Materials Data on Cd(AgI2)2 by Materials Project

doi:10.17188/1355258

Title: Materials Data on Cd(AgI2)2 by Materials Project

Dataset
Other Related Research

Abstract

Ag2CdI4 crystallizes in the tetragonal I-42m space group. The structure is three-dimensional. Ag1+ is bonded to four equivalent I1- atoms to form AgI4 tetrahedra that share corners with four equivalent AgI4 tetrahedra and corners with four equivalent CdI4 tetrahedra. All Ag–I bond lengths are 2.88 Å. Cd2+ is bonded to four equivalent I1- atoms to form CdI4 tetrahedra that share corners with eight equivalent AgI4 tetrahedra. All Cd–I bond lengths are 2.86 Å. I1- is bonded in a trigonal non-coplanar geometry to two equivalent Ag1+ and one Cd2+ atom.

Publication Date:: 2020-07-16

Other Number(s):: mp-1025377

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; Ag-Cd-I; Cd(AgI2)2; crystal structure

OSTI Identifier:: 1355258

DOI:: https://doi.org/10.17188/1355258

Citation Formats


                    Materials Data on Cd(AgI2)2 by Materials Project.  United States: N. p., 2020. 
        Web.  doi:10.17188/1355258.

Copy to clipboard


                    Materials Data on Cd(AgI2)2 by Materials Project.  United States.  doi:https://doi.org/10.17188/1355258

Copy to clipboard


                    2020.  
"Materials Data on Cd(AgI2)2 by Materials Project".  United States.  doi:https://doi.org/10.17188/1355258.  https://www.osti.gov/servlets/purl/1355258. Pub date:Thu Jul 16 04:00:00 UTC 2020

Copy to clipboard


                    
@article{osti_1355258,

  title        = {Materials Data on Cd(AgI2)2 by Materials Project},

  
  abstractNote = {Ag2CdI4 crystallizes in the tetragonal I-42m space group. The structure is three-dimensional. Ag1+ is bonded to four equivalent I1- atoms to form AgI4 tetrahedra that share corners with four equivalent AgI4 tetrahedra and corners with four equivalent CdI4 tetrahedra. All Ag–I bond lengths are 2.88 Å. Cd2+ is bonded to four equivalent I1- atoms to form CdI4 tetrahedra that share corners with eight equivalent AgI4 tetrahedra. All Cd–I bond lengths are 2.86 Å. I1- is bonded in a trigonal non-coplanar geometry to two equivalent Ag1+ and one Cd2+ atom.},

  doi          = {10.17188/1355258},

  journal      = {},

  number       = ,

  volume       = ,

  place        = {United States},

  year         = {2020},

  month        = {7}

}

Copy to clipboard

Dataset:

View Dataset

DOI: https://doi.org/10.17188/1355258

Save / Share:

Export Metadata

Save to My Library

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

Materials Data on Cd(CoO2)2 by Materials Project

Dataset

Cd(CoO2)2 crystallizes in the triclinic P1 space group. The structure is three-dimensional. there are eight inequivalent Co3+ sites. In the first Co3+ site, Co3+ is bonded to six O2- atoms to form CoO6 octahedra that share corners with two equivalent CdO6 pentagonal pyramids, edges with six CoO6 octahedra, and a faceface with one CdO6 pentagonal pyramid. There are a spread of Co–O bond distances ranging from 1.89–2.27 Å. In the second Co3+ site, Co3+ is bonded to six O2- atoms to form CoO6 octahedra that share corners with three CdO6 pentagonal pyramids, edges with six CoO6 octahedra, and an edgeedgemore »« less
Materials Data on Cd(CuO2)2 by Materials Project

Dataset

Cd(CuO2)2 crystallizes in the monoclinic C2/c space group. The structure is three-dimensional. there are two inequivalent Cu3+ sites. In the first Cu3+ site, Cu3+ is bonded in a square co-planar geometry to four O2- atoms. There is two shorter (1.85 Å) and two longer (1.86 Å) Cu–O bond length. In the second Cu3+ site, Cu3+ is bonded in a square co-planar geometry to four O2- atoms. There is two shorter (1.85 Å) and two longer (1.86 Å) Cu–O bond length. Cd2+ is bonded in a 8-coordinate geometry to eight O2- atoms. There are a spread of Cd–O bond distances rangingmore »« less
Materials Data on Cd(GaO2)2 by Materials Project

Dataset

CdGa2O4 is Spinel-like structured and crystallizes in the trigonal R3m space group. The structure is three-dimensional. there are eight inequivalent Cd2+ sites. In the first Cd2+ site, Cd2+ is bonded to four O2- atoms to form CdO4 tetrahedra that share corners with three equivalent CdO6 octahedra and corners with nine GaO6 octahedra. The corner-sharing octahedra tilt angles range from 56–68°. There are three shorter (2.14 Å) and one longer (2.22 Å) Cd–O bond lengths. In the second Cd2+ site, Cd2+ is bonded to four O2- atoms to form CdO4 tetrahedra that share corners with three equivalent CdO6 octahedra and cornersmore »« less
Materials Data on Cd(GaO2)2 by Materials Project

Dataset

CdGa2O4 is Spinel-like structured and crystallizes in the trigonal P3m1 space group. The structure is three-dimensional. there are twelve inequivalent Cd2+ sites. In the first Cd2+ site, Cd2+ is bonded to four O2- atoms to form CdO4 tetrahedra that share corners with three equivalent CdO6 octahedra and corners with nine GaO6 octahedra. The corner-sharing octahedra tilt angles range from 57–67°. There are three shorter (2.13 Å) and one longer (2.22 Å) Cd–O bond lengths. In the second Cd2+ site, Cd2+ is bonded to six O2- atoms to form CdO6 octahedra that share corners with three equivalent CdO4 tetrahedra, corners withmore »« less
Materials Data on Cd(BiO2)2 by Materials Project

Dataset

Bi2CdO4 crystallizes in the tetragonal I4_1/amd space group. The structure is three-dimensional. Cd2+ is bonded to six O2- atoms to form distorted CdO6 pentagonal pyramids that share corners with two equivalent CdO6 pentagonal pyramids, an edgeedge with one CdO6 pentagonal pyramid, and edges with four equivalent BiO5 square pyramids. There are two shorter (2.30 Å) and four longer (2.42 Å) Cd–O bond lengths. There are two inequivalent Bi3+ sites. In the first Bi3+ site, Bi3+ is bonded in a distorted rectangular see-saw-like geometry to four equivalent O2- atoms. There are two shorter (2.14 Å) and two longer (2.37 Å) Bi–Omore »« less

Similar Records