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Materials Data on AlGaP2 by Materials Project

Dataset ·
DOI:https://doi.org/10.17188/1745545· OSTI ID:1745545
(AlP)(GaP) is Chalcopyrite-like structured and crystallizes in the tetragonal P-4m2 space group. The structure is three-dimensional. Ga3+ is bonded to four equivalent P3- atoms to form GaP4 tetrahedra that share corners with four equivalent GaP4 tetrahedra and corners with eight equivalent AlP4 tetrahedra. All Ga–P bond lengths are 2.39 Å. Al3+ is bonded to four equivalent P3- atoms to form AlP4 tetrahedra that share corners with four equivalent AlP4 tetrahedra and corners with eight equivalent GaP4 tetrahedra. All Al–P bond lengths are 2.38 Å. P3- is bonded to two equivalent Ga3+ and two equivalent Al3+ atoms to form corner-sharing PAl2Ga2 tetrahedra.
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:
1745545
Report Number(s):
mp-1228888
Country of Publication:
United States
Language:
English

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