U.S. Department of EnergyOffice of Scientific and Technical Information
Materials Data on MnTeMoO6 by Materials Project
Abstract
MnTeMoO6 crystallizes in the tetragonal P-42_1m space group. The structure is two-dimensional and consists of one MnTeMoO6 sheet oriented in the (0, 0, 1) direction. Mo6+ is bonded in a tetrahedral geometry to four O2- atoms. There is two shorter (1.74 Å) and two longer (1.89 Å) Mo–O bond length. There are two inequivalent Mn2+ sites. In the first Mn2+ site, Mn2+ is bonded in a 4-coordinate geometry to eight O2- atoms. There are four shorter (2.17 Å) and four longer (2.69 Å) Mn–O bond lengths. In the second Mn2+ site, Mn2+ is bonded in a 8-coordinate geometry to eight O2- atoms. There are four shorter (2.17 Å) and four longer (2.69 Å) Mn–O bond lengths. Te4+ is bonded in a 6-coordinate geometry to six O2- atoms. There are a spread of Te–O bond distances ranging from 1.92–2.87 Å. There are three inequivalent O2- sites. In the first O2- site, O2- is bonded in a single-bond geometry to one Mo6+ and one Te4+ atom. In the second O2- site, O2- is bonded in a 4-coordinate geometry to one Mo6+, two Mn2+, and one Te4+ atom. In the third O2- site, O2- is bonded in a trigonal planar geometry to twomore »
- Authors:
- Publication Date:
- Other Number(s):
- mp-1105362
- 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; MnTeMoO6; Mn-Mo-O-Te
- OSTI Identifier:
- 1666889
- DOI:
- https://doi.org/10.17188/1666889
Citation Formats
The Materials Project. Materials Data on MnTeMoO6 by Materials Project. United States: N. p., 2018.
Web. doi:10.17188/1666889.
The Materials Project. Materials Data on MnTeMoO6 by Materials Project. United States. doi:https://doi.org/10.17188/1666889
The Materials Project. 2018.
"Materials Data on MnTeMoO6 by Materials Project". United States. doi:https://doi.org/10.17188/1666889. https://www.osti.gov/servlets/purl/1666889. Pub date:Thu Jul 19 00:00:00 EDT 2018
@article{osti_1666889,
title = {Materials Data on MnTeMoO6 by Materials Project},
author = {The Materials Project},
abstractNote = {MnTeMoO6 crystallizes in the tetragonal P-42_1m space group. The structure is two-dimensional and consists of one MnTeMoO6 sheet oriented in the (0, 0, 1) direction. Mo6+ is bonded in a tetrahedral geometry to four O2- atoms. There is two shorter (1.74 Å) and two longer (1.89 Å) Mo–O bond length. There are two inequivalent Mn2+ sites. In the first Mn2+ site, Mn2+ is bonded in a 4-coordinate geometry to eight O2- atoms. There are four shorter (2.17 Å) and four longer (2.69 Å) Mn–O bond lengths. In the second Mn2+ site, Mn2+ is bonded in a 8-coordinate geometry to eight O2- atoms. There are four shorter (2.17 Å) and four longer (2.69 Å) Mn–O bond lengths. Te4+ is bonded in a 6-coordinate geometry to six O2- atoms. There are a spread of Te–O bond distances ranging from 1.92–2.87 Å. There are three inequivalent O2- sites. In the first O2- site, O2- is bonded in a single-bond geometry to one Mo6+ and one Te4+ atom. In the second O2- site, O2- is bonded in a 4-coordinate geometry to one Mo6+, two Mn2+, and one Te4+ atom. In the third O2- site, O2- is bonded in a trigonal planar geometry to two Mn2+ and one Te4+ atom.},
doi = {10.17188/1666889},
journal = {},
number = ,
volume = ,
place = {United States},
year = {2018},
month = {7}
}