DyTm5N6
Alexandria ALEXAlex-ID: agm006129846 · Space group: C2/m (#12)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
AB5C6_8_spg12
TmN DyN
2023-09-02 16:50:11.239898
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm006129846).
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 agm006129846
data_agm006129846
_cell_length_a 5.91368
_cell_length_b 5.91387
_cell_length_c 5.91479
_cell_angle_alpha 60.00517
_cell_angle_beta 80.41339
_cell_angle_gamma 70.54122
_cell_volume 168.91907
_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
N1 N 0.74859 0.08376 0.33597 1.00000
N2 N 0.25141 0.58027 0.33597 1.00000
N3 N 0.25144 0.25217 0.00000 1.00000
N4 N 0.74856 0.74783 0.00000 1.00000
N5 N 0.74859 0.41973 0.66403 1.00000
N6 N 0.25141 0.91624 0.66403 1.00000
Tm1 Tm 0.50000 0.16704 0.66592 1.00000
Tm2 Tm 1.00000 0.33335 0.33330 1.00000
Tm3 Tm 0.50000 0.50000 0.00000 1.00000
Tm4 Tm 0.00000 0.66665 0.66670 1.00000
Tm5 Tm 0.50000 0.83296 0.33408 1.00000
Dy1 Dy 0.00000 0.00000 0.00000 1.00000
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