Materials Data on LaCeC4 by Materials Project

doi:10.17188/1651676

Title: Materials Data on LaCeC4 by Materials Project

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Abstract

CeLaC4 crystallizes in the orthorhombic Cmmm space group. The structure is three-dimensional. Ce3+ is bonded in a distorted q4 geometry to ten C+1.50- atoms. There are two shorter (2.58 Å) and eight longer (2.82 Å) Ce–C bond lengths. La3+ is bonded in a distorted q4 geometry to ten C+1.50- atoms. There are two shorter (2.58 Å) and eight longer (2.82 Å) La–C bond lengths. There are two inequivalent C+1.50- sites. In the first C+1.50- site, C+1.50- is bonded in a 6-coordinate geometry to three equivalent Ce3+, two equivalent La3+, and one C+1.50- atom. The C–C bond length is 1.31 Å. In the second C+1.50- site, C+1.50- is bonded in a 6-coordinate geometry to two equivalent Ce3+, three equivalent La3+, and one C+1.50- atom. The C–C bond length is 1.30 Å.

Authors:: The Materials Project

Publication Date:: 2020-07-23

Other Number(s):: mp-1222943

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; LaCeC4; C-Ce-La

OSTI Identifier:: 1651676

DOI:: https://doi.org/10.17188/1651676

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                    The Materials Project. Materials Data on LaCeC4 by Materials Project.  United States: N. p., 2020. 
        Web.  doi:10.17188/1651676.

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                    The Materials Project. Materials Data on LaCeC4 by Materials Project.  United States.  doi:https://doi.org/10.17188/1651676

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                    The Materials Project. 2020.  
"Materials Data on LaCeC4 by Materials Project".  United States.  doi:https://doi.org/10.17188/1651676.  https://www.osti.gov/servlets/purl/1651676. Pub date:Thu Jul 23 00:00:00 EDT 2020

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@article{osti_1651676,

  title        = {Materials Data on LaCeC4 by Materials Project},

  author       = {The Materials Project},

  abstractNote = {CeLaC4 crystallizes in the orthorhombic Cmmm space group. The structure is three-dimensional. Ce3+ is bonded in a distorted q4 geometry to ten C+1.50- atoms. There are two shorter (2.58 Å) and eight longer (2.82 Å) Ce–C bond lengths. La3+ is bonded in a distorted q4 geometry to ten C+1.50- atoms. There are two shorter (2.58 Å) and eight longer (2.82 Å) La–C bond lengths. There are two inequivalent C+1.50- sites. In the first C+1.50- site, C+1.50- is bonded in a 6-coordinate geometry to three equivalent Ce3+, two equivalent La3+, and one C+1.50- atom. The C–C bond length is 1.31 Å. In the second C+1.50- site, C+1.50- is bonded in a 6-coordinate geometry to two equivalent Ce3+, three equivalent La3+, and one C+1.50- atom. The C–C bond length is 1.30 Å.},

  doi          = {10.17188/1651676},

  journal      = {},

  number       = ,

  volume       = ,

  place        = {United States},

  year         = {2020},

  month        = {7}

}

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DOI: https://doi.org/10.17188/1651676

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