Pm2Dy2Ho4Th
Alexandria ALEXAlex-ID: agm036639285 · Space group: C2/m (#12)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
AB2C2D4_171_spg12
Pm3DyHo4 Pm2DyHo6 Ho2Th Pm3Dy5
2025-03-07 05:41:08
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm036639285).
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 agm036639285
data_agm036639285
_cell_length_a 9.52195
_cell_length_b 9.52195
_cell_length_c 9.52620
_cell_angle_alpha 64.68403
_cell_angle_beta 115.31597
_cell_angle_gamma 158.26209
_cell_volume 287.97102
_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 0.33606 0.66394 0.99605 1.00000
Pm2 Pm 0.66394 0.33606 0.00395 1.00000
Dy1 Dy 0.85282 0.14718 0.33604 1.00000
Dy2 Dy 0.14718 0.85282 0.66396 1.00000
Ho1 Ho 0.81553 0.18447 0.66486 1.00000
Ho2 Ho 0.18447 0.81553 0.33514 1.00000
Ho3 Ho 0.51883 0.48117 0.33058 1.00000
Ho4 Ho 0.48117 0.51883 0.66942 1.00000
Th1 Th 0.00000 0.00000 0.00000 1.00000
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