Er6MnGa3SiPd4
Alexandria ALEXAlex-ID: agm010647682 · Space group: P-6m2 (#187)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
ABC3D4E6_5_spg187
Er2GaSi Er(Mn2Si)2 ErGa ErPd ErGaPd
2024-07-13 16:10:59.713176
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm010647682).
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 agm010647682
data_agm010647682
_cell_length_a 9.15294
_cell_length_b 9.15294
_cell_length_c 4.33507
_cell_angle_alpha 90.00000
_cell_angle_beta 90.00000
_cell_angle_gamma 120.00000
_cell_volume 314.51979
_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 0.71435 0.85718 0.50000 1.00000
Er2 Er 0.14282 0.85718 0.50000 1.00000
Er3 Er 0.14282 0.28565 0.50000 1.00000
Er4 Er 0.40518 0.20259 0.00000 1.00000
Er5 Er 0.79741 0.20259 0.00000 1.00000
Er6 Er 0.79741 0.59482 0.00000 1.00000
Mn1 Mn 0.66667 0.33333 0.50000 1.00000
Ga1 Ga 0.13305 0.56653 0.00000 1.00000
Ga2 Ga 0.43347 0.56653 0.00000 1.00000
Ga3 Ga 0.43347 0.86695 0.00000 1.00000
Si1 Si 0.00000 0.00000 0.00000 1.00000
Pd1 Pd 0.33333 0.66667 0.50000 1.00000
Pd2 Pd 0.96905 0.48452 0.50000 1.00000
Pd3 Pd 0.51548 0.48452 0.50000 1.00000
Pd4 Pd 0.51548 0.03095 0.50000 1.00000
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