Materials Data on RbF3 by Materials Project

doi:10.17188/1314794

Title: Materials Data on RbF3 by Materials Project

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Abstract

RbF3 crystallizes in the monoclinic Pm space group. The structure is three-dimensional. there are two inequivalent Rb sites. In the first Rb site, Rb is bonded in a 12-coordinate geometry to twelve F atoms. There are a spread of Rb–F bond distances ranging from 2.89–3.28 Å. In the second Rb site, Rb is bonded to twelve F atoms to form a mixture of distorted corner and face-sharing RbF12 cuboctahedra. There are a spread of Rb–F bond distances ranging from 2.89–3.29 Å. There are six inequivalent F sites. In the first F site, F is bonded in a distorted see-saw-like geometry to four Rb atoms. In the second F site, F is bonded in a distorted see-saw-like geometry to four Rb atoms. In the third F site, F is bonded in a 2-coordinate geometry to four Rb atoms. In the fourth F site, F is bonded in a distorted see-saw-like geometry to four Rb atoms. In the fifth F site, F is bonded in a distorted see-saw-like geometry to four Rb atoms. In the sixth F site, F is bonded in a 2-coordinate geometry to four Rb atoms.

Authors:: The Materials Project

Publication Date:: Wed Jul 22 00:00:00 EDT 2020

Other Number(s):: mp-975422

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; RbF3; F-Rb

OSTI Identifier:: 1314794

DOI:: https://doi.org/10.17188/1314794

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                    The Materials Project. Materials Data on RbF3 by Materials Project.  United States: N. p., 2020. 
        Web.  doi:10.17188/1314794.

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                    The Materials Project. Materials Data on RbF3 by Materials Project.  United States.  doi:https://doi.org/10.17188/1314794

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                    The Materials Project. 2020.  
"Materials Data on RbF3 by Materials Project".  United States.  doi:https://doi.org/10.17188/1314794.  https://www.osti.gov/servlets/purl/1314794. Pub date:Wed Jul 22 00:00:00 EDT 2020

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@article{osti_1314794,

  title        = {Materials Data on RbF3 by Materials Project},

  author       = {The Materials Project},

  abstractNote = {RbF3 crystallizes in the monoclinic Pm space group. The structure is three-dimensional. there are two inequivalent Rb sites. In the first Rb site, Rb is bonded in a 12-coordinate geometry to twelve F atoms. There are a spread of Rb–F bond distances ranging from 2.89–3.28 Å. In the second Rb site, Rb is bonded to twelve F atoms to form a mixture of distorted corner and face-sharing RbF12 cuboctahedra. There are a spread of Rb–F bond distances ranging from 2.89–3.29 Å. There are six inequivalent F sites. In the first F site, F is bonded in a distorted see-saw-like geometry to four Rb atoms. In the second F site, F is bonded in a distorted see-saw-like geometry to four Rb atoms. In the third F site, F is bonded in a 2-coordinate geometry to four Rb atoms. In the fourth F site, F is bonded in a distorted see-saw-like geometry to four Rb atoms. In the fifth F site, F is bonded in a distorted see-saw-like geometry to four Rb atoms. In the sixth F site, F is bonded in a 2-coordinate geometry to four Rb atoms.},

  doi          = {10.17188/1314794},

  journal      = {},

  number       = ,

  volume       = ,

  place        = {United States},

  year         = {Wed Jul 22 00:00:00 EDT 2020},

  month        = {Wed Jul 22 00:00:00 EDT 2020}

}

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