Materials Data on NbTe4 by Materials Project
NbTe4 crystallizes in the tetragonal P4 space group. The structure is one-dimensional and consists of two NbTe4 ribbons oriented in the (0, 0, 1) direction. there are six inequivalent Nb2+ sites. In the first Nb2+ site, Nb2+ is bonded in a 8-coordinate geometry to eight Te+0.50- atoms. There are four shorter (2.82 Å) and four longer (3.00 Å) Nb–Te bond lengths. In the second Nb2+ site, Nb2+ is bonded in a 8-coordinate geometry to eight Te+0.50- atoms. There are four shorter (2.83 Å) and four longer (2.99 Å) Nb–Te bond lengths. In the third Nb2+ site, Nb2+ is bonded in a 8-coordinate geometry to eight Te+0.50- atoms. There are four shorter (2.83 Å) and four longer (2.99 Å) Nb–Te bond lengths. In the fourth Nb2+ site, Nb2+ is bonded in a 8-coordinate geometry to eight Te+0.50- atoms. There are four shorter (2.82 Å) and four longer (2.99 Å) Nb–Te bond lengths. In the fifth Nb2+ site, Nb2+ is bonded in a 8-coordinate geometry to eight Te+0.50- atoms. All Nb–Te bond lengths are 2.92 Å. In the sixth Nb2+ site, Nb2+ is bonded in a 8-coordinate geometry to eight Te+0.50- atoms. All Nb–Te bond lengths are 2.92 Å. There are six inequivalent Te+0.50- sites. In the first Te+0.50- site, Te+0.50- is bonded in a 3-coordinate geometry to two Nb2+ atoms. In the second Te+0.50- site, Te+0.50- is bonded in a 3-coordinate geometry to two Nb2+ atoms. In the third Te+0.50- site, Te+0.50- is bonded in a 2-coordinate geometry to two Nb2+ atoms. In the fourth Te+0.50- site, Te+0.50- is bonded in a 3-coordinate geometry to two Nb2+ atoms. In the fifth Te+0.50- site, Te+0.50- is bonded in a 2-coordinate geometry to two Nb2+ atoms. In the sixth Te+0.50- site, Te+0.50- is bonded in a 3-coordinate geometry to two Nb2+ atoms.
- 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:
- 1280961
- Report Number(s):
- mp-650328
- Resource Relation:
- Related Information: https://materialsproject.org/citing
- Country of Publication:
- United States
- Language:
- English
Similar Records
Materials Data on SrTeO3 by Materials Project
Materials Data on SrTeO3 by Materials Project