Materials Data on SmHgPd by Materials Project

doi:10.17188/1274122

Title: Materials Data on SmHgPd by Materials Project

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Abstract

SmPdHg crystallizes in the hexagonal P-62m space group. The structure is three-dimensional. Sm is bonded in a 11-coordinate geometry to five Pd and six equivalent Hg atoms. There are four shorter (3.08 Å) and one longer (3.12 Å) Sm–Pd bond lengths. There are two shorter (3.26 Å) and four longer (3.38 Å) Sm–Hg bond lengths. There are two inequivalent Pd sites. In the first Pd site, Pd is bonded in a 9-coordinate geometry to three equivalent Sm and six equivalent Hg atoms. All Pd–Hg bond lengths are 2.85 Å. In the second Pd site, Pd is bonded in a 9-coordinate geometry to six equivalent Sm and three equivalent Hg atoms. All Pd–Hg bond lengths are 2.90 Å. Hg is bonded in a 10-coordinate geometry to six equivalent Sm and four Pd atoms.

Authors:: The Materials Project

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

Other Number(s):: mp-567912

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; SmHgPd; Hg-Pd-Sm

OSTI Identifier:: 1274122

DOI:: https://doi.org/10.17188/1274122

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                    The Materials Project. Materials Data on SmHgPd by Materials Project.  United States: N. p., 2020. 
        Web.  doi:10.17188/1274122.

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                    The Materials Project. Materials Data on SmHgPd by Materials Project.  United States.  doi:https://doi.org/10.17188/1274122

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                    The Materials Project. 2020.  
"Materials Data on SmHgPd by Materials Project".  United States.  doi:https://doi.org/10.17188/1274122.  https://www.osti.gov/servlets/purl/1274122. Pub date:Thu Jul 16 00:00:00 EDT 2020

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@article{osti_1274122,

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

  author       = {The Materials Project},

  abstractNote = {SmPdHg crystallizes in the hexagonal P-62m space group. The structure is three-dimensional. Sm is bonded in a 11-coordinate geometry to five Pd and six equivalent Hg atoms. There are four shorter (3.08 Å) and one longer (3.12 Å) Sm–Pd bond lengths. There are two shorter (3.26 Å) and four longer (3.38 Å) Sm–Hg bond lengths. There are two inequivalent Pd sites. In the first Pd site, Pd is bonded in a 9-coordinate geometry to three equivalent Sm and six equivalent Hg atoms. All Pd–Hg bond lengths are 2.85 Å. In the second Pd site, Pd is bonded in a 9-coordinate geometry to six equivalent Sm and three equivalent Hg atoms. All Pd–Hg bond lengths are 2.90 Å. Hg is bonded in a 10-coordinate geometry to six equivalent Sm and four Pd atoms.},

  doi          = {10.17188/1274122},

  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/10.17188/1274122

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