Materials Data on Eu2P3(HO3)3 by Materials Project
Eu2P3(HO3)3 crystallizes in the triclinic P-1 space group. The structure is three-dimensional. there are two inequivalent Eu2+ sites. In the first Eu2+ site, Eu2+ is bonded in a 8-coordinate geometry to eight O2- atoms. There are a spread of Eu–O bond distances ranging from 2.34–2.80 Å. In the second Eu2+ site, Eu2+ is bonded to seven O2- atoms to form distorted EuO7 pentagonal bipyramids that share corners with five PHO3 tetrahedra and an edgeedge with one PHO3 tetrahedra. There are a spread of Eu–O bond distances ranging from 2.30–2.59 Å. There are three inequivalent P5+ sites. In the first P5+ site, P5+ is bonded to one H+0.33- and three O2- atoms to form distorted PHO3 tetrahedra that share an edgeedge with one EuO7 pentagonal bipyramid. The P–H bond length is 1.40 Å. There is one shorter (1.52 Å) and two longer (1.55 Å) P–O bond length. In the second P5+ site, P5+ is bonded to one H+0.33- and three O2- atoms to form distorted PHO3 tetrahedra that share corners with three equivalent EuO7 pentagonal bipyramids. The P–H bond length is 1.41 Å. There are a spread of P–O bond distances ranging from 1.52–1.55 Å. In the third P5+ site, P5+ is bonded to one H+0.33- and three O2- atoms to form distorted PHO3 tetrahedra that share corners with two equivalent EuO7 pentagonal bipyramids. The P–H bond length is 1.40 Å. There is one shorter (1.53 Å) and two longer (1.55 Å) P–O bond length. There are three inequivalent H+0.33- sites. In the first H+0.33- site, H+0.33- is bonded in a single-bond geometry to one P5+ atom. In the second H+0.33- site, H+0.33- is bonded in a single-bond geometry to one P5+ atom. In the third H+0.33- site, H+0.33- is bonded in a single-bond geometry to one P5+ atom. There are nine inequivalent O2- sites. In the first O2- site, O2- is bonded in a bent 150 degrees geometry to one Eu2+ and one P5+ atom. In the second O2- site, O2- is bonded in a distorted bent 150 degrees geometry to one Eu2+ and one P5+ atom. In the third O2- site, O2- is bonded in a distorted bent 150 degrees geometry to one Eu2+ and one P5+ atom. In the fourth O2- site, O2- is bonded in a 1-coordinate geometry to two equivalent Eu2+ and one P5+ atom. In the fifth O2- site, O2- is bonded in a 1-coordinate geometry to two Eu2+ and one P5+ atom. In the sixth O2- site, O2- is bonded in a 1-coordinate geometry to two Eu2+ and one P5+ atom. In the seventh O2- site, O2- is bonded in a 1-coordinate geometry to two Eu2+ and one P5+ atom. In the eighth O2- site, O2- is bonded in a 1-coordinate geometry to two Eu2+ and one P5+ atom. In the ninth O2- site, O2- is bonded in a 1-coordinate geometry to two Eu2+ and one P5+ 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:
- 1720462
- Report Number(s):
- mp-1226428
- Resource Relation:
- Related Information: https://materialsproject.org/citing
- Country of Publication:
- United States
- Language:
- English
Similar Records
Materials Data on CaP2H6O7 by Materials Project
Materials Data on Rb2U2P3H3O13 by Materials Project