U.S. Department of EnergyOffice of Scientific and Technical Information
Materials Data on GaPO4 by Materials Project
Abstract
GaPO4 crystallizes in the orthorhombic C222_1 space group. The structure is three-dimensional. Ga3+ is bonded to four O2- atoms to form GaO4 tetrahedra that share corners with four equivalent PO4 tetrahedra. All Ga–O bond lengths are 1.84 Å. P5+ is bonded to four O2- atoms to form PO4 tetrahedra that share corners with four equivalent GaO4 tetrahedra. All P–O bond lengths are 1.55 Å. There are two inequivalent O2- sites. In the first O2- site, O2- is bonded in a distorted bent 150 degrees geometry to one Ga3+ and one P5+ atom. In the second O2- site, O2- is bonded in a distorted bent 120 degrees geometry to one Ga3+ and one P5+ atom.
- Publication Date:
- Other Number(s):
- mp-553932
- DOE Contract Number:
- AC02-05CH11231
- Research Org.:
- LBNL Materials Project; Lawrence Berkeley National Laboratory (LBNL), Berkeley, CA (United States)
- Sponsoring Org.:
- USDOE Office of Science (SC), Basic Energy Sciences (BES) (SC-22)
- Collaborations:
- The Materials Project; MIT; UC Berkeley; Duke; U Louvain
- Subject:
- 36 MATERIALS SCIENCE; Ga-O-P; GaPO4; crystal structure
- OSTI Identifier:
- 1267644
- DOI:
- https://doi.org/10.17188/1267644
Citation Formats
Materials Data on GaPO4 by Materials Project. United States: N. p., 2020.
Web. doi:10.17188/1267644.
Materials Data on GaPO4 by Materials Project. United States. doi:https://doi.org/10.17188/1267644
2020.
"Materials Data on GaPO4 by Materials Project". United States. doi:https://doi.org/10.17188/1267644. https://www.osti.gov/servlets/purl/1267644. Pub date:Thu Jul 16 00:00:00 EDT 2020
@article{osti_1267644,
title = {Materials Data on GaPO4 by Materials Project},
abstractNote = {GaPO4 crystallizes in the orthorhombic C222_1 space group. The structure is three-dimensional. Ga3+ is bonded to four O2- atoms to form GaO4 tetrahedra that share corners with four equivalent PO4 tetrahedra. All Ga–O bond lengths are 1.84 Å. P5+ is bonded to four O2- atoms to form PO4 tetrahedra that share corners with four equivalent GaO4 tetrahedra. All P–O bond lengths are 1.55 Å. There are two inequivalent O2- sites. In the first O2- site, O2- is bonded in a distorted bent 150 degrees geometry to one Ga3+ and one P5+ atom. In the second O2- site, O2- is bonded in a distorted bent 120 degrees geometry to one Ga3+ and one P5+ atom.},
doi = {10.17188/1267644},
journal = {},
number = ,
volume = ,
place = {United States},
year = {2020},
month = {7}
}
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