Ca(Dy2Pd)4
Alexandria ALEXAlex-ID: agm097679197 · Space group: Pm (#6)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
AB4C8_1607_spg8
Dy3Pd DyPd Ca
2025-06-07 06:49:04
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm097679197).
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 agm097679197
data_agm097679197
_cell_length_a 3.74567
_cell_length_b 10.63174
_cell_length_c 10.14540
_cell_angle_alpha 59.06649
_cell_angle_beta 90.00106
_cell_angle_gamma 90.01709
_cell_volume 346.55379
_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
Ca1 Ca 0.27008 0.00274 0.05600 1.00000
Dy1 Dy 0.76949 0.11021 0.29907 1.00000
Dy2 Dy 0.26908 0.69231 0.00071 1.00000
Dy3 Dy 0.76919 0.71441 0.67079 1.00000
Dy4 Dy 0.76917 0.27637 0.69386 1.00000
Dy5 Dy 0.76920 0.66621 0.34844 1.00000
Dy6 Dy 0.26877 0.37149 0.36080 1.00000
Dy7 Dy 0.26853 0.38808 0.93826 1.00000
Dy8 Dy 0.26979 0.01382 0.63247 1.00000
Pd1 Pd 0.76970 0.93217 0.87369 1.00000
Pd2 Pd 0.76864 0.45136 0.10896 1.00000
Pd3 Pd 0.26907 0.52374 0.60633 1.00000
Pd4 Pd 0.26930 0.85710 0.41062 1.00000
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