Materials Data on DyPRu2C by Materials Project

doi:10.17188/1678099

Title: Materials Data on DyPRu2C by Materials Project

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Abstract

DyRu2CP crystallizes in the orthorhombic Cmcm space group. The structure is three-dimensional. Dy3+ is bonded in a 4-coordinate geometry to four equivalent C4- and three equivalent P3- atoms. All Dy–C bond lengths are 2.63 Å. There are one shorter (3.05 Å) and two longer (3.12 Å) Dy–P bond lengths. Ru2+ is bonded in a distorted single-bond geometry to one C4- and three equivalent P3- atoms. The Ru–C bond length is 1.86 Å. There are one shorter (2.42 Å) and two longer (2.46 Å) Ru–P bond lengths. C4- is bonded to four equivalent Dy3+ and two equivalent Ru2+ atoms to form a mixture of edge and corner-sharing CDy4Ru2 octahedra. The corner-sharing octahedral tilt angles are 21°. P3- is bonded in a 9-coordinate geometry to three equivalent Dy3+ and six equivalent Ru2+ atoms.

Authors:: The Materials Project

Publication Date:: 2020-05-02

Other Number(s):: mp-1205848

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; DyPRu2C; C-Dy-P-Ru

OSTI Identifier:: 1678099

DOI:: https://doi.org/10.17188/1678099

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                    The Materials Project. Materials Data on DyPRu2C by Materials Project.  United States: N. p., 2020. 
        Web.  doi:10.17188/1678099.

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                    The Materials Project. Materials Data on DyPRu2C by Materials Project.  United States.  doi:https://doi.org/10.17188/1678099

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                    The Materials Project. 2020.  
"Materials Data on DyPRu2C by Materials Project".  United States.  doi:https://doi.org/10.17188/1678099.  https://www.osti.gov/servlets/purl/1678099. Pub date:Sat May 02 00:00:00 EDT 2020

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@article{osti_1678099,

  title        = {Materials Data on DyPRu2C by Materials Project},

  author       = {The Materials Project},

  abstractNote = {DyRu2CP crystallizes in the orthorhombic Cmcm space group. The structure is three-dimensional. Dy3+ is bonded in a 4-coordinate geometry to four equivalent C4- and three equivalent P3- atoms. All Dy–C bond lengths are 2.63 Å. There are one shorter (3.05 Å) and two longer (3.12 Å) Dy–P bond lengths. Ru2+ is bonded in a distorted single-bond geometry to one C4- and three equivalent P3- atoms. The Ru–C bond length is 1.86 Å. There are one shorter (2.42 Å) and two longer (2.46 Å) Ru–P bond lengths. C4- is bonded to four equivalent Dy3+ and two equivalent Ru2+ atoms to form a mixture of edge and corner-sharing CDy4Ru2 octahedra. The corner-sharing octahedral tilt angles are 21°. P3- is bonded in a 9-coordinate geometry to three equivalent Dy3+ and six equivalent Ru2+ atoms.},

  doi          = {10.17188/1678099},

  journal      = {},

  number       = ,

  volume       = ,

  place        = {United States},

  year         = {2020},

  month        = {5}

}

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DOI: https://doi.org/10.17188/1678099

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