Materials Data on Y3Tl5 by Materials Project

doi:10.17188/1745102

Title: Materials Data on Y3Tl5 by Materials Project

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Abstract

Y3Tl5 crystallizes in the orthorhombic Cmcm space group. The structure is three-dimensional. there are two inequivalent Y sites. In the first Y site, Y is bonded in a 10-coordinate geometry to ten Tl atoms. There are a spread of Y–Tl bond distances ranging from 3.22–3.57 Å. In the second Y site, Y is bonded in a 9-coordinate geometry to nine Tl atoms. There are a spread of Y–Tl bond distances ranging from 3.12–3.51 Å. There are three inequivalent Tl sites. In the first Tl site, Tl is bonded in a 10-coordinate geometry to six Y and four Tl atoms. There are a spread of Tl–Tl bond distances ranging from 3.18–3.32 Å. In the second Tl site, Tl is bonded in a 5-coordinate geometry to five Y and six Tl atoms. Both Tl–Tl bond lengths are 3.29 Å. In the third Tl site, Tl is bonded in a 10-coordinate geometry to six Y and four Tl atoms. The Tl–Tl bond length is 3.29 Å.

Authors:: The Materials Project

Publication Date:: 2020-05-04

Other Number(s):: mp-1207757

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; Y3Tl5; Tl-Y

OSTI Identifier:: 1745102

DOI:: https://doi.org/10.17188/1745102

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                    The Materials Project. Materials Data on Y3Tl5 by Materials Project.  United States: N. p., 2020. 
        Web.  doi:10.17188/1745102.

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                    The Materials Project. Materials Data on Y3Tl5 by Materials Project.  United States.  doi:https://doi.org/10.17188/1745102

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                    The Materials Project. 2020.  
"Materials Data on Y3Tl5 by Materials Project".  United States.  doi:https://doi.org/10.17188/1745102.  https://www.osti.gov/servlets/purl/1745102. Pub date:Mon May 04 00:00:00 EDT 2020

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@article{osti_1745102,

  title        = {Materials Data on Y3Tl5 by Materials Project},

  author       = {The Materials Project},

  abstractNote = {Y3Tl5 crystallizes in the orthorhombic Cmcm space group. The structure is three-dimensional. there are two inequivalent Y sites. In the first Y site, Y is bonded in a 10-coordinate geometry to ten Tl atoms. There are a spread of Y–Tl bond distances ranging from 3.22–3.57 Å. In the second Y site, Y is bonded in a 9-coordinate geometry to nine Tl atoms. There are a spread of Y–Tl bond distances ranging from 3.12–3.51 Å. There are three inequivalent Tl sites. In the first Tl site, Tl is bonded in a 10-coordinate geometry to six Y and four Tl atoms. There are a spread of Tl–Tl bond distances ranging from 3.18–3.32 Å. In the second Tl site, Tl is bonded in a 5-coordinate geometry to five Y and six Tl atoms. Both Tl–Tl bond lengths are 3.29 Å. In the third Tl site, Tl is bonded in a 10-coordinate geometry to six Y and four Tl atoms. The Tl–Tl bond length is 3.29 Å.},

  doi          = {10.17188/1745102},

  journal      = {},

  number       = ,

  volume       = ,

  place        = {United States},

  year         = {2020},

  month        = {5}

}

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DOI: https://doi.org/10.17188/1745102

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