Materials Data on RbSm(CO3)2 by Materials Project

doi:10.17188/1316556

Title: Materials Data on RbSm(CO3)2 by Materials Project

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Abstract

RbSm(CO3)2 crystallizes in the monoclinic C2/c space group. The structure is three-dimensional. Rb1+ is bonded in a 6-coordinate geometry to six O2- atoms. There are a spread of Rb–O bond distances ranging from 2.92–3.02 Å. Sm3+ is bonded in a 8-coordinate geometry to eight O2- atoms. There are a spread of Sm–O bond distances ranging from 2.36–2.57 Å. C4+ is bonded in a trigonal planar geometry to three O2- atoms. There are a spread of C–O bond distances ranging from 1.28–1.32 Å. There are three inequivalent O2- sites. In the first O2- site, O2- is bonded in a distorted linear geometry to one Sm3+ and one C4+ atom. In the second O2- site, O2- is bonded in a distorted single-bond geometry to two equivalent Rb1+, one Sm3+, and one C4+ atom. In the third O2- site, O2- is bonded in a distorted single-bond geometry to one Rb1+, two equivalent Sm3+, and one C4+ atom.

Authors:: The Materials Project

Publication Date:: Sat Jul 18 00:00:00 EDT 2020

Other Number(s):: mp-9842

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; RbSm(CO3)2; C-O-Rb-Sm

OSTI Identifier:: 1316556

DOI:: https://doi.org/10.17188/1316556

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                    The Materials Project. Materials Data on RbSm(CO3)2 by Materials Project.  United States: N. p., 2020. 
        Web.  doi:10.17188/1316556.

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                    The Materials Project. Materials Data on RbSm(CO3)2 by Materials Project.  United States.  doi:https://doi.org/10.17188/1316556

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                    The Materials Project. 2020.  
"Materials Data on RbSm(CO3)2 by Materials Project".  United States.  doi:https://doi.org/10.17188/1316556.  https://www.osti.gov/servlets/purl/1316556. Pub date:Sat Jul 18 00:00:00 EDT 2020

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@article{osti_1316556,

  title        = {Materials Data on RbSm(CO3)2 by Materials Project},

  author       = {The Materials Project},

  abstractNote = {RbSm(CO3)2 crystallizes in the monoclinic C2/c space group. The structure is three-dimensional. Rb1+ is bonded in a 6-coordinate geometry to six O2- atoms. There are a spread of Rb–O bond distances ranging from 2.92–3.02 Å. Sm3+ is bonded in a 8-coordinate geometry to eight O2- atoms. There are a spread of Sm–O bond distances ranging from 2.36–2.57 Å. C4+ is bonded in a trigonal planar geometry to three O2- atoms. There are a spread of C–O bond distances ranging from 1.28–1.32 Å. There are three inequivalent O2- sites. In the first O2- site, O2- is bonded in a distorted linear geometry to one Sm3+ and one C4+ atom. In the second O2- site, O2- is bonded in a distorted single-bond geometry to two equivalent Rb1+, one Sm3+, and one C4+ atom. In the third O2- site, O2- is bonded in a distorted single-bond geometry to one Rb1+, two equivalent Sm3+, and one C4+ atom.},

  doi          = {10.17188/1316556},

  journal      = {},

  number       = ,

  volume       = ,

  place        = {United States},

  year         = {Sat Jul 18 00:00:00 EDT 2020},

  month        = {Sat Jul 18 00:00:00 EDT 2020}

}

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DOI: https://doi.org/10.17188/1316556

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