Materials Data on Er5Bi3 by Materials Project

doi:10.17188/1717337

Title: Materials Data on Er5Bi3 by Materials Project

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Abstract

Er5Bi3 crystallizes in the orthorhombic Pnma space group. The structure is three-dimensional. there are four inequivalent Er sites. In the first Er site, Er is bonded in a 5-coordinate geometry to five Bi atoms. There are a spread of Er–Bi bond distances ranging from 3.10–3.52 Å. In the second Er site, Er is bonded in a 6-coordinate geometry to six Bi atoms. There are a spread of Er–Bi bond distances ranging from 3.10–3.55 Å. In the third Er site, Er is bonded to five Bi atoms to form distorted edge-sharing ErBi5 square pyramids. There are a spread of Er–Bi bond distances ranging from 3.18–3.24 Å. In the fourth Er site, Er is bonded in a 5-coordinate geometry to five Bi atoms. There are a spread of Er–Bi bond distances ranging from 3.05–3.37 Å. There are two inequivalent Bi sites. In the first Bi site, Bi is bonded in a 8-coordinate geometry to eight Er atoms. In the second Bi site, Bi is bonded in a 9-coordinate geometry to nine Er atoms.

Authors:: The Materials Project

Publication Date:: 2020-04-29

Other Number(s):: mp-1201625

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; Er5Bi3; Bi-Er

OSTI Identifier:: 1717337

DOI:: https://doi.org/10.17188/1717337

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                    The Materials Project. Materials Data on Er5Bi3 by Materials Project.  United States: N. p., 2020. 
        Web.  doi:10.17188/1717337.

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                    The Materials Project. Materials Data on Er5Bi3 by Materials Project.  United States.  doi:https://doi.org/10.17188/1717337

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                    The Materials Project. 2020.  
"Materials Data on Er5Bi3 by Materials Project".  United States.  doi:https://doi.org/10.17188/1717337.  https://www.osti.gov/servlets/purl/1717337. Pub date:Wed Apr 29 00:00:00 EDT 2020

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@article{osti_1717337,

  title        = {Materials Data on Er5Bi3 by Materials Project},

  author       = {The Materials Project},

  abstractNote = {Er5Bi3 crystallizes in the orthorhombic Pnma space group. The structure is three-dimensional. there are four inequivalent Er sites. In the first Er site, Er is bonded in a 5-coordinate geometry to five Bi atoms. There are a spread of Er–Bi bond distances ranging from 3.10–3.52 Å. In the second Er site, Er is bonded in a 6-coordinate geometry to six Bi atoms. There are a spread of Er–Bi bond distances ranging from 3.10–3.55 Å. In the third Er site, Er is bonded to five Bi atoms to form distorted edge-sharing ErBi5 square pyramids. There are a spread of Er–Bi bond distances ranging from 3.18–3.24 Å. In the fourth Er site, Er is bonded in a 5-coordinate geometry to five Bi atoms. There are a spread of Er–Bi bond distances ranging from 3.05–3.37 Å. There are two inequivalent Bi sites. In the first Bi site, Bi is bonded in a 8-coordinate geometry to eight Er atoms. In the second Bi site, Bi is bonded in a 9-coordinate geometry to nine Er atoms.},

  doi          = {10.17188/1717337},

  journal      = {},

  number       = ,

  volume       = ,

  place        = {United States},

  year         = {2020},

  month        = {4}

}

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DOI: https://doi.org/10.17188/1717337

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