GaReAg2
Alexandria ALEXAlex-ID: agm002065415 · Space group: Cm (#8)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
ABC2_4728_spg8
Ag Ga4Re Re
2021-11-08 18:29:18.013596
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm002065415).
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 agm002065415
data_agm002065415
_cell_length_a 4.11902
_cell_length_b 4.73892
_cell_length_c 7.86005
_cell_angle_alpha 87.54977
_cell_angle_beta 75.04942
_cell_angle_gamma 64.24492
_cell_volume 133.08197
_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
Ga1 Ga 0.44438 0.31538 0.95627 1.00000
Ga2 Ga 0.07156 0.88009 0.12761 1.00000
Re1 Re 0.80542 0.68963 0.85996 1.00000
Re2 Re 0.16581 0.03277 0.79270 1.00000
Ag1 Ag 0.71186 0.50703 0.22138 1.00000
Ag2 Ag 0.31689 0.15017 0.36938 1.00000
Ag3 Ag 0.56080 0.42606 0.60843 1.00000
Ag4 Ag 0.93308 0.79560 0.49311 1.00000
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