Materials Data on La5Sn3Br by Materials Project

doi:10.17188/1275056

Title: Materials Data on La5Sn3Br by Materials Project

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Abstract

La5Sn3Br crystallizes in the hexagonal P6_3/mcm space group. The structure is three-dimensional. there are two inequivalent La sites. In the first La site, La is bonded in a 7-coordinate geometry to five equivalent Sn and two equivalent Br atoms. There are a spread of La–Sn bond distances ranging from 3.33–3.69 Å. Both La–Br bond lengths are 3.14 Å. In the second La site, La is bonded in a 6-coordinate geometry to six equivalent Sn atoms. All La–Sn bond lengths are 3.49 Å. Sn is bonded in a 9-coordinate geometry to nine La atoms. Br is bonded to six equivalent La atoms to form face-sharing BrLa6 octahedra.

Authors:: The Materials Project

Publication Date:: 2020-07-15

Other Number(s):: mp-569350

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; La5Sn3Br; Br-La-Sn

OSTI Identifier:: 1275056

DOI:: https://doi.org/10.17188/1275056

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                    The Materials Project. Materials Data on La5Sn3Br by Materials Project.  United States: N. p., 2020. 
        Web.  doi:10.17188/1275056.

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                    The Materials Project. Materials Data on La5Sn3Br by Materials Project.  United States.  doi:https://doi.org/10.17188/1275056

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                    The Materials Project. 2020.  
"Materials Data on La5Sn3Br by Materials Project".  United States.  doi:https://doi.org/10.17188/1275056.  https://www.osti.gov/servlets/purl/1275056. Pub date:Wed Jul 15 00:00:00 EDT 2020

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@article{osti_1275056,

  title        = {Materials Data on La5Sn3Br by Materials Project},

  author       = {The Materials Project},

  abstractNote = {La5Sn3Br crystallizes in the hexagonal P6_3/mcm space group. The structure is three-dimensional. there are two inequivalent La sites. In the first La site, La is bonded in a 7-coordinate geometry to five equivalent Sn and two equivalent Br atoms. There are a spread of La–Sn bond distances ranging from 3.33–3.69 Å. Both La–Br bond lengths are 3.14 Å. In the second La site, La is bonded in a 6-coordinate geometry to six equivalent Sn atoms. All La–Sn bond lengths are 3.49 Å. Sn is bonded in a 9-coordinate geometry to nine La atoms. Br is bonded to six equivalent La atoms to form face-sharing BrLa6 octahedra.},

  doi          = {10.17188/1275056},

  journal      = {},

  number       = ,

  volume       = ,

  place        = {United States},

  year         = {2020},

  month        = {7}

}

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DOI: https://doi.org/10.17188/1275056

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