Er2Cd5
Alexandria ALEXAlex-ID: agm010111208 · Space group: R-3m (#166)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
A2B5_23_spg12
ErCd2 ErCd3
2024-05-03 16:22:31.975549
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm010111208).
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 agm010111208
data_agm010111208
_cell_length_a 8.57181
_cell_length_b 8.57181
_cell_length_c 8.57181
_cell_angle_alpha 33.22347
_cell_angle_beta 33.22347
_cell_angle_gamma 33.22347
_cell_volume 168.31993
_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 0.57134 0.57134 0.57134 1.00000
Er2 Er 0.42866 0.42866 0.42866 1.00000
Cd1 Cd 0.00000 0.00000 0.00000 1.00000
Cd2 Cd 0.82681 0.82681 0.82681 1.00000
Cd3 Cd 0.17319 0.17319 0.17319 1.00000
Cd4 Cd 0.70278 0.70278 0.70278 1.00000
Cd5 Cd 0.29722 0.29722 0.29722 1.00000
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