Materials Data on YB2C by Materials Project

doi:10.17188/1316766

Title: Materials Data on YB2C by Materials Project

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Abstract

YB2C crystallizes in the tetragonal P4_2/mbc space group. The structure is three-dimensional. Y3+ is bonded in a 4-coordinate geometry to four equivalent C3- atoms. There are two shorter (2.61 Å) and two longer (2.62 Å) Y–C bond lengths. There are two inequivalent B sites. In the first B site, B is bonded in a distorted water-like geometry to two equivalent C3- atoms. Both B–C bond lengths are 1.63 Å. In the second B site, B is bonded in a distorted single-bond geometry to one C3- atom. The B–C bond length is 1.60 Å. C3- is bonded in a 3-coordinate geometry to four equivalent Y3+ and three B atoms.

Authors:: The Materials Project

Publication Date:: Wed May 10 00:00:00 EDT 2017

Other Number(s):: mp-9880

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; YB2C; B-C-Y

OSTI Identifier:: 1316766

DOI:: https://doi.org/10.17188/1316766

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                    The Materials Project. Materials Data on YB2C by Materials Project.  United States: N. p., 2017. 
        Web.  doi:10.17188/1316766.

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                    The Materials Project. Materials Data on YB2C by Materials Project.  United States.  doi:https://doi.org/10.17188/1316766

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                    The Materials Project. 2017.  
"Materials Data on YB2C by Materials Project".  United States.  doi:https://doi.org/10.17188/1316766.  https://www.osti.gov/servlets/purl/1316766. Pub date:Wed May 10 00:00:00 EDT 2017

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@article{osti_1316766,

  title        = {Materials Data on YB2C by Materials Project},

  author       = {The Materials Project},

  abstractNote = {YB2C crystallizes in the tetragonal P4_2/mbc space group. The structure is three-dimensional. Y3+ is bonded in a 4-coordinate geometry to four equivalent C3- atoms. There are two shorter (2.61 Å) and two longer (2.62 Å) Y–C bond lengths. There are two inequivalent B sites. In the first B site, B is bonded in a distorted water-like geometry to two equivalent C3- atoms. Both B–C bond lengths are 1.63 Å. In the second B site, B is bonded in a distorted single-bond geometry to one C3- atom. The B–C bond length is 1.60 Å. C3- is bonded in a 3-coordinate geometry to four equivalent Y3+ and three B atoms.},

  doi          = {10.17188/1316766},

  journal      = {},

  number       = ,

  volume       = ,

  place        = {United States},

  year         = {Wed May 10 00:00:00 EDT 2017},

  month        = {Wed May 10 00:00:00 EDT 2017}

}

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DOI: https://doi.org/10.17188/1316766

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