Er3(ZnCu)2
Alexandria ALEXAlex-ID: agm011759136 · Space group: C2/m (#12)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
A2B2C3_21_spg12
ErZn2 ErCu
2025-06-22 12:02:56
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm011759136).
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 agm011759136
data_agm011759136
_cell_length_a 5.68801
_cell_length_b 5.68801
_cell_length_c 7.31124
_cell_angle_alpha 72.62920
_cell_angle_beta 107.37080
_cell_angle_gamma 138.74019
_cell_volume 147.84395
_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 0.68297 0.31703 0.15423 1.00000
Er2 Er 0.31703 0.68297 0.84577 1.00000
Er3 Er 0.50000 0.50000 0.50000 1.00000
Zn1 Zn 0.03542 0.96458 0.83787 1.00000
Zn2 Zn 0.96458 0.03542 0.16213 1.00000
Cu1 Cu 0.18480 0.81520 0.43445 1.00000
Cu2 Cu 0.81520 0.18480 0.56555 1.00000
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