Y5(Tm2Th)2
Alexandria ALEXAlex-ID: agm005641094 · Space group: C2/m (#12)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
A2B4C5_643_spg12
Y5Tm YTmTh2 Tm2Th
2023-06-22 20:49:00.853202
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm005641094).
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 agm005641094
data_agm005641094
_cell_length_a 3.49438
_cell_length_b 11.50568
_cell_length_c 8.89647
_cell_angle_alpha 94.06096
_cell_angle_beta 101.32214
_cell_angle_gamma 89.99574
_cell_volume 349.80778
_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
Y1 Y 0.90261 0.46600 0.80525 1.00000
Y2 Y 0.09739 0.53400 0.19475 1.00000
Y3 Y 0.82301 0.92959 0.64600 1.00000
Y4 Y 0.50000 0.00000 0.00000 1.00000
Y5 Y 0.17699 0.07041 0.35400 1.00000
Tm1 Tm 0.35877 0.20500 0.71751 1.00000
Tm2 Tm 0.96655 0.74394 0.93306 1.00000
Tm3 Tm 0.64123 0.79500 0.28249 1.00000
Tm4 Tm 0.03345 0.25606 0.06694 1.00000
Th1 Th 0.71758 0.35831 0.43514 1.00000
Th2 Th 0.28242 0.64169 0.56486 1.00000
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