Materials Data on Ho3Tl5 by Materials Project

doi:10.17188/1655365

Title: Materials Data on Ho3Tl5 by Materials Project

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Abstract

Ho3Tl5 crystallizes in the orthorhombic Cmcm space group. The structure is three-dimensional. there are two inequivalent Ho sites. In the first Ho site, Ho is bonded in a 9-coordinate geometry to nine Tl atoms. There are a spread of Ho–Tl bond distances ranging from 3.06–3.49 Å. In the second Ho site, Ho is bonded in a 10-coordinate geometry to ten Tl atoms. There are a spread of Ho–Tl bond distances ranging from 3.21–3.50 Å. There are three inequivalent Tl sites. In the first Tl site, Tl is bonded in a 5-coordinate geometry to five Ho and six Tl atoms. There are two shorter (3.24 Å) and four longer (3.27 Å) Tl–Tl bond lengths. In the second Tl site, Tl is bonded in a 10-coordinate geometry to six Ho and four Tl atoms. There are two shorter (3.22 Å) and one longer (3.30 Å) Tl–Tl bond lengths. In the third Tl site, Tl is bonded in a 10-coordinate geometry to six Ho and four Tl atoms.

Authors:: The Materials Project

Publication Date:: Fri Jan 11 00:00:00 EST 2019

Other Number(s):: mp-1188242

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; Ho3Tl5; Ho-Tl

OSTI Identifier:: 1655365

DOI:: https://doi.org/10.17188/1655365

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                    The Materials Project. Materials Data on Ho3Tl5 by Materials Project.  United States: N. p., 2019. 
        Web.  doi:10.17188/1655365.

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                    The Materials Project. Materials Data on Ho3Tl5 by Materials Project.  United States.  doi:https://doi.org/10.17188/1655365

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                    The Materials Project. 2019.  
"Materials Data on Ho3Tl5 by Materials Project".  United States.  doi:https://doi.org/10.17188/1655365.  https://www.osti.gov/servlets/purl/1655365. Pub date:Fri Jan 11 00:00:00 EST 2019

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@article{osti_1655365,

  title        = {Materials Data on Ho3Tl5 by Materials Project},

  author       = {The Materials Project},

  abstractNote = {Ho3Tl5 crystallizes in the orthorhombic Cmcm space group. The structure is three-dimensional. there are two inequivalent Ho sites. In the first Ho site, Ho is bonded in a 9-coordinate geometry to nine Tl atoms. There are a spread of Ho–Tl bond distances ranging from 3.06–3.49 Å. In the second Ho site, Ho is bonded in a 10-coordinate geometry to ten Tl atoms. There are a spread of Ho–Tl bond distances ranging from 3.21–3.50 Å. There are three inequivalent Tl sites. In the first Tl site, Tl is bonded in a 5-coordinate geometry to five Ho and six Tl atoms. There are two shorter (3.24 Å) and four longer (3.27 Å) Tl–Tl bond lengths. In the second Tl site, Tl is bonded in a 10-coordinate geometry to six Ho and four Tl atoms. There are two shorter (3.22 Å) and one longer (3.30 Å) Tl–Tl bond lengths. In the third Tl site, Tl is bonded in a 10-coordinate geometry to six Ho and four Tl atoms.},

  doi          = {10.17188/1655365},

  journal      = {},

  number       = ,

  volume       = ,

  place        = {United States},

  year         = {Fri Jan 11 00:00:00 EST 2019},

  month        = {Fri Jan 11 00:00:00 EST 2019}

}

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DOI: https://doi.org/10.17188/1655365

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