Materials Data on UBC by Materials Project

doi:10.17188/1276863

Title: Materials Data on UBC by Materials Project

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Abstract

UCB1 crystallizes in the orthorhombic Cmcm space group. The structure is two-dimensional and consists of two UCB1 sheets oriented in the (0, 1, 0) direction. U6+ is bonded in a 5-coordinate geometry to five equivalent C3- atoms. There are one shorter (2.34 Å) and four longer (2.47 Å) U–C bond lengths. B3- is bonded in a distorted single-bond geometry to one C3- atom. The B–C bond length is 1.58 Å. C3- is bonded to five equivalent U6+ and one B3- atom to form a mixture of distorted corner and edge-sharing CU5B octahedra. The corner-sharing octahedral tilt angles are 16°.

Authors:: The Materials Project

Publication Date:: 2020-07-16

Other Number(s):: mp-5816

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; UBC; B-C-U

OSTI Identifier:: 1276863

DOI:: https://doi.org/10.17188/1276863

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                    The Materials Project. Materials Data on UBC by Materials Project.  United States: N. p., 2020. 
        Web.  doi:10.17188/1276863.

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                    The Materials Project. Materials Data on UBC by Materials Project.  United States.  doi:https://doi.org/10.17188/1276863

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                    The Materials Project. 2020.  
"Materials Data on UBC by Materials Project".  United States.  doi:https://doi.org/10.17188/1276863.  https://www.osti.gov/servlets/purl/1276863. Pub date:Thu Jul 16 00:00:00 EDT 2020

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@article{osti_1276863,

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

  author       = {The Materials Project},

  abstractNote = {UCB1 crystallizes in the orthorhombic Cmcm space group. The structure is two-dimensional and consists of two UCB1 sheets oriented in the (0, 1, 0) direction. U6+ is bonded in a 5-coordinate geometry to five equivalent C3- atoms. There are one shorter (2.34 Å) and four longer (2.47 Å) U–C bond lengths. B3- is bonded in a distorted single-bond geometry to one C3- atom. The B–C bond length is 1.58 Å. C3- is bonded to five equivalent U6+ and one B3- atom to form a mixture of distorted corner and edge-sharing CU5B octahedra. The corner-sharing octahedral tilt angles are 16°.},

  doi          = {10.17188/1276863},

  journal      = {},

  number       = ,

  volume       = ,

  place        = {United States},

  year         = {2020},

  month        = {7}

}

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DOI: https://doi.org/10.17188/1276863

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