Er5Ge5Ir2
Alexandria ALEXAlex-ID: agm005665206 · Space group: C2/m (#12)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
A2B5C5_26_spg12
Er2Ge2Ir ErGe
2023-06-19 00:00:53.451628
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm005665206).
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 agm005665206
data_agm005665206
_cell_length_a 4.21300
_cell_length_b 7.81017
_cell_length_c 8.39368
_cell_angle_alpha 89.14796
_cell_angle_beta 75.46552
_cell_angle_gamma 74.35282
_cell_volume 257.02766
_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 0.00000 0.50000 0.50000 1.00000
Er2 Er 0.69854 0.68287 0.92006 1.00000
Er3 Er 0.36976 0.93680 0.32367 1.00000
Er4 Er 0.63024 0.06320 0.67633 1.00000
Er5 Er 0.30146 0.31713 0.07994 1.00000
Ge1 Ge 0.72182 0.21879 0.33757 1.00000
Ge2 Ge 0.95462 0.29109 0.79968 1.00000
Ge3 Ge 0.04538 0.70891 0.20032 1.00000
Ge4 Ge 0.27818 0.78121 0.66243 1.00000
Ge5 Ge 0.00000 0.00000 0.00000 1.00000
Ir1 Ir 0.38955 0.46576 0.75515 1.00000
Ir2 Ir 0.61045 0.53424 0.24485 1.00000
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