Tb(PrDy)4
Alexandria ALEXAlex-ID: agm058056366 · Space group: P-1 (#2)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
AB4C4_375_spg2
PrDy5 Tb2Pr3Dy Pr
2025-04-01 18:03:26
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm058056366).
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 agm058056366
data_agm058056366
_cell_length_a 6.31376
_cell_length_b 9.00596
_cell_length_c 10.96639
_cell_angle_alpha 101.65290
_cell_angle_beta 90.00872
_cell_angle_gamma 96.76099
_cell_volume 606.28160
_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
Tb1 Tb 0.74707 0.00075 0.24837 1.00000
Tb2 Tb 0.25293 0.99925 0.75163 1.00000
Pr1 Pr 0.85789 0.66496 0.35797 1.00000
Pr2 Pr 0.86190 0.66540 0.69603 1.00000
Pr3 Pr 0.74754 0.00372 0.58465 1.00000
Pr4 Pr 0.24985 0.99539 0.08162 1.00000
Pr5 Pr 0.25246 0.99628 0.41535 1.00000
Pr6 Pr 0.75015 0.00461 0.91838 1.00000
Pr7 Pr 0.14211 0.33504 0.64203 1.00000
Pr8 Pr 0.13810 0.33460 0.30397 1.00000
Dy1 Dy 0.63776 0.33347 0.47086 1.00000
Dy2 Dy 0.13915 0.33553 0.97210 1.00000
Dy3 Dy 0.36347 0.66419 0.19069 1.00000
Dy4 Dy 0.36241 0.66545 0.86263 1.00000
Dy5 Dy 0.63759 0.33455 0.13737 1.00000
Dy6 Dy 0.63653 0.33581 0.80931 1.00000
Dy7 Dy 0.86085 0.66447 0.02790 1.00000
Dy8 Dy 0.36224 0.66653 0.52914 1.00000
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