Er2CdP3Pd7
Alexandria ALEXAlex-ID: agm019995320 · Space group: I-4m2 (#119)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
AB2C3D7_19_spg119
Er3(P3Pd10)2 Er8PPd24 ErPPd ErCdP2Pd5
2024-09-25 02:38:24.556620
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm019995320).
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 agm019995320
data_agm019995320
_cell_length_a 13.48328
_cell_length_b 13.48328
_cell_length_c 13.48328
_cell_angle_alpha 162.40136
_cell_angle_beta 162.40136
_cell_angle_gamma 24.98808
_cell_volume 224.01324
_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 0.08542 0.58542 0.50000 1.00000
Er2 Er 0.41458 0.91458 0.50000 1.00000
Cd1 Cd 0.25000 0.75000 0.50000 1.00000
P1 P 0.87266 0.37266 0.50000 1.00000
P2 P 0.62734 0.12734 0.50000 1.00000
P3 P 0.00000 0.00000 0.00000 1.00000
Pd1 Pd 0.82663 0.82663 0.00000 1.00000
Pd2 Pd 0.32763 0.32763 0.00000 1.00000
Pd3 Pd 0.67237 0.67237 0.00000 1.00000
Pd4 Pd 0.17337 0.17337 0.00000 1.00000
Pd5 Pd 0.96131 0.46131 0.50000 1.00000
Pd6 Pd 0.53869 0.03869 0.50000 1.00000
Pd7 Pd 0.75000 0.25000 0.50000 1.00000
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