Materials Data on Tb2Si3 by Materials Project

doi:10.17188/1699587

Title: Materials Data on Tb2Si3 by Materials Project

Dataset
Other Related Research

Abstract

Tb2Si3 crystallizes in the hexagonal P-6m2 space group. The structure is three-dimensional. Tb is bonded in a 9-coordinate geometry to nine Si atoms. There are three shorter (3.02 Å) and six longer (3.07 Å) Tb–Si bond lengths. There are three inequivalent Si sites. In the first Si site, Si is bonded in a 9-coordinate geometry to six equivalent Tb and three equivalent Si atoms. All Si–Si bond lengths are 2.30 Å. In the second Si site, Si is bonded to six equivalent Tb atoms to form distorted edge-sharing SiTb6 pentagonal pyramids. In the third Si site, Si is bonded in a 9-coordinate geometry to six equivalent Tb and three equivalent Si atoms.

Authors:: The Materials Project

Publication Date:: Mon May 04 00:00:00 EDT 2020

Other Number(s):: mp-1217685

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; Tb2Si3; Si-Tb

OSTI Identifier:: 1699587

DOI:: https://doi.org/10.17188/1699587

Citation Formats


                    The Materials Project. Materials Data on Tb2Si3 by Materials Project.  United States: N. p., 2020. 
        Web.  doi:10.17188/1699587.

Copy to clipboard


                    The Materials Project. Materials Data on Tb2Si3 by Materials Project.  United States.  doi:https://doi.org/10.17188/1699587

Copy to clipboard


                    The Materials Project. 2020.  
"Materials Data on Tb2Si3 by Materials Project".  United States.  doi:https://doi.org/10.17188/1699587.  https://www.osti.gov/servlets/purl/1699587. Pub date:Mon May 04 00:00:00 EDT 2020

Copy to clipboard


                    
@article{osti_1699587,

  title        = {Materials Data on Tb2Si3 by Materials Project},

  author       = {The Materials Project},

  abstractNote = {Tb2Si3 crystallizes in the hexagonal P-6m2 space group. The structure is three-dimensional. Tb is bonded in a 9-coordinate geometry to nine Si atoms. There are three shorter (3.02 Å) and six longer (3.07 Å) Tb–Si bond lengths. There are three inequivalent Si sites. In the first Si site, Si is bonded in a 9-coordinate geometry to six equivalent Tb and three equivalent Si atoms. All Si–Si bond lengths are 2.30 Å. In the second Si site, Si is bonded to six equivalent Tb atoms to form distorted edge-sharing SiTb6 pentagonal pyramids. In the third Si site, Si is bonded in a 9-coordinate geometry to six equivalent Tb and three equivalent Si atoms.},

  doi          = {10.17188/1699587},

  journal      = {},

  number       = ,

  volume       = ,

  place        = {United States},

  year         = {Mon May 04 00:00:00 EDT 2020},

  month        = {Mon May 04 00:00:00 EDT 2020}

}

Copy to clipboard

Dataset:

View Dataset

DOI: https://doi.org/10.17188/1699587

Save / Share:

Export Metadata

Save to My Library

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

Materials Data on Tb2Si3 by Materials Project

Dataset The Materials Project

Tb2Si3 crystallizes in the orthorhombic Cmcm space group. The structure is three-dimensional. there are two inequivalent Tb sites. In the first Tb site, Tb is bonded in a 4-coordinate geometry to four equivalent Si atoms. There are two shorter (2.88 Å) and two longer (3.04 Å) Tb–Si bond lengths. In the second Tb site, Tb is bonded in a 11-coordinate geometry to eleven Si atoms. There are a spread of Tb–Si bond distances ranging from 3.17–3.26 Å. There are three inequivalent Si sites. In the first Si site, Si is bonded in a 7-coordinate geometry to three equivalent Tb andmore »« less
Materials Data on Tb2Si3 by Materials Project

Dataset The Materials Project

Tb2Si3 crystallizes in the orthorhombic Cmcm space group. The structure is three-dimensional. there are two inequivalent Tb sites. In the first Tb site, Tb is bonded to twelve Si atoms to form a mixture of edge and face-sharing TbSi12 cuboctahedra. There are a spread of Tb–Si bond distances ranging from 3.08–3.34 Å. In the second Tb site, Tb is bonded in a 7-coordinate geometry to seven Si atoms. There are a spread of Tb–Si bond distances ranging from 2.93–2.97 Å. There are three inequivalent Si sites. In the first Si site, Si is bonded in a 9-coordinate geometry to sixmore »« less
Materials Data on Tb2Si3 by Materials Project

Dataset The Materials Project

Tb2Si3 crystallizes in the orthorhombic Imm2 space group. The structure is three-dimensional. there are two inequivalent Tb sites. In the first Tb site, Tb is bonded in a 10-coordinate geometry to ten Si atoms. There are a spread of Tb–Si bond distances ranging from 2.98–3.13 Å. In the second Tb site, Tb is bonded in a 8-coordinate geometry to eight Si atoms. There are a spread of Tb–Si bond distances ranging from 2.93–3.11 Å. There are three inequivalent Si sites. In the first Si site, Si is bonded in a 9-coordinate geometry to six Tb and three Si atoms. Theremore »« less
Materials Data on LiMg9B20 by Materials Project

Dataset The Materials Project

LiMg9B20 is hexagonal omega structure-derived structured and crystallizes in the triclinic P-1 space group. The structure is three-dimensional. Li is bonded to twelve B atoms to form LiB12 cuboctahedra that share edges with twelve MgB12 cuboctahedra and faces with eight MgB12 cuboctahedra. There are a spread of Li–B bond distances ranging from 2.48–2.50 Å. There are five inequivalent Mg sites. In the first Mg site, Mg is bonded to twelve B atoms to form MgB12 cuboctahedra that share edges with twelve MgB12 cuboctahedra, faces with two equivalent LiB12 cuboctahedra, and faces with six MgB12 cuboctahedra. There are a spread ofmore »« less
Materials Data on Y(CoB)2 by Materials Project

Dataset The Materials Project

YCo2B2 crystallizes in the tetragonal I4/mmm space group. The structure is three-dimensional. Y3+ is bonded in a body-centered cubic geometry to eight equivalent B3- atoms. All Y–B bond lengths are 2.89 Å. Co+1.50+ is bonded to four equivalent B3- atoms to form a mixture of distorted edge and corner-sharing CoB4 tetrahedra. All Co–B bond lengths are 2.00 Å. B3- is bonded in a 4-coordinate geometry to four equivalent Y3+ and four equivalent Co+1.50+ atoms.

Similar Records