NdErCd4
Alexandria ALEXAlex-ID: agm013469372 · Space group: Immm (#71)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
ABC4_687_spg12
ErCd2 NdCd2
2025-04-13 21:35:17
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm013469372).
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 agm013469372
data_agm013469372
_cell_length_a 6.09081
_cell_length_b 6.09081
_cell_length_c 6.09081
_cell_angle_alpha 131.22749
_cell_angle_beta 111.28407
_cell_angle_gamma 88.73695
_cell_volume 150.55428
_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
Nd1 Nd 0.00000 0.00000 0.00000 1.00000
Er1 Er 0.50000 0.00000 0.50000 1.00000
Cd1 Cd 0.57900 0.33327 0.24574 1.00000
Cd2 Cd 0.91247 0.66673 0.24574 1.00000
Cd3 Cd 0.42100 0.66673 0.75426 1.00000
Cd4 Cd 0.08753 0.33327 0.75426 1.00000
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