Materials Data on La3(GaRh)2 by Materials Project

doi:10.17188/1743368

Title: Materials Data on La3(GaRh)2 by Materials Project

Dataset
Other Related Research

Abstract

La3(RhGa)2 crystallizes in the orthorhombic Pbcm space group. The structure is three-dimensional. there are two inequivalent La sites. In the first La site, La is bonded in a 9-coordinate geometry to four equivalent Rh and five Ga atoms. There are two shorter (3.21 Å) and two longer (3.24 Å) La–Rh bond lengths. There are a spread of La–Ga bond distances ranging from 3.13–3.42 Å. In the second La site, La is bonded in a 7-coordinate geometry to four equivalent Rh and five Ga atoms. There are a spread of La–Rh bond distances ranging from 2.91–3.30 Å. There are a spread of La–Ga bond distances ranging from 3.25–3.46 Å. Rh is bonded in a 9-coordinate geometry to six La and three Ga atoms. There are a spread of Rh–Ga bond distances ranging from 2.59–2.70 Å. There are two inequivalent Ga sites. In the first Ga site, Ga is bonded in a 9-coordinate geometry to seven La and two equivalent Rh atoms. In the second Ga site, Ga is bonded to eight La and four equivalent Rh atoms to form a mixture of distorted face, edge, and corner-sharing GaLa8Rh4 cuboctahedra.

Authors:: The Materials Project

Publication Date:: Thu Apr 30 00:00:00 EDT 2020

Other Number(s):: mp-1211591

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; La3(GaRh)2; Ga-La-Rh

OSTI Identifier:: 1743368

DOI:: https://doi.org/10.17188/1743368

Citation Formats


                    The Materials Project. Materials Data on La3(GaRh)2 by Materials Project.  United States: N. p., 2020. 
        Web.  doi:10.17188/1743368.

Copy to clipboard


                    The Materials Project. Materials Data on La3(GaRh)2 by Materials Project.  United States.  doi:https://doi.org/10.17188/1743368

Copy to clipboard


                    The Materials Project. 2020.  
"Materials Data on La3(GaRh)2 by Materials Project".  United States.  doi:https://doi.org/10.17188/1743368.  https://www.osti.gov/servlets/purl/1743368. Pub date:Thu Apr 30 00:00:00 EDT 2020

Copy to clipboard


                    
@article{osti_1743368,

  title        = {Materials Data on La3(GaRh)2 by Materials Project},

  author       = {The Materials Project},

  abstractNote = {La3(RhGa)2 crystallizes in the orthorhombic Pbcm space group. The structure is three-dimensional. there are two inequivalent La sites. In the first La site, La is bonded in a 9-coordinate geometry to four equivalent Rh and five Ga atoms. There are two shorter (3.21 Å) and two longer (3.24 Å) La–Rh bond lengths. There are a spread of La–Ga bond distances ranging from 3.13–3.42 Å. In the second La site, La is bonded in a 7-coordinate geometry to four equivalent Rh and five Ga atoms. There are a spread of La–Rh bond distances ranging from 2.91–3.30 Å. There are a spread of La–Ga bond distances ranging from 3.25–3.46 Å. Rh is bonded in a 9-coordinate geometry to six La and three Ga atoms. There are a spread of Rh–Ga bond distances ranging from 2.59–2.70 Å. There are two inequivalent Ga sites. In the first Ga site, Ga is bonded in a 9-coordinate geometry to seven La and two equivalent Rh atoms. In the second Ga site, Ga is bonded to eight La and four equivalent Rh atoms to form a mixture of distorted face, edge, and corner-sharing GaLa8Rh4 cuboctahedra.},

  doi          = {10.17188/1743368},

  journal      = {},

  number       = ,

  volume       = ,

  place        = {United States},

  year         = {Thu Apr 30 00:00:00 EDT 2020},

  month        = {Thu Apr 30 00:00:00 EDT 2020}

}

Copy to clipboard

Dataset:

View Dataset

DOI: https://doi.org/10.17188/1743368

Save / Share:

Export Metadata

Save to My Library

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

Materials Data on La3(Sn3Pd2)2 by Materials Project

Dataset The Materials Project

La3Pd4Sn6 crystallizes in the orthorhombic Pnma space group. The structure is three-dimensional. there are three inequivalent La sites. In the first La site, La is bonded in a 6-coordinate geometry to six Pd and nine Sn atoms. There are a spread of La–Pd bond distances ranging from 3.46–3.56 Å. There are a spread of La–Sn bond distances ranging from 3.50–3.74 Å. In the second La site, La is bonded in a 12-coordinate geometry to six Pd and nine Sn atoms. There are a spread of La–Pd bond distances ranging from 3.37–3.62 Å. There are a spread of La–Sn bond distancesmore »« less
Materials Data on La3(VN3)2 by Materials Project

Dataset The Materials Project

La3V2N6 crystallizes in the tetragonal I4/mmm space group. The structure is three-dimensional. there are two inequivalent La3+ sites. In the first La3+ site, La3+ is bonded in a body-centered cubic geometry to eight equivalent N3- atoms. All La–N bond lengths are 2.62 Å. In the second La3+ site, La3+ is bonded in a 9-coordinate geometry to nine N3- atoms. There are a spread of La–N bond distances ranging from 2.58–2.78 Å. V+4.50+ is bonded to five N3- atoms to form corner-sharing VN5 square pyramids. There is one shorter (1.81 Å) and four longer (1.98 Å) V–N bond length. There aremore »« less
Materials Data on La3(B3Ru4)2 by Materials Project

Dataset The Materials Project

La3Ru8B6 crystallizes in the orthorhombic Fmmm space group. The structure is three-dimensional. there are three inequivalent La sites. In the first La site, La is bonded in a 12-coordinate geometry to two La, twelve Ru, and six equivalent B atoms. Both La–La bond lengths are 3.21 Å. There are four shorter (3.19 Å) and eight longer (3.21 Å) La–Ru bond lengths. There are four shorter (3.25 Å) and two longer (3.26 Å) La–B bond lengths. In the second La site, La is bonded in a 6-coordinate geometry to one La, ten Ru, and eight equivalent B atoms. There are amore »« less
Materials Data on La3(TaN3)2 by Materials Project

Dataset The Materials Project

La3(TaN3)2 crystallizes in the tetragonal I4/mmm space group. The structure is three-dimensional. there are two inequivalent La3+ sites. In the first La3+ site, La3+ is bonded in a 1-coordinate geometry to nine N3- atoms. There are a spread of La–N bond distances ranging from 2.45–2.91 Å. In the second La3+ site, La3+ is bonded in a body-centered cubic geometry to eight equivalent N3- atoms. All La–N bond lengths are 2.68 Å. Ta+4.50+ is bonded to five N3- atoms to form corner-sharing TaN5 square pyramids. There are one shorter (1.96 Å) and four longer (2.07 Å) Ta–N bond lengths. There aremore »« less
Materials Data on La3(AlI)2 by Materials Project

Dataset The Materials Project

La3(AlI)2 crystallizes in the monoclinic C2/m space group. The structure is three-dimensional. there are three inequivalent La sites. In the first La site, La is bonded in a 2-coordinate geometry to four Al and two equivalent I atoms. There are a spread of La–Al bond distances ranging from 3.21–3.33 Å. Both La–I bond lengths are 3.23 Å. In the second La site, La is bonded to three Al and four I atoms to form distorted edge-sharing LaAl3I4 pentagonal bipyramids. There are two shorter (3.19 Å) and one longer (3.31 Å) La–Al bond lengths. There are a spread of La–I bondmore »« less

Similar Records