Materials Data on Cs(MnP)2 by Materials Project

doi:10.17188/1187616

Title: Materials Data on Cs(MnP)2 by Materials Project

Dataset
Other Related Research

Abstract

Cs(MnP)2 crystallizes in the tetragonal I4/mmm space group. The structure is three-dimensional. Cs1+ is bonded in a distorted body-centered cubic geometry to eight equivalent P+2.50- atoms. All Cs–P bond lengths are 3.66 Å. Mn2+ is bonded to four equivalent P+2.50- atoms to form a mixture of edge and corner-sharing MnP4 tetrahedra. All Mn–P bond lengths are 2.28 Å. P+2.50- is bonded in a 4-coordinate geometry to four equivalent Cs1+ and four equivalent Mn2+ atoms.

Authors:: The Materials Project

Publication Date:: 2020-07-16

Other Number(s):: mp-11181

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; Cs(MnP)2; Cs-Mn-P

OSTI Identifier:: 1187616

DOI:: https://doi.org/10.17188/1187616

Citation Formats


                    The Materials Project. Materials Data on Cs(MnP)2 by Materials Project.  United States: N. p., 2020. 
        Web.  doi:10.17188/1187616.

Copy to clipboard


                    The Materials Project. Materials Data on Cs(MnP)2 by Materials Project.  United States.  doi:https://doi.org/10.17188/1187616

Copy to clipboard


                    The Materials Project. 2020.  
"Materials Data on Cs(MnP)2 by Materials Project".  United States.  doi:https://doi.org/10.17188/1187616.  https://www.osti.gov/servlets/purl/1187616. Pub date:Thu Jul 16 00:00:00 EDT 2020

Copy to clipboard


                    
@article{osti_1187616,

  title        = {Materials Data on Cs(MnP)2 by Materials Project},

  author       = {The Materials Project},

  abstractNote = {Cs(MnP)2 crystallizes in the tetragonal I4/mmm space group. The structure is three-dimensional. Cs1+ is bonded in a distorted body-centered cubic geometry to eight equivalent P+2.50- atoms. All Cs–P bond lengths are 3.66 Å. Mn2+ is bonded to four equivalent P+2.50- atoms to form a mixture of edge and corner-sharing MnP4 tetrahedra. All Mn–P bond lengths are 2.28 Å. P+2.50- is bonded in a 4-coordinate geometry to four equivalent Cs1+ and four equivalent Mn2+ atoms.},

  doi          = {10.17188/1187616},

  journal      = {},

  number       = ,

  volume       = ,

  place        = {United States},

  year         = {2020},

  month        = {7}

}

Copy to clipboard

Dataset:

View Dataset

DOI: https://doi.org/10.17188/1187616

Save / Share:

Export Metadata

Save to My Library

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

Materials Data on Ba(MnP)2 by Materials Project

Dataset The Materials Project

BaMn2P2 is alpha bismuth trifluoride-derived structured and crystallizes in the tetragonal I4/mmm space group. The structure is three-dimensional. Ba2+ is bonded in a body-centered cubic geometry to eight equivalent P3- atoms. All Ba–P bond lengths are 3.35 Å. Mn2+ is bonded to four equivalent P3- atoms to form a mixture of corner and edge-sharing MnP4 tetrahedra. All Mn–P bond lengths are 2.28 Å. P3- is bonded in a 4-coordinate geometry to four equivalent Ba2+ and four equivalent Mn2+ atoms.
Materials Data on Eu(MnP)2 by Materials Project

Dataset The Materials Project

EuMn2P2 crystallizes in the trigonal P-3m1 space group. The structure is three-dimensional. Eu2+ is bonded to six equivalent P3- atoms to form EuP6 octahedra that share corners with twelve equivalent MnP4 tetrahedra, edges with six equivalent EuP6 octahedra, and edges with six equivalent MnP4 tetrahedra. All Eu–P bond lengths are 2.95 Å. Mn2+ is bonded to four equivalent P3- atoms to form MnP4 tetrahedra that share corners with six equivalent EuP6 octahedra, corners with six equivalent MnP4 tetrahedra, edges with three equivalent EuP6 octahedra, and edges with three equivalent MnP4 tetrahedra. The corner-sharing octahedra tilt angles range from 27–48°. Theremore »« less
Materials Data on Ca(MnP)2 by Materials Project

Dataset The Materials Project

Ca(MnP)2 crystallizes in the trigonal P-3m1 space group. The structure is three-dimensional. Ca2+ is bonded to six equivalent P3- atoms to form CaP6 octahedra that share corners with twelve equivalent MnP4 tetrahedra, edges with six equivalent CaP6 octahedra, and edges with six equivalent MnP4 tetrahedra. All Ca–P bond lengths are 2.91 Å. Mn2+ is bonded to four equivalent P3- atoms to form MnP4 tetrahedra that share corners with six equivalent CaP6 octahedra, corners with six equivalent MnP4 tetrahedra, edges with three equivalent CaP6 octahedra, and edges with three equivalent MnP4 tetrahedra. The corner-sharing octahedra tilt angles range from 24–49°. Theremore »« less
Materials Data on Sr(MnP)2 by Materials Project

Dataset The Materials Project

SrMn2P2 crystallizes in the trigonal P-3m1 space group. The structure is three-dimensional. Sr2+ is bonded to six equivalent P3- atoms to form distorted SrP6 octahedra that share corners with twelve equivalent MnP4 tetrahedra, edges with six equivalent SrP6 octahedra, and edges with six equivalent MnP4 tetrahedra. All Sr–P bond lengths are 3.06 Å. Mn2+ is bonded to four equivalent P3- atoms to form MnP4 tetrahedra that share corners with six equivalent SrP6 octahedra, corners with six equivalent MnP4 tetrahedra, edges with three equivalent SrP6 octahedra, and edges with three equivalent MnP4 tetrahedra. The corner-sharing octahedra tilt angles range from 27–47°.more »« less
Materials Data on MnP by Materials Project

Dataset The Materials Project

MnP is Modderite structured and crystallizes in the orthorhombic Pnma space group. The structure is three-dimensional. Mn2+ is bonded to six equivalent P2- atoms to form a mixture of distorted corner, edge, and face-sharing MnP6 octahedra. The corner-sharing octahedra tilt angles range from 44–56°. There are a spread of Mn–P bond distances ranging from 2.26–2.38 Å. P2- is bonded in a 6-coordinate geometry to six equivalent Mn2+ atoms.

Similar Records