Materials Data on Sr2RhF7 by Materials Project

doi:10.17188/1264958

Title: Materials Data on Sr2RhF7 by Materials Project

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Abstract

Sr2RhF7 crystallizes in the monoclinic P2_1/c space group. The structure is three-dimensional. there are two inequivalent Sr2+ sites. In the first Sr2+ site, Sr2+ is bonded in a 9-coordinate geometry to nine F1- atoms. There are a spread of Sr–F bond distances ranging from 2.39–2.99 Å. In the second Sr2+ site, Sr2+ is bonded in a 10-coordinate geometry to ten F1- atoms. There are a spread of Sr–F bond distances ranging from 2.35–3.04 Å. Rh3+ is bonded in an octahedral geometry to six F1- atoms. There are a spread of Rh–F bond distances ranging from 2.00–2.04 Å. There are seven inequivalent F1- sites. In the first F1- site, F1- is bonded to three Sr2+ and one Rh3+ atom to form distorted corner-sharing FSr3Rh tetrahedra. In the second F1- site, F1- is bonded in a 4-coordinate geometry to three Sr2+ and one Rh3+ atom. In the third F1- site, F1- is bonded in a trigonal planar geometry to three Sr2+ atoms. In the fourth F1- site, F1- is bonded in a distorted trigonal planar geometry to two Sr2+ and one Rh3+ atom. In the fifth F1- site, F1- is bonded in a 3-coordinate geometry to two Sr2+ and one Rh3+ atom.more »« less

Authors:: The Materials Project

Publication Date:: Sat May 02 00:00:00 EDT 2020

Other Number(s):: mp-541114

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; Sr2RhF7; F-Rh-Sr

OSTI Identifier:: 1264958

DOI:: https://doi.org/10.17188/1264958

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                    The Materials Project. Materials Data on Sr2RhF7 by Materials Project.  United States: N. p., 2020. 
        Web.  doi:10.17188/1264958.

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                    The Materials Project. Materials Data on Sr2RhF7 by Materials Project.  United States.  doi:https://doi.org/10.17188/1264958

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                    The Materials Project. 2020.  
"Materials Data on Sr2RhF7 by Materials Project".  United States.  doi:https://doi.org/10.17188/1264958.  https://www.osti.gov/servlets/purl/1264958. Pub date:Sat May 02 00:00:00 EDT 2020

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@article{osti_1264958,

  title        = {Materials Data on Sr2RhF7 by Materials Project},

  author       = {The Materials Project},

  abstractNote = {Sr2RhF7 crystallizes in the monoclinic P2_1/c space group. The structure is three-dimensional. there are two inequivalent Sr2+ sites. In the first Sr2+ site, Sr2+ is bonded in a 9-coordinate geometry to nine F1- atoms. There are a spread of Sr–F bond distances ranging from 2.39–2.99 Å. In the second Sr2+ site, Sr2+ is bonded in a 10-coordinate geometry to ten F1- atoms. There are a spread of Sr–F bond distances ranging from 2.35–3.04 Å. Rh3+ is bonded in an octahedral geometry to six F1- atoms. There are a spread of Rh–F bond distances ranging from 2.00–2.04 Å. There are seven inequivalent F1- sites. In the first F1- site, F1- is bonded to three Sr2+ and one Rh3+ atom to form distorted corner-sharing FSr3Rh tetrahedra. In the second F1- site, F1- is bonded in a 4-coordinate geometry to three Sr2+ and one Rh3+ atom. In the third F1- site, F1- is bonded in a trigonal planar geometry to three Sr2+ atoms. In the fourth F1- site, F1- is bonded in a distorted trigonal planar geometry to two Sr2+ and one Rh3+ atom. In the fifth F1- site, F1- is bonded in a 3-coordinate geometry to two Sr2+ and one Rh3+ atom. In the sixth F1- site, F1- is bonded in a 1-coordinate geometry to three Sr2+ and one Rh3+ atom. In the seventh F1- site, F1- is bonded in a 1-coordinate geometry to three Sr2+ and one Rh3+ atom.},

  doi          = {10.17188/1264958},

  journal      = {},

  number       = ,

  volume       = ,

  place        = {United States},

  year         = {Sat May 02 00:00:00 EDT 2020},

  month        = {Sat May 02 00:00:00 EDT 2020}

}

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DOI: https://doi.org/10.17188/1264958

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