Materials Data on Mg2Ni by Materials Project

doi:10.17188/1196813

Title: Materials Data on Mg2Ni by Materials Project

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Abstract

Mg2Ni is Khatyrkite-like structured and crystallizes in the hexagonal P6_222 space group. The structure is three-dimensional. there are two inequivalent Mg sites. In the first Mg site, Mg is bonded in a 4-coordinate geometry to four Ni atoms. All Mg–Ni bond lengths are 2.68 Å. In the second Mg site, Mg is bonded in a 4-coordinate geometry to four Ni atoms. There are two shorter (2.64 Å) and two longer (2.66 Å) Mg–Ni bond lengths. There are two inequivalent Ni sites. In the first Ni site, Ni is bonded in a 10-coordinate geometry to eight Mg and two equivalent Ni atoms. Both Ni–Ni bond lengths are 2.60 Å. In the second Ni site, Ni is bonded in a 10-coordinate geometry to eight Mg and two equivalent Ni atoms.

Authors:: The Materials Project

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

Other Number(s):: mp-2137

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; Mg2Ni; Mg-Ni

OSTI Identifier:: 1196813

DOI:: https://doi.org/10.17188/1196813

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                    The Materials Project. Materials Data on Mg2Ni by Materials Project.  United States: N. p., 2020. 
        Web.  doi:10.17188/1196813.

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                    The Materials Project. Materials Data on Mg2Ni by Materials Project.  United States.  doi:https://doi.org/10.17188/1196813

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                    The Materials Project. 2020.  
"Materials Data on Mg2Ni by Materials Project".  United States.  doi:https://doi.org/10.17188/1196813.  https://www.osti.gov/servlets/purl/1196813. Pub date:Thu Jul 16 00:00:00 EDT 2020

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@article{osti_1196813,

  title        = {Materials Data on Mg2Ni by Materials Project},

  author       = {The Materials Project},

  abstractNote = {Mg2Ni is Khatyrkite-like structured and crystallizes in the hexagonal P6_222 space group. The structure is three-dimensional. there are two inequivalent Mg sites. In the first Mg site, Mg is bonded in a 4-coordinate geometry to four Ni atoms. All Mg–Ni bond lengths are 2.68 Å. In the second Mg site, Mg is bonded in a 4-coordinate geometry to four Ni atoms. There are two shorter (2.64 Å) and two longer (2.66 Å) Mg–Ni bond lengths. There are two inequivalent Ni sites. In the first Ni site, Ni is bonded in a 10-coordinate geometry to eight Mg and two equivalent Ni atoms. Both Ni–Ni bond lengths are 2.60 Å. In the second Ni site, Ni is bonded in a 10-coordinate geometry to eight Mg and two equivalent Ni atoms.},

  doi          = {10.17188/1196813},

  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/10.17188/1196813

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