LaDy2Tm7
Alexandria ALEXAlex-ID: agm005855804 · Space group: P-1 (#2)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
AB2C7_328_spg2
DyTm5 LaDy4 LaTm2
2023-07-26 07:45:40.264626
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm005855804).
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 agm005855804
data_agm005855804
_cell_length_a 6.10325
_cell_length_b 7.88441
_cell_length_c 7.87695
_cell_angle_alpha 90.06143
_cell_angle_beta 104.86522
_cell_angle_gamma 121.10518
_cell_volume 309.56752
_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
La1 La 0.00000 0.00000 0.00000 1.00000
Dy1 Dy 0.49869 0.69864 0.59848 1.00000
Dy2 Dy 0.50131 0.30136 0.40152 1.00000
Tm1 Tm 0.00035 0.79911 0.40113 1.00000
Tm2 Tm 0.99965 0.20089 0.59887 1.00000
Tm3 Tm 0.99971 0.59807 0.79841 1.00000
Tm4 Tm 0.00029 0.40193 0.20159 1.00000
Tm5 Tm 0.49991 0.89952 0.20154 1.00000
Tm6 Tm 0.50009 0.10048 0.79846 1.00000
Tm7 Tm 0.50000 0.50000 0.00000 1.00000
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