Nd4Sm2Dy5
Alexandria ALEXAlex-ID: agm005647288 · Space group: C2/m (#12)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
A2B4C5_218_spg12
Nd3Dy5 NdSm3Dy4 Nd
2023-06-22 06:17:28.853087
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm005647288).
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 agm005647288
data_agm005647288
_cell_length_a 5.71321
_cell_length_b 6.67032
_cell_length_c 10.07497
_cell_angle_alpha 90.94300
_cell_angle_beta 106.47124
_cell_angle_gamma 90.00008
_cell_volume 368.13555
_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
Nd1 Nd 0.30471 0.92281 0.60943 1.00000
Nd2 Nd 0.97921 0.71532 0.95843 1.00000
Nd3 Nd 0.69529 0.07719 0.39057 1.00000
Nd4 Nd 0.02079 0.28468 0.04157 1.00000
Sm1 Sm 0.40210 0.44706 0.80421 1.00000
Sm2 Sm 0.59790 0.55294 0.19579 1.00000
Dy1 Dy 0.79082 0.59927 0.58165 1.00000
Dy2 Dy 0.20918 0.40073 0.41835 1.00000
Dy3 Dy 0.86923 0.10726 0.73846 1.00000
Dy4 Dy 0.50000 0.00000 0.00000 1.00000
Dy5 Dy 0.13077 0.89274 0.26154 1.00000
Get direct link