Materials Data on Er5Ge3C by Materials Project

doi:10.17188/1753593

Title: Materials Data on Er5Ge3C by Materials Project

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Abstract

Er5Ge3C crystallizes in the hexagonal P6_3/mcm space group. The structure is three-dimensional. there are two inequivalent Er sites. In the first Er site, Er is bonded in a 6-coordinate geometry to six equivalent Ge atoms. All Er–Ge bond lengths are 3.02 Å. In the second Er site, Er is bonded in a 2-coordinate geometry to five equivalent Ge and two equivalent C atoms. There are a spread of Er–Ge bond distances ranging from 2.98–3.57 Å. Both Er–C bond lengths are 2.46 Å. Ge is bonded in a 9-coordinate geometry to nine Er atoms. C is bonded to six equivalent Er atoms to form face-sharing CEr6 octahedra.

Authors:: The Materials Project

Publication Date:: Sun May 03 00:00:00 EDT 2020

Other Number(s):: mp-1105712

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; Er5Ge3C; C-Er-Ge

OSTI Identifier:: 1753593

DOI:: https://doi.org/10.17188/1753593

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                    The Materials Project. Materials Data on Er5Ge3C by Materials Project.  United States: N. p., 2020. 
        Web.  doi:10.17188/1753593.

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                    The Materials Project. Materials Data on Er5Ge3C by Materials Project.  United States.  doi:https://doi.org/10.17188/1753593

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                    The Materials Project. 2020.  
"Materials Data on Er5Ge3C by Materials Project".  United States.  doi:https://doi.org/10.17188/1753593.  https://www.osti.gov/servlets/purl/1753593. Pub date:Sun May 03 00:00:00 EDT 2020

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@article{osti_1753593,

  title        = {Materials Data on Er5Ge3C by Materials Project},

  author       = {The Materials Project},

  abstractNote = {Er5Ge3C crystallizes in the hexagonal P6_3/mcm space group. The structure is three-dimensional. there are two inequivalent Er sites. In the first Er site, Er is bonded in a 6-coordinate geometry to six equivalent Ge atoms. All Er–Ge bond lengths are 3.02 Å. In the second Er site, Er is bonded in a 2-coordinate geometry to five equivalent Ge and two equivalent C atoms. There are a spread of Er–Ge bond distances ranging from 2.98–3.57 Å. Both Er–C bond lengths are 2.46 Å. Ge is bonded in a 9-coordinate geometry to nine Er atoms. C is bonded to six equivalent Er atoms to form face-sharing CEr6 octahedra.},

  doi          = {10.17188/1753593},

  journal      = {},

  number       = ,

  volume       = ,

  place        = {United States},

  year         = {Sun May 03 00:00:00 EDT 2020},

  month        = {Sun May 03 00:00:00 EDT 2020}

}

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DOI: https://doi.org/10.17188/1753593

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