Materials Data on U2Si5Os3 by Materials Project

doi:10.17188/1679617

Title: Materials Data on U2Si5Os3 by Materials Project

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Abstract

U2Os3Si5 crystallizes in the monoclinic C2/c space group. The structure is three-dimensional. U5+ is bonded in a 8-coordinate geometry to six Os2- and ten Si+0.80- atoms. There are a spread of U–Os bond distances ranging from 3.04–3.41 Å. There are a spread of U–Si bond distances ranging from 2.96–3.32 Å. There are two inequivalent Os2- sites. In the first Os2- site, Os2- is bonded in a 6-coordinate geometry to four equivalent U5+ and six Si+0.80- atoms. There are a spread of Os–Si bond distances ranging from 2.41–2.63 Å. In the second Os2- site, Os2- is bonded in a 5-coordinate geometry to four equivalent U5+ and five Si+0.80- atoms. There are a spread of Os–Si bond distances ranging from 2.36–2.49 Å. There are four inequivalent Si+0.80- sites. In the first Si+0.80- site, Si+0.80- is bonded in a 9-coordinate geometry to four equivalent U5+, three Os2-, and two Si+0.80- atoms. There are one shorter (2.51 Å) and one longer (2.57 Å) Si–Si bond lengths. In the second Si+0.80- site, Si+0.80- is bonded in a 3-coordinate geometry to four equivalent U5+, three Os2-, and two equivalent Si+0.80- atoms. In the third Si+0.80- site, Si+0.80- is bonded in a 4-coordinate geometry to four equivalentmore »« less

Authors:: The Materials Project

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

Other Number(s):: mp-1105580

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; U2Si5Os3; Os-Si-U

OSTI Identifier:: 1679617

DOI:: https://doi.org/10.17188/1679617

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                    The Materials Project. Materials Data on U2Si5Os3 by Materials Project.  United States: N. p., 2020. 
        Web.  doi:10.17188/1679617.

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                    The Materials Project. Materials Data on U2Si5Os3 by Materials Project.  United States.  doi:https://doi.org/10.17188/1679617

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                    The Materials Project. 2020.  
"Materials Data on U2Si5Os3 by Materials Project".  United States.  doi:https://doi.org/10.17188/1679617.  https://www.osti.gov/servlets/purl/1679617. Pub date:Sun May 03 00:00:00 EDT 2020

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@article{osti_1679617,

  title        = {Materials Data on U2Si5Os3 by Materials Project},

  author       = {The Materials Project},

  abstractNote = {U2Os3Si5 crystallizes in the monoclinic C2/c space group. The structure is three-dimensional. U5+ is bonded in a 8-coordinate geometry to six Os2- and ten Si+0.80- atoms. There are a spread of U–Os bond distances ranging from 3.04–3.41 Å. There are a spread of U–Si bond distances ranging from 2.96–3.32 Å. There are two inequivalent Os2- sites. In the first Os2- site, Os2- is bonded in a 6-coordinate geometry to four equivalent U5+ and six Si+0.80- atoms. There are a spread of Os–Si bond distances ranging from 2.41–2.63 Å. In the second Os2- site, Os2- is bonded in a 5-coordinate geometry to four equivalent U5+ and five Si+0.80- atoms. There are a spread of Os–Si bond distances ranging from 2.36–2.49 Å. There are four inequivalent Si+0.80- sites. In the first Si+0.80- site, Si+0.80- is bonded in a 9-coordinate geometry to four equivalent U5+, three Os2-, and two Si+0.80- atoms. There are one shorter (2.51 Å) and one longer (2.57 Å) Si–Si bond lengths. In the second Si+0.80- site, Si+0.80- is bonded in a 3-coordinate geometry to four equivalent U5+, three Os2-, and two equivalent Si+0.80- atoms. In the third Si+0.80- site, Si+0.80- is bonded in a 4-coordinate geometry to four equivalent U5+ and four equivalent Os2- atoms. In the fourth Si+0.80- site, Si+0.80- is bonded in a 3-coordinate geometry to four equivalent U5+, three Os2-, and two equivalent Si+0.80- atoms.},

  doi          = {10.17188/1679617},

  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/10.17188/1679617

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