Tb5Tm2Sc5
Alexandria ALEXAlex-ID: agm003374497 · Space group: C2/m (#12)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
A2B5C5_18_spg12
Tb5Tm4 Tb5Tm Sc
2022-02-08 21:58:40.043438
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm003374497).
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 agm003374497
data_agm003374497
_cell_length_a 4.83179
_cell_length_b 7.64089
_cell_length_c 10.85492
_cell_angle_alpha 115.05010
_cell_angle_beta 90.00000
_cell_angle_gamma 108.43203
_cell_volume 340.22940
_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 0.50000 0.00000 0.50000 1.00000
Tb2 Tb 0.66457 0.32913 0.99936 1.00000
Tb3 Tb 0.58740 0.17481 0.25203 1.00000
Tb4 Tb 0.41260 0.82519 0.74797 1.00000
Tb5 Tb 0.33543 0.67087 0.00064 1.00000
Tm1 Tm 0.08341 0.16683 0.74606 1.00000
Tm2 Tm 0.91659 0.83317 0.25394 1.00000
Sc1 Sc 0.17089 0.34178 0.50192 1.00000
Sc2 Sc 0.74938 0.49875 0.74548 1.00000
Sc3 Sc 0.25062 0.50125 0.25452 1.00000
Sc4 Sc 0.82911 0.65822 0.49808 1.00000
Sc5 Sc 0.00000 0.00000 0.00000 1.00000
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