Materials Data on Ce(NiSn)2 by Materials Project

doi:10.17188/1197295

Title: Materials Data on Ce(NiSn)2 by Materials Project

Dataset
Other Related Research

Abstract

CeNi2Sn2 crystallizes in the tetragonal I4/mmm space group. The structure is three-dimensional. Ce is bonded in a 8-coordinate geometry to eight equivalent Ni and eight equivalent Sn atoms. All Ce–Ni bond lengths are 3.42 Å. All Ce–Sn bond lengths are 3.44 Å. Ni is bonded in a 4-coordinate geometry to four equivalent Ce and four equivalent Sn atoms. All Ni–Sn bond lengths are 2.51 Å. Sn is bonded in a 9-coordinate geometry to four equivalent Ce, four equivalent Ni, and one Sn atom. The Sn–Sn bond length is 2.83 Å.

Authors:: The Materials Project

Publication Date:: 2020-05-03

Other Number(s):: mp-22026

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; Ce(NiSn)2; Ce-Ni-Sn

OSTI Identifier:: 1197295

DOI:: https://doi.org/10.17188/1197295

Citation Formats


                    The Materials Project. Materials Data on Ce(NiSn)2 by Materials Project.  United States: N. p., 2020. 
        Web.  doi:10.17188/1197295.

Copy to clipboard


                    The Materials Project. Materials Data on Ce(NiSn)2 by Materials Project.  United States.  doi:https://doi.org/10.17188/1197295

Copy to clipboard


                    The Materials Project. 2020.  
"Materials Data on Ce(NiSn)2 by Materials Project".  United States.  doi:https://doi.org/10.17188/1197295.  https://www.osti.gov/servlets/purl/1197295. Pub date:Sun May 03 00:00:00 EDT 2020

Copy to clipboard


                    
@article{osti_1197295,

  title        = {Materials Data on Ce(NiSn)2 by Materials Project},

  author       = {The Materials Project},

  abstractNote = {CeNi2Sn2 crystallizes in the tetragonal I4/mmm space group. The structure is three-dimensional. Ce is bonded in a 8-coordinate geometry to eight equivalent Ni and eight equivalent Sn atoms. All Ce–Ni bond lengths are 3.42 Å. All Ce–Sn bond lengths are 3.44 Å. Ni is bonded in a 4-coordinate geometry to four equivalent Ce and four equivalent Sn atoms. All Ni–Sn bond lengths are 2.51 Å. Sn is bonded in a 9-coordinate geometry to four equivalent Ce, four equivalent Ni, and one Sn atom. The Sn–Sn bond length is 2.83 Å.},

  doi          = {10.17188/1197295},

  journal      = {},

  number       = ,

  volume       = ,

  place        = {United States},

  year         = {2020},

  month        = {5}

}

Copy to clipboard

Dataset:

View Dataset

DOI: https://doi.org/10.17188/1197295

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

Materials Data on Ce(NiSn)2 by Materials Project

Dataset The Materials Project

CeNi2Sn2 crystallizes in the tetragonal P4/nmm space group. The structure is three-dimensional. Ce is bonded in a 12-coordinate geometry to eight Ni and eight Sn atoms. There are four shorter (3.27 Å) and four longer (3.42 Å) Ce–Ni bond lengths. There are four shorter (3.34 Å) and four longer (3.44 Å) Ce–Sn bond lengths. There are two inequivalent Ni sites. In the first Ni site, Ni is bonded in a 8-coordinate geometry to four equivalent Ce and four equivalent Sn atoms. All Ni–Sn bond lengths are 2.56 Å. In the second Ni site, Ni is bonded in a 9-coordinate geometrymore »« less
Materials Data on Nd(NiSn)2 by Materials Project

Dataset The Materials Project

Nd(NiSn)2 crystallizes in the tetragonal P4/nmm space group. The structure is three-dimensional. Nd is bonded in a 12-coordinate geometry to eight Ni and eight Sn atoms. There are four shorter (3.31 Å) and four longer (3.43 Å) Nd–Ni bond lengths. There are four shorter (3.37 Å) and four longer (3.44 Å) Nd–Sn bond lengths. There are two inequivalent Ni sites. In the first Ni site, Ni is bonded in a 9-coordinate geometry to four equivalent Nd and five Sn atoms. There are one shorter (2.51 Å) and four longer (2.58 Å) Ni–Sn bond lengths. In the second Ni site, Nimore »« less
Materials Data on La(NiSn)2 by Materials Project

Dataset The Materials Project

LaNi2Sn2 crystallizes in the tetragonal I4/mmm space group. The structure is three-dimensional. La is bonded in a 8-coordinate geometry to eight equivalent Ni and eight equivalent Sn atoms. All La–Ni bond lengths are 3.45 Å. All La–Sn bond lengths are 3.48 Å. Ni is bonded in a 4-coordinate geometry to four equivalent La and four equivalent Sn atoms. All Ni–Sn bond lengths are 2.53 Å. Sn is bonded in a 9-coordinate geometry to four equivalent La, four equivalent Ni, and one Sn atom. The Sn–Sn bond length is 2.90 Å.
Materials Data on Pr(NiSn)2 by Materials Project

Dataset The Materials Project

Pr(NiSn)2 crystallizes in the tetragonal I4/mmm space group. The structure is three-dimensional. Pr is bonded in a 8-coordinate geometry to eight equivalent Ni and eight equivalent Sn atoms. All Pr–Ni bond lengths are 3.45 Å. All Pr–Sn bond lengths are 3.45 Å. Ni is bonded in a 4-coordinate geometry to four equivalent Pr and four equivalent Sn atoms. All Ni–Sn bond lengths are 2.52 Å. Sn is bonded in a 9-coordinate geometry to four equivalent Pr, four equivalent Ni, and one Sn atom. The Sn–Sn bond length is 2.87 Å.
Materials Data on NiSn(PO4)2 (SG:11) by Materials Project

Dataset The Materials Project

Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations

Similar Records