Mg3GaPd
Alexandria ALEXAlex-ID: agm003708342 · Space group: Pm (#6)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
ABC3_3965_spg11
Mg7(GaPd)2 Mg2GaPd
2022-04-16 03:59:35.504022
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm003708342).
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
Loading 3D structure…
# CIF generated by HEAS from Alexandria entry agm003708342
data_agm003708342
_cell_length_a 4.47324
_cell_length_b 5.57945
_cell_length_c 8.03366
_cell_angle_alpha 109.85004
_cell_angle_beta 90.01135
_cell_angle_gamma 89.98838
_cell_volume 188.59253
_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
Mg1 Mg 0.54338 0.04991 0.63897 1.00000
Mg2 Mg 0.54301 0.13371 0.07695 1.00000
Mg3 Mg 0.04314 0.16683 0.35519 1.00000
Mg4 Mg 0.04339 0.85865 0.82140 1.00000
Mg5 Mg 0.54328 0.50458 0.54652 1.00000
Mg6 Mg 0.54284 0.74354 0.26434 1.00000
Ga1 Ga 0.54307 0.56565 0.90393 1.00000
Ga2 Ga 0.04283 0.44320 0.08529 1.00000
Pd1 Pd 0.04300 0.73675 0.45836 1.00000
Pd2 Pd 0.04321 0.34043 0.72591 1.00000
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