skip to main content
DOE Data Explorer title logo U.S. Department of Energy
Office of Scientific and Technical Information

Title: Materials Data on CaSn(BO3)2 by Materials Project

Abstract

CaSn(BO3)2 is Calcite-derived structured and crystallizes in the trigonal R-3 space group. The structure is three-dimensional. Ca2+ is bonded to six equivalent O2- atoms to form CaO6 octahedra that share corners with six equivalent SnO6 octahedra. The corner-sharing octahedral tilt angles are 58°. All Ca–O bond lengths are 2.40 Å. B3+ is bonded in a trigonal planar geometry to three equivalent O2- atoms. All B–O bond lengths are 1.39 Å. Sn4+ is bonded to six equivalent O2- atoms to form SnO6 octahedra that share corners with six equivalent CaO6 octahedra. The corner-sharing octahedral tilt angles are 58°. All Sn–O bond lengths are 2.09 Å. O2- is bonded in a distorted trigonal planar geometry to one Ca2+, one B3+, and one Sn4+ atom.

Authors:
Contributors:
Researcher:
Publication Date:
Other Number(s):
mp-14398
DOE Contract Number:  
AC02-05CH11231; EDCBEE
Product Type:
Dataset
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)
Subject:
36 MATERIALS SCIENCE
Keywords:
crystal structure; CaSn(BO3)2; B-Ca-O-Sn
OSTI Identifier:
1190655
DOI:
10.17188/1190655

Citation Formats

Persson, Kristin, and Project, Materials. Materials Data on CaSn(BO3)2 by Materials Project. United States: N. p., 2020. Web. doi:10.17188/1190655.
Persson, Kristin, & Project, Materials. Materials Data on CaSn(BO3)2 by Materials Project. United States. doi:10.17188/1190655.
Persson, Kristin, and Project, Materials. 2020. "Materials Data on CaSn(BO3)2 by Materials Project". United States. doi:10.17188/1190655. https://www.osti.gov/servlets/purl/1190655. Pub date:Thu Jul 16 00:00:00 EDT 2020
@article{osti_1190655,
title = {Materials Data on CaSn(BO3)2 by Materials Project},
author = {Persson, Kristin and Project, Materials},
abstractNote = {CaSn(BO3)2 is Calcite-derived structured and crystallizes in the trigonal R-3 space group. The structure is three-dimensional. Ca2+ is bonded to six equivalent O2- atoms to form CaO6 octahedra that share corners with six equivalent SnO6 octahedra. The corner-sharing octahedral tilt angles are 58°. All Ca–O bond lengths are 2.40 Å. B3+ is bonded in a trigonal planar geometry to three equivalent O2- atoms. All B–O bond lengths are 1.39 Å. Sn4+ is bonded to six equivalent O2- atoms to form SnO6 octahedra that share corners with six equivalent CaO6 octahedra. The corner-sharing octahedral tilt angles are 58°. All Sn–O bond lengths are 2.09 Å. O2- is bonded in a distorted trigonal planar geometry to one Ca2+, one B3+, and one Sn4+ atom.},
doi = {10.17188/1190655},
journal = {},
number = ,
volume = ,
place = {United States},
year = {2020},
month = {7}
}

Dataset:

Save / Share: