Title: Materials Data on Pr3GaC by Materials Project

Abstract

Pr3GaC is (Cubic) Perovskite structured and crystallizes in the cubic Pm-3m space group. The structure is three-dimensional and consists of one methane molecule and one Pr3Ga framework. In the Pr3Ga framework, Pr is bonded in a linear geometry to two equivalent Ga atoms. Both Pr–Ga bond lengths are 2.77 Å. Ga is bonded to six equivalent Pr atoms to form corner-sharing GaPr6 octahedra. The corner-sharing octahedral tilt angles are 0°.

Publication Date:
Other Number(s):
mp-8368
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; C-Ga-Pr; crystal structure; Pr3GaC
OSTI Identifier:
1183748
DOI:
https://doi.org/10.17188/1183748

Citation Formats

Materials Data on Pr3GaC by Materials Project. United States: N. p., 2020. Web. doi:10.17188/1183748.
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Materials Data on Pr3GaC by Materials Project. United States. doi:https://doi.org/10.17188/1183748
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2020. "Materials Data on Pr3GaC by Materials Project". United States. doi:https://doi.org/10.17188/1183748. https://www.osti.gov/servlets/purl/1183748. Pub date:Tue Jul 14 20:00:00 EDT 2020
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@article{osti_1183748,
title = {Materials Data on Pr3GaC by Materials Project},
abstractNote = {Pr3GaC is (Cubic) Perovskite structured and crystallizes in the cubic Pm-3m space group. The structure is three-dimensional and consists of one methane molecule and one Pr3Ga framework. In the Pr3Ga framework, Pr is bonded in a linear geometry to two equivalent Ga atoms. Both Pr–Ga bond lengths are 2.77 Å. Ga is bonded to six equivalent Pr atoms to form corner-sharing GaPr6 octahedra. The corner-sharing octahedral tilt angles are 0°.},
doi = {10.17188/1183748},
journal = {},
number = ,
volume = ,
place = {United States},
year = {2020},
month = {7}
}
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DOI: https://doi.org/10.17188/1183748
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