Materials Data on PrSiOs2C by Materials Project

doi:10.17188/1738944

Title: Materials Data on PrSiOs2C by Materials Project

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Abstract

PrOs2SiC crystallizes in the orthorhombic Cmcm space group. The structure is three-dimensional. Pr3+ is bonded in a distorted rectangular see-saw-like geometry to four equivalent C4- atoms. All Pr–C bond lengths are 2.75 Å. Os+1.50- is bonded in a 1-coordinate geometry to three equivalent Si4+ and one C4- atom. All Os–Si bond lengths are 2.52 Å. The Os–C bond length is 1.90 Å. Si4+ is bonded in a 6-coordinate geometry to six equivalent Os+1.50- atoms. C4- is bonded to four equivalent Pr3+ and two equivalent Os+1.50- atoms to form a mixture of edge and corner-sharing CPr4Os2 octahedra. The corner-sharing octahedral tilt angles are 23°.

Authors:: The Materials Project

Publication Date:: 2020-05-03

Other Number(s):: mp-1209299

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; PrSiOs2C; C-Os-Pr-Si

OSTI Identifier:: 1738944

DOI:: https://doi.org/10.17188/1738944

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                    The Materials Project. Materials Data on PrSiOs2C by Materials Project.  United States: N. p., 2020. 
        Web.  doi:10.17188/1738944.

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                    The Materials Project. Materials Data on PrSiOs2C by Materials Project.  United States.  doi:https://doi.org/10.17188/1738944

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                    The Materials Project. 2020.  
"Materials Data on PrSiOs2C by Materials Project".  United States.  doi:https://doi.org/10.17188/1738944.  https://www.osti.gov/servlets/purl/1738944. Pub date:Sun May 03 00:00:00 EDT 2020

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@article{osti_1738944,

  title        = {Materials Data on PrSiOs2C by Materials Project},

  author       = {The Materials Project},

  abstractNote = {PrOs2SiC crystallizes in the orthorhombic Cmcm space group. The structure is three-dimensional. Pr3+ is bonded in a distorted rectangular see-saw-like geometry to four equivalent C4- atoms. All Pr–C bond lengths are 2.75 Å. Os+1.50- is bonded in a 1-coordinate geometry to three equivalent Si4+ and one C4- atom. All Os–Si bond lengths are 2.52 Å. The Os–C bond length is 1.90 Å. Si4+ is bonded in a 6-coordinate geometry to six equivalent Os+1.50- atoms. C4- is bonded to four equivalent Pr3+ and two equivalent Os+1.50- atoms to form a mixture of edge and corner-sharing CPr4Os2 octahedra. The corner-sharing octahedral tilt angles are 23°.},

  doi          = {10.17188/1738944},

  journal      = {},

  number       = ,

  volume       = ,

  place        = {United States},

  year         = {2020},

  month        = {5}

}

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DOI: https://doi.org/10.17188/1738944

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