Materials Data on Mn10(SiGe)3 by Materials Project

doi:10.17188/1676032

Title: Materials Data on Mn10(SiGe)3 by Materials Project

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Abstract

Mn10(GeSi)3 crystallizes in the hexagonal P-62m space group. The structure is three-dimensional. there are three inequivalent Mn sites. In the first Mn site, Mn is bonded in a 5-coordinate geometry to three equivalent Ge and two equivalent Si atoms. There are two shorter (2.44 Å) and one longer (2.51 Å) Mn–Ge bond lengths. Both Mn–Si bond lengths are 2.66 Å. In the second Mn site, Mn is bonded in a 5-coordinate geometry to two equivalent Ge and three equivalent Si atoms. Both Mn–Ge bond lengths are 2.67 Å. There are two shorter (2.42 Å) and one longer (2.54 Å) Mn–Si bond lengths. In the third Mn site, Mn is bonded in a 6-coordinate geometry to three equivalent Ge and three equivalent Si atoms. All Mn–Ge bond lengths are 2.48 Å. All Mn–Si bond lengths are 2.46 Å. Ge is bonded in a 9-coordinate geometry to nine Mn atoms. Si is bonded in a 9-coordinate geometry to nine Mn atoms.

Authors:: The Materials Project

Publication Date:: 2020-05-03

Other Number(s):: mp-1222206

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; Mn10(SiGe)3; Ge-Mn-Si

OSTI Identifier:: 1676032

DOI:: https://doi.org/10.17188/1676032

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                    The Materials Project. Materials Data on Mn10(SiGe)3 by Materials Project.  United States: N. p., 2020. 
        Web.  doi:10.17188/1676032.

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                    The Materials Project. Materials Data on Mn10(SiGe)3 by Materials Project.  United States.  doi:https://doi.org/10.17188/1676032

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                    The Materials Project. 2020.  
"Materials Data on Mn10(SiGe)3 by Materials Project".  United States.  doi:https://doi.org/10.17188/1676032.  https://www.osti.gov/servlets/purl/1676032. Pub date:Sun May 03 00:00:00 EDT 2020

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@article{osti_1676032,

  title        = {Materials Data on Mn10(SiGe)3 by Materials Project},

  author       = {The Materials Project},

  abstractNote = {Mn10(GeSi)3 crystallizes in the hexagonal P-62m space group. The structure is three-dimensional. there are three inequivalent Mn sites. In the first Mn site, Mn is bonded in a 5-coordinate geometry to three equivalent Ge and two equivalent Si atoms. There are two shorter (2.44 Å) and one longer (2.51 Å) Mn–Ge bond lengths. Both Mn–Si bond lengths are 2.66 Å. In the second Mn site, Mn is bonded in a 5-coordinate geometry to two equivalent Ge and three equivalent Si atoms. Both Mn–Ge bond lengths are 2.67 Å. There are two shorter (2.42 Å) and one longer (2.54 Å) Mn–Si bond lengths. In the third Mn site, Mn is bonded in a 6-coordinate geometry to three equivalent Ge and three equivalent Si atoms. All Mn–Ge bond lengths are 2.48 Å. All Mn–Si bond lengths are 2.46 Å. Ge is bonded in a 9-coordinate geometry to nine Mn atoms. Si is bonded in a 9-coordinate geometry to nine Mn atoms.},

  doi          = {10.17188/1676032},

  journal      = {},

  number       = ,

  volume       = ,

  place        = {United States},

  year         = {2020},

  month        = {5}

}

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DOI: https://doi.org/10.17188/1676032

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