Materials Data on Ho12InPt7 by Materials Project

doi:10.17188/1205433

Title: Materials Data on Ho12InPt7 by Materials Project

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Abstract

Ho12Pt7In crystallizes in the tetragonal I4/mcm space group. The structure is three-dimensional. there are three inequivalent Ho sites. In the first Ho site, Ho is bonded in a 6-coordinate geometry to five Pt and one In atom. There are a spread of Ho–Pt bond distances ranging from 2.90–3.23 Å. The Ho–In bond length is 3.30 Å. In the second Ho site, Ho is bonded in a 3-coordinate geometry to five Pt atoms. There are a spread of Ho–Pt bond distances ranging from 2.78–3.58 Å. In the third Ho site, Ho is bonded to four Pt atoms to form distorted edge-sharing HoPt4 trigonal pyramids. There are two shorter (2.85 Å) and two longer (2.93 Å) Ho–Pt bond lengths. There are three inequivalent Pt sites. In the first Pt site, Pt is bonded in a 10-coordinate geometry to eight Ho atoms. In the second Pt site, Pt is bonded in a 9-coordinate geometry to nine Ho atoms. In the third Pt site, Pt is bonded in a 8-coordinate geometry to eight equivalent Ho atoms. In is bonded in a body-centered cubic geometry to eight equivalent Ho atoms.

Publication Date:: 2020-04-29

Other Number(s):: mp-31109

DOE Contract Number:: AC02-05CH11231;

Research Org.:: LBNL Materials Project; Lawrence Berkeley National Laboratory (LBNL), Berkeley, CA (United States)

Sponsoring Org.:: USDOE Office of Science (SC), Basic Energy Sciences (BES) (SC-22)

Collaborations:: The Materials Project; MIT; UC Berkeley; Duke; U Louvain

Subject:: 36 MATERIALS SCIENCE; crystal structure; Ho-In-Pt; Ho12InPt7

OSTI Identifier:: 1205433

DOI:: https://doi.org/10.17188/1205433

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                    Materials Data on Ho12InPt7 by Materials Project.  United States: N. p., 2020. 
        Web.  doi:10.17188/1205433.

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                    Materials Data on Ho12InPt7 by Materials Project.  United States.  doi:https://doi.org/10.17188/1205433

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                    2020.  
"Materials Data on Ho12InPt7 by Materials Project".  United States.  doi:https://doi.org/10.17188/1205433.  https://www.osti.gov/servlets/purl/1205433. Pub date:Wed Apr 29 20:00:00 EDT 2020

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@article{osti_1205433,

  title        = {Materials Data on Ho12InPt7 by Materials Project},

  
  abstractNote = {Ho12Pt7In crystallizes in the tetragonal I4/mcm space group. The structure is three-dimensional. there are three inequivalent Ho sites. In the first Ho site, Ho is bonded in a 6-coordinate geometry to five Pt and one In atom. There are a spread of Ho–Pt bond distances ranging from 2.90–3.23 Å. The Ho–In bond length is 3.30 Å. In the second Ho site, Ho is bonded in a 3-coordinate geometry to five Pt atoms. There are a spread of Ho–Pt bond distances ranging from 2.78–3.58 Å. In the third Ho site, Ho is bonded to four Pt atoms to form distorted edge-sharing HoPt4 trigonal pyramids. There are two shorter (2.85 Å) and two longer (2.93 Å) Ho–Pt bond lengths. There are three inequivalent Pt sites. In the first Pt site, Pt is bonded in a 10-coordinate geometry to eight Ho atoms. In the second Pt site, Pt is bonded in a 9-coordinate geometry to nine Ho atoms. In the third Pt site, Pt is bonded in a 8-coordinate geometry to eight equivalent Ho atoms. In is bonded in a body-centered cubic geometry to eight equivalent Ho atoms.},

  doi          = {10.17188/1205433},

  journal      = {},

  number       = ,

  volume       = ,

  place        = {United States},

  year         = {2020},

  month        = {4}

}

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DOI: https://doi.org/10.17188/1205433

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