Materials Data on ZnAs2S4(NF6)4 by Materials Project
Zn(AsF6)2(NSF3)4 crystallizes in the monoclinic P2_1/c space group. The structure is zero-dimensional and consists of sixteen amino-sulfur trifluoride molecules, eight AsF6 clusters, and four zinc molecules. In each AsF6 cluster, As5+ is bonded in an octahedral geometry to six F1- atoms. There is two shorter (1.77 Å) and four longer (1.78 Å) As–F bond length. There are six inequivalent F1- sites. In the first F1- site, F1- is bonded in a single-bond geometry to one As5+ atom. In the second F1- site, F1- is bonded in a single-bond geometry to one As5+ atom. In the third F1- site, F1- is bonded in a single-bond geometry to one As5+ atom. In the fourth F1- site, F1- is bonded in a single-bond geometry to one As5+ atom. In the fifth F1- site, F1- is bonded in a single-bond geometry to one As5+ atom. In the sixth F1- site, F1- is bonded in a single-bond geometry to one As5+ atom.
- Research Organization:
- LBNL Materials Project; Lawrence Berkeley National Laboratory (LBNL), Berkeley, CA (United States)
- Sponsoring Organization:
- USDOE Office of Science (SC), Basic Energy Sciences (BES) (SC-22)
- Contributing Organization:
- The Materials Project; MIT; UC Berkeley; Duke; U Louvain
- DOE Contract Number:
- AC02-05CH11231
- OSTI ID:
- 1689588
- Report Number(s):
- mp-1208566
- Country of Publication:
- United States
- Language:
- English
Similar Records
Materials Data on As2Se3(NF6)2 by Materials Project
Materials Data on AsN(OF3)2 by Materials Project
Materials Data on AsN(OF3)2 by Materials Project
Dataset
·
Sat May 02 00:00:00 EDT 2020
·
OSTI ID:1265092
Materials Data on AsN(OF3)2 by Materials Project
Dataset
·
Thu Jul 16 00:00:00 EDT 2020
·
OSTI ID:1277701
Materials Data on AsN(OF3)2 by Materials Project
Dataset
·
Sun May 03 00:00:00 EDT 2020
·
OSTI ID:1674297