Materials Data on Ce3(SiRh)2 by Materials Project

doi:10.17188/1315870

Title: Materials Data on Ce3(SiRh)2 by Materials Project

Dataset
Other Related Research

Abstract

Ce3(RhSi)2 crystallizes in the orthorhombic Pbcm space group. The structure is three-dimensional. there are two inequivalent Ce sites. In the first Ce site, Ce is bonded in a 9-coordinate geometry to four equivalent Rh and five Si atoms. There are two shorter (3.03 Å) and two longer (3.12 Å) Ce–Rh bond lengths. There are a spread of Ce–Si bond distances ranging from 3.00–3.29 Å. In the second Ce site, Ce is bonded in a 7-coordinate geometry to four equivalent Rh and five Si atoms. There are two shorter (2.91 Å) and two longer (3.11 Å) Ce–Rh bond lengths. There are a spread of Ce–Si bond distances ranging from 3.03–3.37 Å. Rh is bonded in a 9-coordinate geometry to six Ce and three Si atoms. There are a spread of Rh–Si bond distances ranging from 2.49–2.58 Å. There are two inequivalent Si sites. In the first Si site, Si is bonded to eight Ce and four equivalent Rh atoms to form a mixture of distorted edge, corner, and face-sharing SiCe8Rh4 cuboctahedra. In the second Si site, Si is bonded in a 9-coordinate geometry to seven Ce and two equivalent Rh atoms.

Publication Date:: Thu Jul 23 04:00:00 UTC 2020

Other Number(s):: mp-978253

DOE Contract Number:: AC02-05CH11231

Research Org.:: LBNL Materials Project; Lawrence Berkeley National Laboratory (LBNL), Berkeley, CA (United States)

Sponsoring Org.:: USDOE Office of Science (SC), Basic Energy Sciences (BES) (SC-22)

Collaborations:: The Materials Project; MIT; UC Berkeley; Duke; U Louvain

Subject:: 36 MATERIALS SCIENCE; Ce-Rh-Si; Ce3(SiRh)2; crystal structure

OSTI Identifier:: 1315870

DOI:: https://doi.org/10.17188/1315870

Citation Formats


                    Materials Data on Ce3(SiRh)2 by Materials Project.  United States: N. p., 2020. 
        Web.  doi:10.17188/1315870.

Copy to clipboard


                    Materials Data on Ce3(SiRh)2 by Materials Project.  United States.  doi:https://doi.org/10.17188/1315870

Copy to clipboard


                    2020.  
"Materials Data on Ce3(SiRh)2 by Materials Project".  United States.  doi:https://doi.org/10.17188/1315870.  https://www.osti.gov/servlets/purl/1315870. Pub date:Thu Jul 23 04:00:00 UTC 2020

Copy to clipboard


                    
@article{osti_1315870,

  title        = {Materials Data on Ce3(SiRh)2 by Materials Project},

  
  abstractNote = {Ce3(RhSi)2 crystallizes in the orthorhombic Pbcm space group. The structure is three-dimensional. there are two inequivalent Ce sites. In the first Ce site, Ce is bonded in a 9-coordinate geometry to four equivalent Rh and five Si atoms. There are two shorter (3.03 Å) and two longer (3.12 Å) Ce–Rh bond lengths. There are a spread of Ce–Si bond distances ranging from 3.00–3.29 Å. In the second Ce site, Ce is bonded in a 7-coordinate geometry to four equivalent Rh and five Si atoms. There are two shorter (2.91 Å) and two longer (3.11 Å) Ce–Rh bond lengths. There are a spread of Ce–Si bond distances ranging from 3.03–3.37 Å. Rh is bonded in a 9-coordinate geometry to six Ce and three Si atoms. There are a spread of Rh–Si bond distances ranging from 2.49–2.58 Å. There are two inequivalent Si sites. In the first Si site, Si is bonded to eight Ce and four equivalent Rh atoms to form a mixture of distorted edge, corner, and face-sharing SiCe8Rh4 cuboctahedra. In the second Si site, Si is bonded in a 9-coordinate geometry to seven Ce and two equivalent Rh atoms.},

  doi          = {10.17188/1315870},

  journal      = {},

  number       = ,

  volume       = ,

  place        = {United States},

  year         = {Thu Jul 23 04:00:00 UTC 2020},

  month        = {Thu Jul 23 04:00:00 UTC 2020}

}

Copy to clipboard

Dataset:

View Dataset

DOI: https://doi.org/10.17188/1315870

Save / Share:

Export Metadata

Save to My Library

Similar records in DOE Data Explorer and OSTI.GOV collections:

Materials Data on Y3(SiRh)2 by Materials Project

Dataset

Y3(RhSi)2 crystallizes in the orthorhombic Pbcm space group. The structure is three-dimensional. there are two inequivalent Y sites. In the first Y site, Y is bonded in a 6-coordinate geometry to four equivalent Rh and five Si atoms. There are a spread of Y–Rh bond distances ranging from 2.90–3.10 Å. There are a spread of Y–Si bond distances ranging from 2.96–3.40 Å. In the second Y site, Y is bonded in a 9-coordinate geometry to four equivalent Rh and five Si atoms. There are two shorter (3.02 Å) and two longer (3.10 Å) Y–Rh bond lengths. There are a spreadmore »« less
Materials Data on Er(SiRh)2 by Materials Project

Dataset

ErRh2Si2 crystallizes in the tetragonal I4/mmm space group. The structure is three-dimensional. Er is bonded in a 8-coordinate geometry to eight equivalent Rh and eight equivalent Si atoms. All Er–Rh bond lengths are 3.21 Å. All Er–Si bond lengths are 3.11 Å. Rh is bonded to four equivalent Er and four equivalent Si atoms to form a mixture of distorted corner, edge, and face-sharing RhEr4Si4 tetrahedra. All Rh–Si bond lengths are 2.40 Å. Si is bonded in a 9-coordinate geometry to four equivalent Er, four equivalent Rh, and one Si atom. The Si–Si bond length is 2.41 Å.
Materials Data on Pu(SiRh)2 by Materials Project

Dataset

Pu(RhSi)2 crystallizes in the tetragonal I4/mmm space group. The structure is three-dimensional. Pu is bonded in a 8-coordinate geometry to eight equivalent Rh and eight equivalent Si atoms. All Pu–Rh bond lengths are 3.23 Å. All Pu–Si bond lengths are 3.08 Å. Rh is bonded to four equivalent Pu and four equivalent Si atoms to form a mixture of distorted corner, edge, and face-sharing RhPu4Si4 tetrahedra. All Rh–Si bond lengths are 2.41 Å. Si is bonded in a 9-coordinate geometry to four equivalent Pu, four equivalent Rh, and one Si atom. The Si–Si bond length is 2.38 Å.
Materials Data on Th(SiRh)2 by Materials Project

Dataset

Th(RhSi)2 crystallizes in the tetragonal I4/mmm space group. The structure is three-dimensional. Th is bonded in a 8-coordinate geometry to eight equivalent Rh and eight equivalent Si atoms. All Th–Rh bond lengths are 3.28 Å. All Th–Si bond lengths are 3.17 Å. Rh is bonded to four equivalent Th and four equivalent Si atoms to form a mixture of distorted corner, edge, and face-sharing RhTh4Si4 tetrahedra. All Rh–Si bond lengths are 2.44 Å. Si is bonded in a 9-coordinate geometry to four equivalent Th, four equivalent Rh, and one Si atom. The Si–Si bond length is 2.46 Å.
Materials Data on Pr(SiRh)2 by Materials Project

Dataset

PrRh2Si2 crystallizes in the tetragonal I4/mmm space group. The structure is three-dimensional. Pr is bonded in a 8-coordinate geometry to eight equivalent Rh and eight equivalent Si atoms. All Pr–Rh bond lengths are 3.29 Å. All Pr–Si bond lengths are 3.19 Å. Rh is bonded to four equivalent Pr and four equivalent Si atoms to form a mixture of distorted face, edge, and corner-sharing RhPr4Si4 tetrahedra. All Rh–Si bond lengths are 2.43 Å. Si is bonded in a 9-coordinate geometry to four equivalent Pr, four equivalent Rh, and one Si atom. The Si–Si bond length is 2.57 Å.

Similar Records