Materials Data on Ca(AlGa)2 by Materials Project

doi:10.17188/1313518

Title: Materials Data on Ca(AlGa)2 by Materials Project

Dataset
Other Related Research

Abstract

Ca(GaAl)2 crystallizes in the tetragonal I4/mmm space group. The structure is three-dimensional. Ca is bonded in a 8-coordinate geometry to eight equivalent Ga and eight equivalent Al atoms. All Ca–Ga bond lengths are 3.28 Å. All Ca–Al bond lengths are 3.49 Å. Ga is bonded in a 9-coordinate geometry to four equivalent Ca, one Ga, and four equivalent Al atoms. The Ga–Ga bond length is 2.49 Å. All Ga–Al bond lengths are 2.62 Å. Al is bonded to four equivalent Ca and four equivalent Ga atoms to form a mixture of distorted edge, face, and corner-sharing AlCa4Ga4 tetrahedra.

Publication Date:: Wed Jul 15 00:00:00 EDT 2020

Other Number(s):: mp-9690

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; Al-Ca-Ga; Ca(AlGa)2; crystal structure

OSTI Identifier:: 1313518

DOI:: https://doi.org/10.17188/1313518

Citation Formats


                    Materials Data on Ca(AlGa)2 by Materials Project.  United States: N. p., 2020. 
        Web.  doi:10.17188/1313518.

Copy to clipboard


                    Materials Data on Ca(AlGa)2 by Materials Project.  United States.  doi:https://doi.org/10.17188/1313518

Copy to clipboard


                    2020.  
"Materials Data on Ca(AlGa)2 by Materials Project".  United States.  doi:https://doi.org/10.17188/1313518.  https://www.osti.gov/servlets/purl/1313518. Pub date:Wed Jul 15 00:00:00 EDT 2020

Copy to clipboard


                    
@article{osti_1313518,

  title        = {Materials Data on Ca(AlGa)2 by Materials Project},

  
  abstractNote = {Ca(GaAl)2 crystallizes in the tetragonal I4/mmm space group. The structure is three-dimensional. Ca is bonded in a 8-coordinate geometry to eight equivalent Ga and eight equivalent Al atoms. All Ca–Ga bond lengths are 3.28 Å. All Ca–Al bond lengths are 3.49 Å. Ga is bonded in a 9-coordinate geometry to four equivalent Ca, one Ga, and four equivalent Al atoms. The Ga–Ga bond length is 2.49 Å. All Ga–Al bond lengths are 2.62 Å. Al is bonded to four equivalent Ca and four equivalent Ga atoms to form a mixture of distorted edge, face, and corner-sharing AlCa4Ga4 tetrahedra.},

  doi          = {10.17188/1313518},

  journal      = {},

  number       = ,

  volume       = ,

  place        = {United States},

  year         = {Wed Jul 15 00:00:00 EDT 2020},

  month        = {Wed Jul 15 00:00:00 EDT 2020}

}

Copy to clipboard

Dataset:

View Dataset

DOI: https://doi.org/10.17188/1313518

Save / Share:

Export Metadata

Save to My Library

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

Materials Data on Eu(AlGa)2 by Materials Project

Dataset

EuAl2Ga2 crystallizes in the tetragonal I4/mmm space group. The structure is three-dimensional. Eu is bonded in a 8-coordinate geometry to eight equivalent Ga and eight equivalent Al atoms. All Eu–Ga bond lengths are 3.31 Å. All Eu–Al bond lengths are 3.50 Å. Ga is bonded in a 9-coordinate geometry to four equivalent Eu, one Ga, and four equivalent Al atoms. The Ga–Ga bond length is 2.51 Å. All Ga–Al bond lengths are 2.63 Å. Al is bonded to four equivalent Eu and four equivalent Ga atoms to form a mixture of distorted corner, edge, and face-sharing AlEu4Ga4 tetrahedra.
Materials Data on Ce(AlGa)2 by Materials Project

Dataset

CeGa2Al2 crystallizes in the tetragonal I4/mmm space group. The structure is three-dimensional. Ce is bonded in a 8-coordinate geometry to eight equivalent Ga and eight equivalent Al atoms. All Ce–Ga bond lengths are 3.21 Å. All Ce–Al bond lengths are 3.50 Å. Ga is bonded in a 9-coordinate geometry to four equivalent Ce, one Ga, and four equivalent Al atoms. The Ga–Ga bond length is 2.50 Å. All Ga–Al bond lengths are 2.61 Å. Al is bonded to four equivalent Ce and four equivalent Ga atoms to form a mixture of distorted corner, edge, and face-sharing AlCe4Ga4 tetrahedra.
Materials Data on Yb(AlGa)2 by Materials Project

Dataset

YbAl2Ga2 crystallizes in the tetragonal I4/mmm space group. The structure is three-dimensional. Yb is bonded in a 8-coordinate geometry to eight equivalent Ga and eight equivalent Al atoms. All Yb–Ga bond lengths are 3.25 Å. All Yb–Al bond lengths are 3.46 Å. Ga is bonded in a 9-coordinate geometry to four equivalent Yb, one Ga, and four equivalent Al atoms. The Ga–Ga bond length is 2.46 Å. All Ga–Al bond lengths are 2.60 Å. Al is bonded to four equivalent Yb and four equivalent Ga atoms to form a mixture of distorted face, edge, and corner-sharing AlYb4Ga4 tetrahedra.
Materials Data on Nd(AlGa)2 by Materials Project

Dataset

NdAl2Ga2 crystallizes in the tetragonal I4/mmm space group. The structure is three-dimensional. Nd is bonded in a 8-coordinate geometry to eight equivalent Ga and eight equivalent Al atoms. All Nd–Ga bond lengths are 3.24 Å. All Nd–Al bond lengths are 3.51 Å. Ga is bonded in a 9-coordinate geometry to four equivalent Nd, one Ga, and four equivalent Al atoms. The Ga–Ga bond length is 2.51 Å. All Ga–Al bond lengths are 2.62 Å. Al is bonded to four equivalent Nd and four equivalent Ga atoms to form a mixture of distorted face, edge, and corner-sharing AlNd4Ga4 tetrahedra.
Materials Data on La(AlGa)2 by Materials Project

Dataset

LaAl2Ga2 crystallizes in the tetragonal I4/mmm space group. The structure is three-dimensional. La is bonded in a 8-coordinate geometry to eight equivalent Ga and eight equivalent Al atoms. All La–Ga bond lengths are 3.29 Å. All La–Al bond lengths are 3.52 Å. Ga is bonded in a 9-coordinate geometry to four equivalent La, one Ga, and four equivalent Al atoms. The Ga–Ga bond length is 2.56 Å. All Ga–Al bond lengths are 2.63 Å. Al is bonded to four equivalent La and four equivalent Ga atoms to form a mixture of distorted corner, edge, and face-sharing AlLa4Ga4 tetrahedra.

Similar Records