NdDy7Er4
Alexandria ALEXAlex-ID: agm003669940 · Space group: C2/m (#12)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
AB4C7_85_spg12
Nd2Dy5Er2 Dy5Er4 Dy7Er2
2022-04-20 12:24:50.865165
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm003669940).
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 agm003669940
data_agm003669940
_cell_length_a 5.85262
_cell_length_b 11.48734
_cell_length_c 6.67987
_cell_angle_alpha 83.09032
_cell_angle_beta 64.01862
_cell_angle_gamma 75.24169
_cell_volume 390.36952
_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 0.00000 0.00000 0.00000 1.00000
Dy1 Dy 0.78923 0.92201 0.49954 1.00000
Dy2 Dy 0.21077 0.07799 0.50046 1.00000
Dy3 Dy 0.05846 0.66988 0.21320 1.00000
Dy4 Dy 0.94154 0.33012 0.78680 1.00000
Dy5 Dy 0.36593 0.50393 0.76421 1.00000
Dy6 Dy 0.50000 0.00000 0.00000 1.00000
Dy7 Dy 0.63407 0.49607 0.23579 1.00000
Er1 Er 0.63229 0.22559 0.50984 1.00000
Er2 Er 0.36771 0.77441 0.49016 1.00000
Er3 Er 0.74849 0.68443 0.81859 1.00000
Er4 Er 0.25151 0.31557 0.18141 1.00000
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