Materials Data on Ho2Ge5Ru3 by Materials Project

doi:10.17188/1751323

Title: Materials Data on Ho2Ge5Ru3 by Materials Project

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Abstract

Ho2Ru3Ge5 crystallizes in the orthorhombic Ibam space group. The structure is three-dimensional. Ho is bonded in a 1-coordinate geometry to six Ru and ten Ge atoms. There are four shorter (3.20 Å) and two longer (3.47 Å) Ho–Ru bond lengths. There are a spread of Ho–Ge bond distances ranging from 2.97–3.47 Å. There are two inequivalent Ru sites. In the first Ru site, Ru is bonded in a 6-coordinate geometry to four equivalent Ho and six Ge atoms. There are four shorter (2.51 Å) and two longer (2.60 Å) Ru–Ge bond lengths. In the second Ru site, Ru is bonded in a 9-coordinate geometry to four equivalent Ho and five Ge atoms. There are a spread of Ru–Ge bond distances ranging from 2.42–2.51 Å. There are three inequivalent Ge sites. In the first Ge site, Ge is bonded in a 10-coordinate geometry to four equivalent Ho and four equivalent Ru atoms. In the second Ge site, Ge is bonded in a 11-coordinate geometry to four equivalent Ho, three Ru, and four Ge atoms. There are two shorter (2.70 Å) and two longer (2.88 Å) Ge–Ge bond lengths. In the third Ge site, Ge is bonded in a 6-coordinate geometry tomore »« less

Authors:: The Materials Project

Publication Date:: 2020-05-04

Other Number(s):: mp-1105625

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; Ho2Ge5Ru3; Ge-Ho-Ru

OSTI Identifier:: 1751323

DOI:: https://doi.org/10.17188/1751323

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                    The Materials Project. Materials Data on Ho2Ge5Ru3 by Materials Project.  United States: N. p., 2020. 
        Web.  doi:10.17188/1751323.

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                    The Materials Project. Materials Data on Ho2Ge5Ru3 by Materials Project.  United States.  doi:https://doi.org/10.17188/1751323

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                    The Materials Project. 2020.  
"Materials Data on Ho2Ge5Ru3 by Materials Project".  United States.  doi:https://doi.org/10.17188/1751323.  https://www.osti.gov/servlets/purl/1751323. Pub date:Mon May 04 00:00:00 EDT 2020

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@article{osti_1751323,

  title        = {Materials Data on Ho2Ge5Ru3 by Materials Project},

  author       = {The Materials Project},

  abstractNote = {Ho2Ru3Ge5 crystallizes in the orthorhombic Ibam space group. The structure is three-dimensional. Ho is bonded in a 1-coordinate geometry to six Ru and ten Ge atoms. There are four shorter (3.20 Å) and two longer (3.47 Å) Ho–Ru bond lengths. There are a spread of Ho–Ge bond distances ranging from 2.97–3.47 Å. There are two inequivalent Ru sites. In the first Ru site, Ru is bonded in a 6-coordinate geometry to four equivalent Ho and six Ge atoms. There are four shorter (2.51 Å) and two longer (2.60 Å) Ru–Ge bond lengths. In the second Ru site, Ru is bonded in a 9-coordinate geometry to four equivalent Ho and five Ge atoms. There are a spread of Ru–Ge bond distances ranging from 2.42–2.51 Å. There are three inequivalent Ge sites. In the first Ge site, Ge is bonded in a 10-coordinate geometry to four equivalent Ho and four equivalent Ru atoms. In the second Ge site, Ge is bonded in a 11-coordinate geometry to four equivalent Ho, three Ru, and four Ge atoms. There are two shorter (2.70 Å) and two longer (2.88 Å) Ge–Ge bond lengths. In the third Ge site, Ge is bonded in a 6-coordinate geometry to four equivalent Ho, three Ru, and two equivalent Ge atoms.},

  doi          = {10.17188/1751323},

  journal      = {},

  number       = ,

  volume       = ,

  place        = {United States},

  year         = {2020},

  month        = {5}

}

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DOI: https://doi.org/10.17188/1751323

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