Pm3Ga2Re7
Alexandria ALEXAlex-ID: agm101112786 · Space group: R-3m (#166)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
A2B3C7_3_spg166
Pm5Ga3 PmGa Re
2025-05-16 07:43:28
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm101112786).
Th. Cavignac, J. Schmidt, P.-P. De Breuck, A. Loew, T. F. T. Cerqueira, H.-C. Wang, A. Bochkarev, Y. Lysogorskiy, A. H. Romero, R. Drautz, S. Botti and M. A. L. Marques. AI-Driven expansion and application of the Alexandria database. J. Phys. Mater. 9, 025014 (2026). https://doi.org/10.1088/2515-7639/ae6620
@article{Cavignac2026Alexandria,
author = {Cavignac, Th{\'e}o and Schmidt, Jonathan and De Breuck, Pierre-Paul and Loew, Antoine
and Cerqueira, Tiago F. T. and Wang, Hai-Chen and Bochkarev, Anton
and Lysogorskiy, Yury and Romero, Aldo H. and Drautz, Ralf and Botti, Silvana
and Marques, Miguel A. L.},
title = {{AI}-Driven expansion and application of the {A}lexandria database},
journal = {Journal of Physics: Materials},
year = {2026},
volume = {9},
number = {2},
pages = {025014},
doi = {10.1088/2515-7639/ae6620},
url = {https://doi.org/10.1088/2515-7639/ae6620}
}
3D Crystal Structure Rendering
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# CIF generated by HEAS from Alexandria entry agm101112786
data_agm101112786
_cell_length_a 9.37042
_cell_length_b 9.37042
_cell_length_c 9.37042
_cell_angle_alpha 33.68057
_cell_angle_beta 33.68057
_cell_angle_gamma 33.68057
_cell_volume 225.42835
_symmetry_space_group_name_H-M 'P 1'
_symmetry_Int_Tables_number 1
loop_
_symmetry_equiv_pos_as_xyz
'x, y, z'
loop_
_atom_site_label
_atom_site_type_symbol
_atom_site_fract_x
_atom_site_fract_y
_atom_site_fract_z
_atom_site_occupancy
Pm1 Pm 0.00000 0.00000 0.00000 1.00000
Pm2 Pm 0.85753 0.85753 0.85753 1.00000
Pm3 Pm 0.14247 0.14247 0.14247 1.00000
Ga1 Ga 0.66583 0.66583 0.66583 1.00000
Ga2 Ga 0.33417 0.33417 0.33417 1.00000
Re1 Re 0.50000 0.50000 0.50000 1.00000
Re2 Re 0.41594 0.41594 0.92174 1.00000
Re3 Re 0.92174 0.41594 0.41594 1.00000
Re4 Re 0.41594 0.92174 0.41594 1.00000
Re5 Re 0.58406 0.58406 0.07826 1.00000
Re6 Re 0.58406 0.07826 0.58406 1.00000
Re7 Re 0.07826 0.58406 0.58406 1.00000
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