Tm6Ga2Pb
Alexandria ALEXAlex-ID: agm005702489 · Space group: Immm (#71)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
AB2C6_712_spg71
Tm5Ga2Pb Tm
2023-07-07 05:07:31.218296
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm005702489).
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 agm005702489
data_agm005702489
_cell_length_a 8.54758
_cell_length_b 8.54758
_cell_length_c 8.54758
_cell_angle_alpha 104.00767
_cell_angle_beta 112.35109
_cell_angle_gamma 112.18926
_cell_volume 477.49974
_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
Tm1 Tm 0.53693 0.72162 0.81530 1.00000
Tm2 Tm 0.46307 0.27838 0.18470 1.00000
Tm3 Tm 0.09368 0.27838 0.81530 1.00000
Tm4 Tm 0.90632 0.72162 0.18470 1.00000
Tm5 Tm 0.79414 0.75963 0.55377 1.00000
Tm6 Tm 0.20586 0.24037 0.44623 1.00000
Tm7 Tm 0.20586 0.75963 0.96549 1.00000
Tm8 Tm 0.79414 0.24037 0.03451 1.00000
Tm9 Tm 0.70096 0.38059 0.67963 1.00000
Tm10 Tm 0.29904 0.61941 0.32037 1.00000
Tm11 Tm 0.29904 0.97867 0.67963 1.00000
Tm12 Tm 0.70096 0.02133 0.32037 1.00000
Ga1 Ga 0.50000 0.37972 0.87972 1.00000
Ga2 Ga 0.50000 0.62028 0.12028 1.00000
Ga3 Ga 0.64506 1.00000 0.64506 1.00000
Ga4 Ga 0.35494 0.00000 0.35494 1.00000
Pb1 Pb 0.00000 0.50000 0.50000 1.00000
Pb2 Pb 0.00000 0.00000 0.00000 1.00000
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