Dy2Tm2Sb3
Alexandria ALEXAlex-ID: agm005560293 · Space group: I2_13 (#199)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
A2B2C3_92_spg199
Dy5Tm5Sb6 Tm5Sb3 Dy3TmSb4
2023-06-09 18:56:20.786838
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm005560293).
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 agm005560293
data_agm005560293
_cell_length_a 7.91126
_cell_length_b 7.91126
_cell_length_c 7.91126
_cell_angle_alpha 109.47122
_cell_angle_beta 109.47122
_cell_angle_gamma 109.47122
_cell_volume 381.16639
_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 0.50000 0.35250 0.50000 1.00000
Dy2 Dy 1.00000 0.00000 0.35250 1.00000
Dy3 Dy 0.64750 0.14750 0.14750 1.00000
Dy4 Dy 0.85250 0.50000 1.00000 1.00000
Tm1 Tm 1.00000 0.00000 0.85549 1.00000
Tm2 Tm 0.50000 0.85549 0.50000 1.00000
Tm3 Tm 0.14451 0.64451 0.64451 1.00000
Tm4 Tm 0.35549 0.50000 1.00000 1.00000
Sb1 Sb 0.75000 0.62701 0.37701 1.00000
Sb2 Sb 0.25000 0.87299 0.12299 1.00000
Sb3 Sb 0.62299 0.75000 0.87299 1.00000
Sb4 Sb 0.87701 0.25000 0.62701 1.00000
Sb5 Sb 0.37299 0.12299 0.75000 1.00000
Sb6 Sb 0.12701 0.37701 0.25000 1.00000
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