tb3+ sites. In the first Tb3+ site, Tb3+ is bonded to six equivalent O2- atoms to form a mixture of distorted edge and corner-sharing TbO6 octahedra. The corner-sharing octahedra tilt angles range from 54–56°. There are a spread of Tb–O bond distances ranging from 2.28–2.37 Å. In the second Tb3+ site, Tb3+ is bonded to six equivalent O2- atoms to form a mixture of edge and corner-sharing TbO6 octahedra. The corner-sharing octahedral tilt angles are 56°. All Tb–O bond lengthsmore »« less
Materials Data on Tb2O3 by Materials Project

Dataset

Tb2O3 crystallizes in the trigonal P-3m1 space group. The structure is three-dimensional. Tb3+ is bonded in a 7-coordinate geometry to seven O2- atoms. There are a spread of Tb–O bond distances ranging from 2.23–2.60 Å. There are two inequivalent O2- sites. In the first O2- site, O2- is bonded to four equivalent Tb3+ atoms to form OTb4 tetrahedra that share corners with six equivalent OTb6 octahedra, corners with six equivalent OTb4 tetrahedra, edges with three equivalent OTb6 octahedra, and edges with three equivalent OTb4 tetrahedra. The corner-sharing octahedra tilt angles range from 18–55°. In the second O2- site, O2- ismore »« less
Materials Data on Tb2O3 by Materials Project

Dataset

Tb2O3 crystallizes in the tetragonal P-4m2 space group. The structure is three-dimensional. Tb3+ is bonded in a 6-coordinate geometry to six O2- atoms. There are four shorter (2.24 Å) and two longer (2.49 Å) Tb–O bond lengths. There are three inequivalent O2- sites. In the first O2- site, O2- is bonded to four equivalent Tb3+ atoms to form a mixture of edge and corner-sharing OTb4 tetrahedra. In the second O2- site, O2- is bonded to four equivalent Tb3+ atoms to form a mixture of edge and corner-sharing OTb4 tetrahedra. In the third O2- site, O2- is bonded to four equivalentmore »« less
Materials Data on Be by Materials Project

Dataset

Be is beta Np structured and crystallizes in the tetragonal P4_2/mnm space group. The structure is three-dimensional. Be is bonded in a 11-coordinate geometry to eleven equivalent Be atoms. There are a spread of Be–Be bond distances ranging from 2.14–2.28 Å.

Similar Records