Dy3Hf(Th3Mn)2
Alexandria ALEXAlex-ID: agm011597600 · Space group: P1 (#1)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
AB2C3D6_628_spg1
DyTh3 HfMn2 DyTh
2024-07-10 13:59:49.680940
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm011597600).
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 agm011597600
data_agm011597600
_cell_length_a 6.06755
_cell_length_b 7.14685
_cell_length_c 8.43300
_cell_angle_alpha 86.97224
_cell_angle_beta 103.26620
_cell_angle_gamma 108.30194
_cell_volume 337.85057
_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
Dy1 Dy 0.74223 0.88810 0.75549 1.00000
Dy2 Dy 0.33240 0.53314 0.92715 1.00000
Dy3 Dy 0.33861 0.03855 0.93456 1.00000
Hf1 Hf 0.53279 0.30620 0.28995 1.00000
Th1 Th 0.70010 0.40102 0.71198 1.00000
Th2 Th 0.94211 0.65824 0.11573 1.00000
Th3 Th 0.57449 0.81943 0.32068 1.00000
Th4 Th 0.08387 0.25155 0.52389 1.00000
Th5 Th 0.13690 0.75839 0.55331 1.00000
Th6 Th 0.93840 0.18260 0.09942 1.00000
Mn1 Mn 0.12628 0.97916 0.29751 1.00000
Mn2 Mn 0.53293 0.09981 0.53314 1.00000
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