Tb5(DyH)2
Alexandria ALEXAlex-ID: agm007167706 · Space group: P-1 (#2)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
A2B2C5_276_spg12
TbDy5 TbDy3H8 Tb5Dy
2024-06-24 12:07:46.547000
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm007167706).
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
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# CIF generated by HEAS from Alexandria entry agm007167706
data_agm007167706
_cell_length_a 5.11013
_cell_length_b 6.25829
_cell_length_c 8.04387
_cell_angle_alpha 97.29636
_cell_angle_beta 89.74843
_cell_angle_gamma 113.92269
_cell_volume 232.92973
_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
Tb1 Tb 0.42574 0.85114 0.28432 1.00000
Tb2 Tb 0.57426 0.14886 0.71568 1.00000
Tb3 Tb 0.14446 0.29082 0.42871 1.00000
Tb4 Tb 0.85554 0.70918 0.57129 1.00000
Tb5 Tb 0.00000 0.00000 0.00000 1.00000
Dy1 Dy 0.29032 0.56659 0.85677 1.00000
Dy2 Dy 0.70968 0.43341 0.14323 1.00000
H1 H 0.46330 0.42785 0.63967 1.00000
H2 H 0.53670 0.57215 0.36033 1.00000
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