Materials Data on Er3Fe2Ge3 by Materials Project

doi:10.17188/1679733

Title: Materials Data on Er3Fe2Ge3 by Materials Project

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Abstract

Er3Fe2Ge3 crystallizes in the orthorhombic Cmcm space group. The structure is three-dimensional. there are two inequivalent Er sites. In the first Er site, Er is bonded in a 2-coordinate geometry to four equivalent Fe and seven Ge atoms. There are a spread of Er–Fe bond distances ranging from 3.02–3.14 Å. There are a spread of Er–Ge bond distances ranging from 2.96–3.28 Å. In the second Er site, Er is bonded in a 5-coordinate geometry to four equivalent Fe and five Ge atoms. All Er–Fe bond lengths are 3.17 Å. There are a spread of Er–Ge bond distances ranging from 2.87–3.25 Å. Fe is bonded in a 4-coordinate geometry to six Er and four Ge atoms. There are a spread of Fe–Ge bond distances ranging from 2.36–2.59 Å. There are two inequivalent Ge sites. In the first Ge site, Ge is bonded in a 10-coordinate geometry to six Er, three equivalent Fe, and one Ge atom. The Ge–Ge bond length is 2.84 Å. In the second Ge site, Ge is bonded in a 9-coordinate geometry to seven Er and two equivalent Fe atoms.

Authors:: The Materials Project

Publication Date:: 2018-07-19

Other Number(s):: mp-1106108

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; Er3Fe2Ge3; Er-Fe-Ge

OSTI Identifier:: 1679733

DOI:: https://doi.org/10.17188/1679733

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                    The Materials Project. Materials Data on Er3Fe2Ge3 by Materials Project.  United States: N. p., 2018. 
        Web.  doi:10.17188/1679733.

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                    The Materials Project. Materials Data on Er3Fe2Ge3 by Materials Project.  United States.  doi:https://doi.org/10.17188/1679733

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                    The Materials Project. 2018.  
"Materials Data on Er3Fe2Ge3 by Materials Project".  United States.  doi:https://doi.org/10.17188/1679733.  https://www.osti.gov/servlets/purl/1679733. Pub date:Thu Jul 19 00:00:00 EDT 2018

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@article{osti_1679733,

  title        = {Materials Data on Er3Fe2Ge3 by Materials Project},

  author       = {The Materials Project},

  abstractNote = {Er3Fe2Ge3 crystallizes in the orthorhombic Cmcm space group. The structure is three-dimensional. there are two inequivalent Er sites. In the first Er site, Er is bonded in a 2-coordinate geometry to four equivalent Fe and seven Ge atoms. There are a spread of Er–Fe bond distances ranging from 3.02–3.14 Å. There are a spread of Er–Ge bond distances ranging from 2.96–3.28 Å. In the second Er site, Er is bonded in a 5-coordinate geometry to four equivalent Fe and five Ge atoms. All Er–Fe bond lengths are 3.17 Å. There are a spread of Er–Ge bond distances ranging from 2.87–3.25 Å. Fe is bonded in a 4-coordinate geometry to six Er and four Ge atoms. There are a spread of Fe–Ge bond distances ranging from 2.36–2.59 Å. There are two inequivalent Ge sites. In the first Ge site, Ge is bonded in a 10-coordinate geometry to six Er, three equivalent Fe, and one Ge atom. The Ge–Ge bond length is 2.84 Å. In the second Ge site, Ge is bonded in a 9-coordinate geometry to seven Er and two equivalent Fe atoms.},

  doi          = {10.17188/1679733},

  journal      = {},

  number       = ,

  volume       = ,

  place        = {United States},

  year         = {2018},

  month        = {7}

}

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