Materials Data on Ho6GaNi2 by Materials Project

doi:10.17188/1744854

Title: Materials Data on Ho6GaNi2 by Materials Project

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Abstract

Ho6Ni2Ga crystallizes in the orthorhombic Immm space group. The structure is three-dimensional. there are three inequivalent Ho sites. In the first Ho site, Ho is bonded in a 4-coordinate geometry to two Ni and two Ga atoms. There are one shorter (2.77 Å) and one longer (3.17 Å) Ho–Ni bond lengths. There are one shorter (2.99 Å) and one longer (3.21 Å) Ho–Ga bond lengths. In the second Ho site, Ho is bonded in a 4-coordinate geometry to three Ni and one Ga atom. There are one shorter (2.69 Å) and two longer (2.86 Å) Ho–Ni bond lengths. The Ho–Ga bond length is 3.33 Å. In the third Ho site, Ho is bonded in a 5-coordinate geometry to three Ni and two Ga atoms. There are two shorter (2.91 Å) and one longer (3.12 Å) Ho–Ni bond lengths. There are one shorter (3.15 Å) and one longer (3.62 Å) Ho–Ga bond lengths. There are two inequivalent Ni sites. In the first Ni site, Ni is bonded in a 9-coordinate geometry to eight Ho and one Ni atom. The Ni–Ni bond length is 2.66 Å. In the second Ni site, Ni is bonded in a 9-coordinate geometry to eight Ho andmore »« less

Authors:: The Materials Project

Publication Date:: Sun May 03 00:00:00 EDT 2020

Other Number(s):: mp-1189374

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; Ho6GaNi2; Ga-Ho-Ni

OSTI Identifier:: 1744854

DOI:: https://doi.org/10.17188/1744854

Citation Formats


                    The Materials Project. Materials Data on Ho6GaNi2 by Materials Project.  United States: N. p., 2020. 
        Web.  doi:10.17188/1744854.

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                    The Materials Project. Materials Data on Ho6GaNi2 by Materials Project.  United States.  doi:https://doi.org/10.17188/1744854

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                    The Materials Project. 2020.  
"Materials Data on Ho6GaNi2 by Materials Project".  United States.  doi:https://doi.org/10.17188/1744854.  https://www.osti.gov/servlets/purl/1744854. Pub date:Sun May 03 00:00:00 EDT 2020

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@article{osti_1744854,

  title        = {Materials Data on Ho6GaNi2 by Materials Project},

  author       = {The Materials Project},

  abstractNote = {Ho6Ni2Ga crystallizes in the orthorhombic Immm space group. The structure is three-dimensional. there are three inequivalent Ho sites. In the first Ho site, Ho is bonded in a 4-coordinate geometry to two Ni and two Ga atoms. There are one shorter (2.77 Å) and one longer (3.17 Å) Ho–Ni bond lengths. There are one shorter (2.99 Å) and one longer (3.21 Å) Ho–Ga bond lengths. In the second Ho site, Ho is bonded in a 4-coordinate geometry to three Ni and one Ga atom. There are one shorter (2.69 Å) and two longer (2.86 Å) Ho–Ni bond lengths. The Ho–Ga bond length is 3.33 Å. In the third Ho site, Ho is bonded in a 5-coordinate geometry to three Ni and two Ga atoms. There are two shorter (2.91 Å) and one longer (3.12 Å) Ho–Ni bond lengths. There are one shorter (3.15 Å) and one longer (3.62 Å) Ho–Ga bond lengths. There are two inequivalent Ni sites. In the first Ni site, Ni is bonded in a 9-coordinate geometry to eight Ho and one Ni atom. The Ni–Ni bond length is 2.66 Å. In the second Ni site, Ni is bonded in a 9-coordinate geometry to eight Ho and one Ni atom. The Ni–Ni bond length is 2.39 Å. There are two inequivalent Ga sites. In the first Ga site, Ga is bonded in a body-centered cubic geometry to eight Ho atoms. In the second Ga site, Ga is bonded in a cuboctahedral geometry to twelve Ho atoms.},

  doi          = {10.17188/1744854},

  journal      = {},

  number       = ,

  volume       = ,

  place        = {United States},

  year         = {Sun May 03 00:00:00 EDT 2020},

  month        = {Sun May 03 00:00:00 EDT 2020}

}

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DOI: https://doi.org/10.17188/1744854

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