Tb2Dy(NpSc)2
Alexandria ALEXAlex-ID: agm011369474 · Space group: I4/mmm (#139)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
AB2C2D2_117_spg119
Tb5Dy TbDy5 Np Sc
2024-06-24 11:18:02.941757
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm011369474).
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 agm011369474
data_agm011369474
_cell_length_a 17.41180
_cell_length_b 17.41057
_cell_length_c 3.33738
_cell_angle_alpha 84.52127
_cell_angle_beta 84.47937
_cell_angle_gamma 10.99936
_cell_volume 192.13711
_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 0.64484 0.64484 0.35516 1.00000
Tb2 Tb 0.35516 0.35516 0.64484 1.00000
Dy1 Dy 0.50000 0.50000 0.50000 1.00000
Np1 Np 0.92698 0.92698 0.07302 1.00000
Np2 Np 0.07302 0.07302 0.92698 1.00000
Sc1 Sc 0.78157 0.78157 0.21843 1.00000
Sc2 Sc 0.21843 0.21843 0.78157 1.00000
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