Materials Data on ErMnSi2 by Materials Project

doi:10.17188/1662993

Title: Materials Data on ErMnSi2 by Materials Project

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Abstract

ErMnSi2 crystallizes in the orthorhombic Cmcm space group. The structure is three-dimensional. Er is bonded in a 10-coordinate geometry to ten Si atoms. There are a spread of Er–Si bond distances ranging from 3.08–3.16 Å. Mn is bonded in a 5-coordinate geometry to five Si atoms. There are a spread of Mn–Si bond distances ranging from 2.27–2.31 Å. There are two inequivalent Si sites. In the first Si site, Si is bonded in a distorted single-bond geometry to six equivalent Er, one Mn, and two equivalent Si atoms. Both Si–Si bond lengths are 2.49 Å. In the second Si site, Si is bonded in a 4-coordinate geometry to four equivalent Er and four equivalent Mn atoms.

Authors:: The Materials Project

Publication Date:: 2019-01-12

Other Number(s):: mp-1206071

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; ErMnSi2; Er-Mn-Si

OSTI Identifier:: 1662993

DOI:: https://doi.org/10.17188/1662993

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                    The Materials Project. Materials Data on ErMnSi2 by Materials Project.  United States: N. p., 2019. 
        Web.  doi:10.17188/1662993.

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                    The Materials Project. Materials Data on ErMnSi2 by Materials Project.  United States.  doi:https://doi.org/10.17188/1662993

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                    The Materials Project. 2019.  
"Materials Data on ErMnSi2 by Materials Project".  United States.  doi:https://doi.org/10.17188/1662993.  https://www.osti.gov/servlets/purl/1662993. Pub date:Sat Jan 12 00:00:00 EST 2019

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@article{osti_1662993,

  title        = {Materials Data on ErMnSi2 by Materials Project},

  author       = {The Materials Project},

  abstractNote = {ErMnSi2 crystallizes in the orthorhombic Cmcm space group. The structure is three-dimensional. Er is bonded in a 10-coordinate geometry to ten Si atoms. There are a spread of Er–Si bond distances ranging from 3.08–3.16 Å. Mn is bonded in a 5-coordinate geometry to five Si atoms. There are a spread of Mn–Si bond distances ranging from 2.27–2.31 Å. There are two inequivalent Si sites. In the first Si site, Si is bonded in a distorted single-bond geometry to six equivalent Er, one Mn, and two equivalent Si atoms. Both Si–Si bond lengths are 2.49 Å. In the second Si site, Si is bonded in a 4-coordinate geometry to four equivalent Er and four equivalent Mn atoms.},

  doi          = {10.17188/1662993},

  journal      = {},

  number       = ,

  volume       = ,

  place        = {United States},

  year         = {2019},

  month        = {1}

}

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DOI: https://doi.org/10.17188/1662993

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