Materials Data on GdOs2 by Materials Project

doi:10.17188/1262849

Title: Materials Data on GdOs2 by Materials Project

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Abstract

GdOs2 is Hexagonal Laves structured and crystallizes in the orthorhombic Cmcm space group. The structure is three-dimensional. Gd3+ is bonded in a 12-coordinate geometry to twelve Os+1.50- atoms. There are a spread of Gd–Os bond distances ranging from 3.13–3.19 Å. There are three inequivalent Os+1.50- sites. In the first Os+1.50- site, Os+1.50- is bonded to six equivalent Gd3+ and six Os+1.50- atoms to form a mixture of corner, edge, and face-sharing OsGd6Os6 cuboctahedra. There are four shorter (2.73 Å) and two longer (2.74 Å) Os–Os bond lengths. In the second Os+1.50- site, Os+1.50- is bonded to six equivalent Gd3+ and six Os+1.50- atoms to form a mixture of corner, edge, and face-sharing OsGd6Os6 cuboctahedra. There are a spread of Os–Os bond distances ranging from 2.59–2.76 Å. In the third Os+1.50- site, Os+1.50- is bonded to six equivalent Gd3+ and six Os+1.50- atoms to form a mixture of corner, edge, and face-sharing OsGd6Os6 cuboctahedra.

Authors:: The Materials Project

Publication Date:: Mon Aug 03 00:00:00 EDT 2020

Other Number(s):: mp-510184

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; GdOs2; Gd-Os

OSTI Identifier:: 1262849

DOI:: https://doi.org/10.17188/1262849

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                    The Materials Project. Materials Data on GdOs2 by Materials Project.  United States: N. p., 2020. 
        Web.  doi:10.17188/1262849.

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                    The Materials Project. Materials Data on GdOs2 by Materials Project.  United States.  doi:https://doi.org/10.17188/1262849

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                    The Materials Project. 2020.  
"Materials Data on GdOs2 by Materials Project".  United States.  doi:https://doi.org/10.17188/1262849.  https://www.osti.gov/servlets/purl/1262849. Pub date:Mon Aug 03 00:00:00 EDT 2020

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@article{osti_1262849,

  title        = {Materials Data on GdOs2 by Materials Project},

  author       = {The Materials Project},

  abstractNote = {GdOs2 is Hexagonal Laves structured and crystallizes in the orthorhombic Cmcm space group. The structure is three-dimensional. Gd3+ is bonded in a 12-coordinate geometry to twelve Os+1.50- atoms. There are a spread of Gd–Os bond distances ranging from 3.13–3.19 Å. There are three inequivalent Os+1.50- sites. In the first Os+1.50- site, Os+1.50- is bonded to six equivalent Gd3+ and six Os+1.50- atoms to form a mixture of corner, edge, and face-sharing OsGd6Os6 cuboctahedra. There are four shorter (2.73 Å) and two longer (2.74 Å) Os–Os bond lengths. In the second Os+1.50- site, Os+1.50- is bonded to six equivalent Gd3+ and six Os+1.50- atoms to form a mixture of corner, edge, and face-sharing OsGd6Os6 cuboctahedra. There are a spread of Os–Os bond distances ranging from 2.59–2.76 Å. In the third Os+1.50- site, Os+1.50- is bonded to six equivalent Gd3+ and six Os+1.50- atoms to form a mixture of corner, edge, and face-sharing OsGd6Os6 cuboctahedra.},

  doi          = {10.17188/1262849},

  journal      = {},

  number       = ,

  volume       = ,

  place        = {United States},

  year         = {Mon Aug 03 00:00:00 EDT 2020},

  month        = {Mon Aug 03 00:00:00 EDT 2020}

}

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DOI: https://doi.org/10.17188/1262849

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