Materials Data on Co(BRh2)3 by Materials Project

doi:10.17188/1696122

Title: Materials Data on Co(BRh2)3 by Materials Project

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Abstract

Co(Rh2B)3 crystallizes in the monoclinic Cm space group. The structure is three-dimensional. there are nine inequivalent Rh sites. In the first Rh site, Rh is bonded in a 3-coordinate geometry to three B atoms. There are one shorter (2.09 Å) and two longer (2.19 Å) Rh–B bond lengths. In the second Rh site, Rh is bonded in a 3-coordinate geometry to three B atoms. There are a spread of Rh–B bond distances ranging from 2.10–2.24 Å. In the third Rh site, Rh is bonded in a 3-coordinate geometry to three B atoms. There are one shorter (2.15 Å) and two longer (2.21 Å) Rh–B bond lengths. In the fourth Rh site, Rh is bonded in a 3-coordinate geometry to three B atoms. There are a spread of Rh–B bond distances ranging from 2.12–2.23 Å. In the fifth Rh site, Rh is bonded in a 3-coordinate geometry to three B atoms. There are one shorter (2.18 Å) and two longer (2.19 Å) Rh–B bond lengths. In the sixth Rh site, Rh is bonded in a 3-coordinate geometry to three B atoms. There are one shorter (2.15 Å) and two longer (2.16 Å) Rh–B bond lengths. In the seventh Rh site, Rhmore »« less

Publication Date:: 2020-04-30

Other Number(s):: mp-1226641

DOE Contract Number:: AC02-05CH11231

Research Org.:: LBNL Materials Project; Lawrence Berkeley National Laboratory (LBNL), Berkeley, CA (United States)

Sponsoring Org.:: USDOE Office of Science (SC), Basic Energy Sciences (BES) (SC-22)

Collaborations:: The Materials Project; MIT; UC Berkeley; Duke; U Louvain

Subject:: 36 MATERIALS SCIENCE; B-Co-Rh; Co(BRh2)3; crystal structure

OSTI Identifier:: 1696122

DOI:: https://doi.org/10.17188/1696122

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                    Materials Data on Co(BRh2)3 by Materials Project.  United States: N. p., 2020. 
        Web.  doi:10.17188/1696122.

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                    Materials Data on Co(BRh2)3 by Materials Project.  United States.  doi:https://doi.org/10.17188/1696122

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                    2020.  
"Materials Data on Co(BRh2)3 by Materials Project".  United States.  doi:https://doi.org/10.17188/1696122.  https://www.osti.gov/servlets/purl/1696122. Pub date:Thu Apr 30 04:00:00 UTC 2020

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@article{osti_1696122,

  title        = {Materials Data on Co(BRh2)3 by Materials Project},

  
  abstractNote = {Co(Rh2B)3 crystallizes in the monoclinic Cm space group. The structure is three-dimensional. there are nine inequivalent Rh sites. In the first Rh site, Rh is bonded in a 3-coordinate geometry to three B atoms. There are one shorter (2.09 Å) and two longer (2.19 Å) Rh–B bond lengths. In the second Rh site, Rh is bonded in a 3-coordinate geometry to three B atoms. There are a spread of Rh–B bond distances ranging from 2.10–2.24 Å. In the third Rh site, Rh is bonded in a 3-coordinate geometry to three B atoms. There are one shorter (2.15 Å) and two longer (2.21 Å) Rh–B bond lengths. In the fourth Rh site, Rh is bonded in a 3-coordinate geometry to three B atoms. There are a spread of Rh–B bond distances ranging from 2.12–2.23 Å. In the fifth Rh site, Rh is bonded in a 3-coordinate geometry to three B atoms. There are one shorter (2.18 Å) and two longer (2.19 Å) Rh–B bond lengths. In the sixth Rh site, Rh is bonded in a 3-coordinate geometry to three B atoms. There are one shorter (2.15 Å) and two longer (2.16 Å) Rh–B bond lengths. In the seventh Rh site, Rh is bonded in a distorted water-like geometry to two equivalent B atoms. Both Rh–B bond lengths are 2.12 Å. In the eighth Rh site, Rh is bonded in a 2-coordinate geometry to two B atoms. There are one shorter (2.15 Å) and one longer (2.16 Å) Rh–B bond lengths. In the ninth Rh site, Rh is bonded in a distorted water-like geometry to two equivalent B atoms. Both Rh–B bond lengths are 2.12 Å. Co is bonded in a 2-coordinate geometry to two B atoms. There are one shorter (2.10 Å) and one longer (2.13 Å) Co–B bond lengths. There are four inequivalent B sites. In the first B site, B is bonded in a 6-coordinate geometry to four Rh and two equivalent Co atoms. In the second B site, B is bonded in a 6-coordinate geometry to five Rh and one Co atom. In the third B site, B is bonded in a 6-coordinate geometry to six Rh atoms. In the fourth B site, B is bonded in a 6-coordinate geometry to six Rh atoms.},

  doi          = {10.17188/1696122},

  journal      = {},

  number       = ,

  volume       = ,

  place        = {United States},

  year         = {2020},

  month        = {4}

}

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DOI: https://doi.org/10.17188/1696122

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