Materials Data on MnTeMoO6 by Materials Project
MnTeMoO6 crystallizes in the orthorhombic P2_12_12 space group. The structure is two-dimensional and consists of one MnTeMoO6 sheet oriented in the (0, 0, 1) direction. Mo6+ is bonded to four O2- atoms to form MoO4 tetrahedra that share corners with two equivalent MnO6 octahedra. The corner-sharing octahedral tilt angles are 59°. There is two shorter (1.74 Å) and two longer (1.90 Å) Mo–O bond length. Mn2+ is bonded to six O2- atoms to form distorted MnO6 octahedra that share corners with four equivalent MnO6 octahedra and corners with two equivalent MoO4 tetrahedra. The corner-sharing octahedral tilt angles are 61°. There are a spread of Mn–O bond distances ranging from 2.16–2.33 Å. Te4+ is bonded in a 6-coordinate geometry to six O2- atoms. There are a spread of Te–O bond distances ranging from 1.92–2.88 Å. There are three inequivalent O2- sites. In the first O2- site, O2- is bonded in a trigonal planar geometry to two equivalent Mn2+ and one Te4+ atom. In the second O2- site, O2- is bonded in a distorted trigonal planar geometry to one Mo6+, one Mn2+, and one Te4+ atom. In the third O2- site, O2- is bonded in a single-bond geometry to one Mo6+ and one Te4+ atom.
- Research Organization:
- Lawrence Berkeley National Lab. (LBNL), Berkeley, CA (United States). LBNL Materials Project
- Sponsoring Organization:
- USDOE Office of Science (SC), Basic Energy Sciences (BES)
- Contributing Organization:
- MIT; UC Berkeley; Duke; U Louvain
- DOE Contract Number:
- AC02-05CH11231; EDCBEE
- OSTI ID:
- 1193876
- Report Number(s):
- mp-19090
- Resource Relation:
- Related Information: https://materialsproject.org/citing
- Country of Publication:
- United States
- Language:
- English
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