Pm3DyCd
Alexandria ALEXAlex-ID: agm005773029 · Space group: C2/m (#12)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
ABC3_4938_spg12
PmDyCd Pm
2023-07-03 05:12:08.678709
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm005773029).
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 agm005773029
data_agm005773029
_cell_length_a 3.73414
_cell_length_b 6.80850
_cell_length_c 12.87915
_cell_angle_alpha 86.51689
_cell_angle_beta 89.99887
_cell_angle_gamma 74.08685
_cell_volume 314.26084
_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
Pm1 Pm 0.14624 0.70780 0.44482 1.00000
Pm2 Pm 0.36498 0.26907 0.02555 1.00000
Pm3 Pm 0.03958 0.92044 0.19025 1.00000
Pm4 Pm 0.85376 0.29220 0.55518 1.00000
Pm5 Pm 0.96042 0.07956 0.80975 1.00000
Pm6 Pm 0.63502 0.73093 0.97445 1.00000
Dy1 Dy 0.22762 0.54560 0.75162 1.00000
Dy2 Dy 0.77238 0.45440 0.24838 1.00000
Cd1 Cd 0.56142 0.87780 0.62887 1.00000
Cd2 Cd 0.43858 0.12220 0.37113 1.00000
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