ErGa3Pt2
Alexandria ALEXAlex-ID: agm018977679 · Space group: Immm (#71)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
AB2C3_1795_spg2
Er4Ga20Pt11 Er(Ga2Pt)2 Er4Ga6Pt7
2025-04-14 01:51:49
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm018977679).
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 agm018977679
data_agm018977679
_cell_length_a 8.08870
_cell_length_b 8.08870
_cell_length_c 7.99000
_cell_angle_alpha 60.39784
_cell_angle_beta 119.60216
_cell_angle_gamma 150.63694
_cell_volume 220.39193
_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
Er1 Er 0.12984 0.87016 0.13144 1.00000
Er2 Er 0.87016 0.12984 0.86856 1.00000
Ga1 Ga 0.67547 0.32453 0.88237 1.00000
Ga2 Ga 0.00280 0.99720 0.65594 1.00000
Ga3 Ga 0.32557 0.67443 0.53095 1.00000
Ga4 Ga 0.67443 0.32557 0.46905 1.00000
Ga5 Ga 0.99720 0.00280 0.34406 1.00000
Ga6 Ga 0.32453 0.67547 0.11763 1.00000
Pt1 Pt 0.50030 0.49970 0.82870 1.00000
Pt2 Pt 0.49970 0.50030 0.17130 1.00000
Pt3 Pt 0.20032 0.79968 0.70026 1.00000
Pt4 Pt 0.79968 0.20032 0.29974 1.00000
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