Materials Data on K6InP3 by Materials Project
K6InP3 crystallizes in the triclinic P1 space group. The structure is three-dimensional. there are twelve inequivalent K1+ sites. In the first K1+ site, K1+ is bonded to four P3- atoms to form a mixture of distorted edge and corner-sharing KP4 tetrahedra. There are a spread of K–P bond distances ranging from 3.31–3.48 Å. In the second K1+ site, K1+ is bonded in a 4-coordinate geometry to four P3- atoms. There are a spread of K–P bond distances ranging from 3.31–3.52 Å. In the third K1+ site, K1+ is bonded to four P3- atoms to form a mixture of distorted edge and corner-sharing KP4 tetrahedra. There are a spread of K–P bond distances ranging from 3.33–3.65 Å. In the fourth K1+ site, K1+ is bonded to four P3- atoms to form a mixture of distorted edge and corner-sharing KP4 tetrahedra. There are a spread of K–P bond distances ranging from 3.28–3.55 Å. In the fifth K1+ site, K1+ is bonded to four P3- atoms to form a mixture of distorted edge and corner-sharing KP4 tetrahedra. There are a spread of K–P bond distances ranging from 3.37–3.47 Å. In the sixth K1+ site, K1+ is bonded in a 4-coordinate geometry to four P3- atoms. There are a spread of K–P bond distances ranging from 3.41–3.46 Å. In the seventh K1+ site, K1+ is bonded to four P3- atoms to form a mixture of distorted edge and corner-sharing KP4 tetrahedra. There are a spread of K–P bond distances ranging from 3.33–3.65 Å. In the eighth K1+ site, K1+ is bonded in a 4-coordinate geometry to four P3- atoms. There are a spread of K–P bond distances ranging from 3.21–3.68 Å. In the ninth K1+ site, K1+ is bonded in a 4-coordinate geometry to four P3- atoms. There are a spread of K–P bond distances ranging from 3.28–3.70 Å. In the tenth K1+ site, K1+ is bonded in a 6-coordinate geometry to four P3- atoms. There are a spread of K–P bond distances ranging from 3.28–3.73 Å. In the eleventh K1+ site, K1+ is bonded in a distorted trigonal non-coplanar geometry to three P3- atoms. There are a spread of K–P bond distances ranging from 3.36–3.54 Å. In the twelfth K1+ site, K1+ is bonded in a 3-coordinate geometry to three P3- atoms. There are a spread of K–P bond distances ranging from 3.30–3.53 Å. There are two inequivalent In3+ sites. In the first In3+ site, In3+ is bonded in a trigonal planar geometry to three P3- atoms. There are a spread of In–P bond distances ranging from 2.56–2.58 Å. In the second In3+ site, In3+ is bonded in a trigonal planar geometry to three P3- atoms. There are a spread of In–P bond distances ranging from 2.54–2.60 Å. There are six inequivalent P3- sites. In the first P3- site, P3- is bonded in a 9-coordinate geometry to eight K1+ and one In3+ atom. In the second P3- site, P3- is bonded in a 9-coordinate geometry to eight K1+ and one In3+ atom. In the third P3- site, P3- is bonded in a 9-coordinate geometry to eight K1+ and one In3+ atom. In the fourth P3- site, P3- is bonded in a 9-coordinate geometry to eight K1+ and one In3+ atom. In the fifth P3- site, P3- is bonded in a 8-coordinate geometry to seven K1+ and one In3+ atom. In the sixth P3- site, P3- is bonded in a 7-coordinate geometry to seven K1+ and one In3+ 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:
- 1745546
- Report Number(s):
- mp-1224505
- Resource Relation:
- Related Information: https://materialsproject.org/citing
- Country of Publication:
- United States
- Language:
- English
Similar Records
Materials Data on K5InO4 by Materials Project
Materials Data on K12In2Se9 by Materials Project