La3Dy2Sc
Alexandria ALEXAlex-ID: agm005689245 · Space group: P-1 (#2)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
AB2C3_2372_spg2
La5Dy LaDy4 Sc
2023-08-24 20:37:15.164670
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm005689245).
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 agm005689245
data_agm005689245
_cell_length_a 7.20177
_cell_length_b 10.29329
_cell_length_c 7.23250
_cell_angle_alpha 80.54682
_cell_angle_beta 119.59947
_cell_angle_gamma 121.09025
_cell_volume 396.23274
_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 0.25694 0.00537 0.75091 1.00000
La2 La 0.74306 0.99463 0.24909 1.00000
La3 La 0.80869 0.67235 0.86350 1.00000
La4 La 0.18908 0.33352 0.63579 1.00000
La5 La 0.81092 0.66648 0.36421 1.00000
La6 La 0.19131 0.32765 0.13650 1.00000
Dy1 Dy 0.30961 0.67636 0.36468 1.00000
Dy2 Dy 0.30333 0.66782 0.86149 1.00000
Dy3 Dy 0.69667 0.33218 0.13851 1.00000
Dy4 Dy 0.69039 0.32364 0.63532 1.00000
Sc1 Sc 0.26144 0.00416 0.25641 1.00000
Sc2 Sc 0.73856 0.99584 0.74359 1.00000
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