Materials Data on Er(BC)2 by Materials Project

doi:10.17188/1187401

Title: Materials Data on Er(BC)2 by Materials Project

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Abstract

ErB2C2 crystallizes in the tetragonal P4/mbm space group. The structure is three-dimensional. Er is bonded in a 8-coordinate geometry to eight equivalent B and eight equivalent C atoms. All Er–B bond lengths are 2.72 Å. All Er–C bond lengths are 2.66 Å. B is bonded in a distorted trigonal planar geometry to four equivalent Er and three equivalent C atoms. There is one shorter (1.52 Å) and two longer (1.60 Å) B–C bond length. C is bonded in a 3-coordinate geometry to four equivalent Er and three equivalent B atoms.

Authors:: The Materials Project

Publication Date:: Thu Jul 16 00:00:00 EDT 2020

Other Number(s):: mp-10856

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; Er(BC)2; B-C-Er

OSTI Identifier:: 1187401

DOI:: https://doi.org/10.17188/1187401

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                    The Materials Project. Materials Data on Er(BC)2 by Materials Project.  United States: N. p., 2020. 
        Web.  doi:10.17188/1187401.

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                    The Materials Project. Materials Data on Er(BC)2 by Materials Project.  United States.  doi:https://doi.org/10.17188/1187401

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                    The Materials Project. 2020.  
"Materials Data on Er(BC)2 by Materials Project".  United States.  doi:https://doi.org/10.17188/1187401.  https://www.osti.gov/servlets/purl/1187401. Pub date:Thu Jul 16 00:00:00 EDT 2020

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@article{osti_1187401,

  title        = {Materials Data on Er(BC)2 by Materials Project},

  author       = {The Materials Project},

  abstractNote = {ErB2C2 crystallizes in the tetragonal P4/mbm space group. The structure is three-dimensional. Er is bonded in a 8-coordinate geometry to eight equivalent B and eight equivalent C atoms. All Er–B bond lengths are 2.72 Å. All Er–C bond lengths are 2.66 Å. B is bonded in a distorted trigonal planar geometry to four equivalent Er and three equivalent C atoms. There is one shorter (1.52 Å) and two longer (1.60 Å) B–C bond length. C is bonded in a 3-coordinate geometry to four equivalent Er and three equivalent B atoms.},

  doi          = {10.17188/1187401},

  journal      = {},

  number       = ,

  volume       = ,

  place        = {United States},

  year         = {Thu Jul 16 00:00:00 EDT 2020},

  month        = {Thu Jul 16 00:00:00 EDT 2020}

}

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DOI: https://doi.org/10.17188/1187401

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Materials Data on Er(BC)2 by Materials Project

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ErB2C2 crystallizes in the tetragonal P4_2/mmc space group. The structure is three-dimensional. Er is bonded in a 8-coordinate geometry to eight equivalent B and eight equivalent C atoms. All Er–B bond lengths are 2.72 Å. All Er–C bond lengths are 2.69 Å. B is bonded in a 2-coordinate geometry to four equivalent Er and two equivalent C atoms. Both B–C bond lengths are 1.60 Å. C is bonded in a 2-coordinate geometry to four equivalent Er, two equivalent B, and one C atom. The C–C bond length is 1.42 Å.
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