Tm2Ga3
Alexandria ALEXAlex-ID: agm002151237 · Space group: Fdd2 (#43)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
A2B3_55_spg43
TmGa Tm3Ga5
2018-06-05 20:38:51
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm002151237).
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 agm002151237
data_agm002151237
_cell_length_a 5.77597
_cell_length_b 5.77597
_cell_length_c 7.78341
_cell_angle_alpha 100.61257
_cell_angle_beta 100.61256
_cell_angle_gamma 120.22089
_cell_volume 208.49211
_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 0.10954 0.76226 0.89537 1.00000
Tm2 Tm 0.86682 0.21389 0.10441 1.00000
Tm3 Tm 0.01226 0.85954 0.39537 1.00000
Tm4 Tm 0.46389 0.61682 0.60441 1.00000
Ga1 Ga 0.57562 0.57551 0.99995 1.00000
Ga2 Ga 0.82551 0.32562 0.49995 1.00000
Ga3 Ga 0.53418 0.17244 0.73762 1.00000
Ga4 Ga 0.43404 0.79570 0.26266 1.00000
Ga5 Ga 0.42244 0.28418 0.23762 1.00000
Ga6 Ga 0.04570 0.18404 0.76266 1.00000
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