Nd4Dy7Er
Alexandria ALEXAlex-ID: agm003669942 · Space group: C2/m (#12)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
AB4C7_85_spg12
Nd2Dy5Er2 Nd(DyEr3)2 Nd3Dy5
2022-04-20 12:29:47.610243
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm003669942).
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 agm003669942
data_agm003669942
_cell_length_a 5.93536
_cell_length_b 11.70074
_cell_length_c 6.74213
_cell_angle_alpha 83.68149
_cell_angle_beta 63.88531
_cell_angle_gamma 75.30747
_cell_volume 406.68081
_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 0.64133 0.22247 0.49487 1.00000
Nd2 Nd 0.35867 0.77753 0.50513 1.00000
Nd3 Nd 0.77971 0.66512 0.77547 1.00000
Nd4 Nd 0.22029 0.33488 0.22453 1.00000
Dy1 Dy 0.78817 0.92377 0.49988 1.00000
Dy2 Dy 0.21183 0.07623 0.50012 1.00000
Dy3 Dy 0.06959 0.69065 0.17017 1.00000
Dy4 Dy 0.93041 0.30935 0.82983 1.00000
Dy5 Dy 0.36804 0.49444 0.76947 1.00000
Dy6 Dy 0.50000 0.00000 0.00000 1.00000
Dy7 Dy 0.63196 0.50556 0.23053 1.00000
Er1 Er 0.00000 0.00000 0.00000 1.00000
Get direct link