La3Nd2SmDy6
Alexandria ALEXAlex-ID: agm004655352 · Space group: C2/m (#12)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
AB2C3D6_178_spg12
LaDy4 La3NdSm4 LaNd SmDy5
2022-06-27 16:06:36.100557
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm004655352).
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 agm004655352
data_agm004655352
_cell_length_a 6.29903
_cell_length_b 6.29903
_cell_length_c 11.88376
_cell_angle_alpha 95.05730
_cell_angle_beta 95.05730
_cell_angle_gamma 120.01246
_cell_volume 401.89961
_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 0.16667 0.83333 0.50000 1.00000
La2 La 0.83333 0.16667 0.50000 1.00000
La3 La 0.50000 0.50000 0.50000 1.00000
Nd1 Nd 0.33334 0.66666 0.00000 1.00000
Nd2 Nd 0.66666 0.33334 0.00000 1.00000
Sm1 Sm 0.00000 0.00000 0.00000 1.00000
Dy1 Dy 0.91763 0.58452 0.75240 1.00000
Dy2 Dy 0.74929 0.74929 0.24758 1.00000
Dy3 Dy 0.08237 0.41548 0.24760 1.00000
Dy4 Dy 0.58452 0.91763 0.75240 1.00000
Dy5 Dy 0.25071 0.25071 0.75242 1.00000
Dy6 Dy 0.41548 0.08237 0.24760 1.00000
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