Materials Data on Ag9(BiO3)2 by Materials Project

doi:10.17188/1281034

Title: Materials Data on Ag9(BiO3)2 by Materials Project

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Abstract

Ag9(BiO3)2 crystallizes in the orthorhombic Cmcm space group. The structure is three-dimensional. there are eight inequivalent Ag1+ sites. In the first Ag1+ site, Ag1+ is bonded in a linear geometry to two equivalent O2- atoms. Both Ag–O bond lengths are 2.25 Å. In the second Ag1+ site, Ag1+ is bonded in a linear geometry to two equivalent O2- atoms. Both Ag–O bond lengths are 2.25 Å. In the third Ag1+ site, Ag1+ is bonded in a 2-coordinate geometry to two equivalent O2- atoms. Both Ag–O bond lengths are 2.44 Å. In the fourth Ag1+ site, Ag1+ is bonded in a linear geometry to two equivalent O2- atoms. Both Ag–O bond lengths are 2.09 Å. In the fifth Ag1+ site, Ag1+ is bonded in a distorted bent 150 degrees geometry to two equivalent O2- atoms. Both Ag–O bond lengths are 2.49 Å. In the sixth Ag1+ site, Ag1+ is bonded in a linear geometry to two O2- atoms. Both Ag–O bond lengths are 2.10 Å. In the seventh Ag1+ site, Ag1+ is bonded in a distorted bent 150 degrees geometry to two equivalent O2- atoms. Both Ag–O bond lengths are 2.53 Å. In the eighth Ag1+ site, Ag1+ is bonded inmore »« less

Authors:: The Materials Project

Publication Date:: Wed Apr 29 00:00:00 EDT 2020

Other Number(s):: mp-651048

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; Ag9(BiO3)2; Ag-Bi-O

OSTI Identifier:: 1281034

DOI:: https://doi.org/10.17188/1281034

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                    The Materials Project. Materials Data on Ag9(BiO3)2 by Materials Project.  United States: N. p., 2020. 
        Web.  doi:10.17188/1281034.

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                    The Materials Project. Materials Data on Ag9(BiO3)2 by Materials Project.  United States.  doi:https://doi.org/10.17188/1281034

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                    The Materials Project. 2020.  
"Materials Data on Ag9(BiO3)2 by Materials Project".  United States.  doi:https://doi.org/10.17188/1281034.  https://www.osti.gov/servlets/purl/1281034. Pub date:Wed Apr 29 00:00:00 EDT 2020

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@article{osti_1281034,

  title        = {Materials Data on Ag9(BiO3)2 by Materials Project},

  author       = {The Materials Project},

  abstractNote = {Ag9(BiO3)2 crystallizes in the orthorhombic Cmcm space group. The structure is three-dimensional. there are eight inequivalent Ag1+ sites. In the first Ag1+ site, Ag1+ is bonded in a linear geometry to two equivalent O2- atoms. Both Ag–O bond lengths are 2.25 Å. In the second Ag1+ site, Ag1+ is bonded in a linear geometry to two equivalent O2- atoms. Both Ag–O bond lengths are 2.25 Å. In the third Ag1+ site, Ag1+ is bonded in a 2-coordinate geometry to two equivalent O2- atoms. Both Ag–O bond lengths are 2.44 Å. In the fourth Ag1+ site, Ag1+ is bonded in a linear geometry to two equivalent O2- atoms. Both Ag–O bond lengths are 2.09 Å. In the fifth Ag1+ site, Ag1+ is bonded in a distorted bent 150 degrees geometry to two equivalent O2- atoms. Both Ag–O bond lengths are 2.49 Å. In the sixth Ag1+ site, Ag1+ is bonded in a linear geometry to two O2- atoms. Both Ag–O bond lengths are 2.10 Å. In the seventh Ag1+ site, Ag1+ is bonded in a distorted bent 150 degrees geometry to two equivalent O2- atoms. Both Ag–O bond lengths are 2.53 Å. In the eighth Ag1+ site, Ag1+ is bonded in a linear geometry to two equivalent O2- atoms. Both Ag–O bond lengths are 2.34 Å. Bi+1.50+ is bonded in a distorted T-shaped geometry to three O2- atoms. All Bi–O bond lengths are 2.11 Å. There are three inequivalent O2- sites. In the first O2- site, O2- is bonded in a 4-coordinate geometry to three Ag1+ and one Bi+1.50+ atom. In the second O2- site, O2- is bonded to three Ag1+ and one Bi+1.50+ atom to form distorted corner-sharing OAg3Bi tetrahedra. In the third O2- site, O2- is bonded in a 4-coordinate geometry to three Ag1+ and one Bi+1.50+ atom.},

  doi          = {10.17188/1281034},

  journal      = {},

  number       = ,

  volume       = ,

  place        = {United States},

  year         = {Wed Apr 29 00:00:00 EDT 2020},

  month        = {Wed Apr 29 00:00:00 EDT 2020}

}

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DOI: https://doi.org/10.17188/1281034

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