Materials Data on BiO2 by Materials Project

doi:10.17188/1289815

Title: Materials Data on BiO2 by Materials Project

Dataset
Other Related Research

Abstract

BiO2 crystallizes in the triclinic P-1 space group. The structure is three-dimensional. Bi is bonded to six equivalent O atoms to form a mixture of distorted corner and edge-sharing BiO6 pentagonal pyramids. There are a spread of Bi–O bond distances ranging from 2.24–2.30 Å. O is bonded in a distorted trigonal non-coplanar geometry to three equivalent Bi atoms.

Publication Date:: 2017-07-24

Other Number(s):: mp-755137

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; Bi-O; BiO2; crystal structure

OSTI Identifier:: 1289815

DOI:: https://doi.org/10.17188/1289815

Citation Formats


                    Materials Data on BiO2 by Materials Project.  United States: N. p., 2017. 
        Web.  doi:10.17188/1289815.

Copy to clipboard


                    Materials Data on BiO2 by Materials Project.  United States.  doi:https://doi.org/10.17188/1289815

Copy to clipboard


                    2017.  
"Materials Data on BiO2 by Materials Project".  United States.  doi:https://doi.org/10.17188/1289815.  https://www.osti.gov/servlets/purl/1289815. Pub date:Mon Jul 24 00:00:00 EDT 2017

Copy to clipboard


                    
@article{osti_1289815,

  title        = {Materials Data on BiO2 by Materials Project},

  
  abstractNote = {BiO2 crystallizes in the triclinic P-1 space group. The structure is three-dimensional. Bi is bonded to six equivalent O atoms to form a mixture of distorted corner and edge-sharing BiO6 pentagonal pyramids. There are a spread of Bi–O bond distances ranging from 2.24–2.30 Å. O is bonded in a distorted trigonal non-coplanar geometry to three equivalent Bi atoms.},

  doi          = {10.17188/1289815},

  journal      = {},

  number       = ,

  volume       = ,

  place        = {United States},

  year         = {2017},

  month        = {7}

}

Copy to clipboard

Dataset:

View Dataset

DOI: https://doi.org/10.17188/1289815

Save / Share:

Export Metadata

Save to My Library

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

Materials Data on BiO2 by Materials Project

Dataset

BiO2 is Fluorite structured and crystallizes in the cubic Fm-3m space group. The structure is three-dimensional. Bi is bonded in a body-centered cubic geometry to eight equivalent O atoms. All Bi–O bond lengths are 2.39 Å. O is bonded to four equivalent Bi atoms to form a mixture of edge and corner-sharing OBi4 tetrahedra.
Materials Data on BiO2 by Materials Project

Dataset

BiO2 crystallizes in the orthorhombic Ibam space group. The structure is one-dimensional and consists of four BiO2 ribbons oriented in the (1, 0, 0) direction. Bi is bonded in a 4-coordinate geometry to four O atoms. There are a spread of Bi–O bond distances ranging from 2.14–2.24 Å. There are two inequivalent O sites. In the first O site, O is bonded in a single-bond geometry to one Bi atom. In the second O site, O is bonded in a trigonal non-coplanar geometry to three equivalent Bi atoms.
Materials Data on BiO2 by Materials Project

Dataset

BiO2 crystallizes in the orthorhombic Ibam space group. The structure is three-dimensional. Bi is bonded in a 6-coordinate geometry to six O atoms. There are a spread of Bi–O bond distances ranging from 2.18–2.66 Å. There are two inequivalent O sites. In the first O site, O is bonded in a distorted bent 150 degrees geometry to two equivalent Bi atoms. In the second O site, O is bonded to four equivalent Bi atoms to form a mixture of distorted edge and corner-sharing OBi4 tetrahedra.
Materials Data on BiO2 by Materials Project

Dataset

BiO2 crystallizes in the hexagonal P6_3/mmc space group. The structure is two-dimensional and consists of two BiO2 sheets oriented in the (0, 0, 1) direction. Bi is bonded in a 6-coordinate geometry to six equivalent O atoms. All Bi–O bond lengths are 2.41 Å. O is bonded in a 3-coordinate geometry to three equivalent Bi atoms.
Materials Data on BiO2 by Materials Project

Dataset

BiO2 is Hydrophilite-like structured and crystallizes in the monoclinic Cm space group. The structure is three-dimensional. there are four inequivalent Bi sites. In the first Bi site, Bi is bonded to six O atoms to form a mixture of edge and corner-sharing BiO6 octahedra. The corner-sharing octahedral tilt angles are 51°. There are a spread of Bi–O bond distances ranging from 2.25–2.30 Å. In the second Bi site, Bi is bonded to six O atoms to form a mixture of edge and corner-sharing BiO6 octahedra. The corner-sharing octahedral tilt angles are 51°. There are a spread of Bi–O bond distancesmore »« less

Similar Records