Materials Data on Cs4GeO4 by Materials Project

doi:10.17188/1300444

Title: Materials Data on Cs4GeO4 by Materials Project

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Abstract

Cs4GeO4 crystallizes in the monoclinic P2_1/c space group. The structure is three-dimensional. there are four inequivalent Cs1+ sites. In the first Cs1+ site, Cs1+ is bonded in a 6-coordinate geometry to six O2- atoms. There are a spread of Cs–O bond distances ranging from 3.03–3.59 Å. In the second Cs1+ site, Cs1+ is bonded to four O2- atoms to form distorted CsO4 tetrahedra that share corners with four equivalent GeO4 tetrahedra and edges with two equivalent CsO4 tetrahedra. There are a spread of Cs–O bond distances ranging from 2.95–3.17 Å. In the third Cs1+ site, Cs1+ is bonded in a 5-coordinate geometry to four O2- atoms. There are a spread of Cs–O bond distances ranging from 2.93–3.04 Å. In the fourth Cs1+ site, Cs1+ is bonded in a 5-coordinate geometry to five O2- atoms. There are a spread of Cs–O bond distances ranging from 2.92–3.57 Å. Ge4+ is bonded to four O2- atoms to form GeO4 tetrahedra that share corners with four equivalent CsO4 tetrahedra. There are a spread of Ge–O bond distances ranging from 1.80–1.83 Å. There are four inequivalent O2- sites. In the first O2- site, O2- is bonded in a 1-coordinate geometry to four Cs1+ and onemore »« less

Authors:: The Materials Project

Publication Date:: 2020-07-15

Other Number(s):: mp-771321

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; Cs4GeO4; Cs-Ge-O

OSTI Identifier:: 1300444

DOI:: https://doi.org/10.17188/1300444

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                    The Materials Project. Materials Data on Cs4GeO4 by Materials Project.  United States: N. p., 2020. 
        Web.  doi:10.17188/1300444.

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                    The Materials Project. Materials Data on Cs4GeO4 by Materials Project.  United States.  doi:https://doi.org/10.17188/1300444

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                    The Materials Project. 2020.  
"Materials Data on Cs4GeO4 by Materials Project".  United States.  doi:https://doi.org/10.17188/1300444.  https://www.osti.gov/servlets/purl/1300444. Pub date:Wed Jul 15 00:00:00 EDT 2020

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@article{osti_1300444,

  title        = {Materials Data on Cs4GeO4 by Materials Project},

  author       = {The Materials Project},

  abstractNote = {Cs4GeO4 crystallizes in the monoclinic P2_1/c space group. The structure is three-dimensional. there are four inequivalent Cs1+ sites. In the first Cs1+ site, Cs1+ is bonded in a 6-coordinate geometry to six O2- atoms. There are a spread of Cs–O bond distances ranging from 3.03–3.59 Å. In the second Cs1+ site, Cs1+ is bonded to four O2- atoms to form distorted CsO4 tetrahedra that share corners with four equivalent GeO4 tetrahedra and edges with two equivalent CsO4 tetrahedra. There are a spread of Cs–O bond distances ranging from 2.95–3.17 Å. In the third Cs1+ site, Cs1+ is bonded in a 5-coordinate geometry to four O2- atoms. There are a spread of Cs–O bond distances ranging from 2.93–3.04 Å. In the fourth Cs1+ site, Cs1+ is bonded in a 5-coordinate geometry to five O2- atoms. There are a spread of Cs–O bond distances ranging from 2.92–3.57 Å. Ge4+ is bonded to four O2- atoms to form GeO4 tetrahedra that share corners with four equivalent CsO4 tetrahedra. There are a spread of Ge–O bond distances ranging from 1.80–1.83 Å. There are four inequivalent O2- sites. In the first O2- site, O2- is bonded in a 1-coordinate geometry to four Cs1+ and one Ge4+ atom. In the second O2- site, O2- is bonded in a 1-coordinate geometry to five Cs1+ and one Ge4+ atom. In the third O2- site, O2- is bonded in a 1-coordinate geometry to five Cs1+ and one Ge4+ atom. In the fourth O2- site, O2- is bonded in a 1-coordinate geometry to five Cs1+ and one Ge4+ atom.},

  doi          = {10.17188/1300444},

  journal      = {},

  number       = ,

  volume       = ,

  place        = {United States},

  year         = {2020},

  month        = {7}

}

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DOI: https://doi.org/10.17188/1300444

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