La5Y2Tm5
Alexandria ALEXAlex-ID: agm005647719 · Space group: C2/m (#12)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
A2B5C5_18_spg12
La7Tm LaY2 LaTm2
2023-06-19 13:32:40.427110
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm005647719).
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 agm005647719
data_agm005647719
_cell_length_a 5.08552
_cell_length_b 10.82175
_cell_length_c 8.10837
_cell_angle_alpha 98.68229
_cell_angle_beta 71.72388
_cell_angle_gamma 76.41030
_cell_volume 399.47966
_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
La1 La 0.66851 0.25048 0.41249 1.00000
La2 La 0.99841 0.24961 0.75358 1.00000
La3 La 0.00159 0.75039 0.24642 1.00000
La4 La 0.33149 0.74952 0.58751 1.00000
La5 La 0.00000 0.00000 0.00000 1.00000
Y1 Y 0.33232 0.50158 0.83379 1.00000
Y2 Y 0.66768 0.49842 0.16621 1.00000
Tm1 Tm 0.00000 0.50000 0.50000 1.00000
Tm2 Tm 0.66835 0.74722 0.91607 1.00000
Tm3 Tm 0.33272 0.99985 0.33471 1.00000
Tm4 Tm 0.66728 0.00015 0.66529 1.00000
Tm5 Tm 0.33165 0.25278 0.08393 1.00000
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