Ce4DyP5
Alexandria ALEXAlex-ID: agm064513985 · Space group: Immm (#71)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
AB4C5_34_spg71
CeDy2P3 CeP
2024-12-11 21:59:13
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm064513985).
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 agm064513985
data_agm064513985
_cell_length_a 10.77883
_cell_length_b 10.77883
_cell_length_c 10.77883
_cell_angle_alpha 158.22405
_cell_angle_beta 148.99778
_cell_angle_gamma 38.20629
_cell_volume 238.95243
_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
Ce1 Ce 0.40066 0.90066 0.50000 1.00000
Ce2 Ce 0.80105 0.30105 0.50000 1.00000
Ce3 Ce 0.19895 0.69895 0.50000 1.00000
Ce4 Ce 0.59934 0.09934 0.50000 1.00000
Dy1 Dy 0.00000 0.50000 0.50000 1.00000
P1 P 0.09860 0.09860 0.00000 1.00000
P2 P 0.30007 0.30007 0.00000 1.00000
P3 P 0.69993 0.69993 0.00000 1.00000
P4 P 0.50000 0.50000 0.00000 1.00000
P5 P 0.90140 0.90140 0.00000 1.00000
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