Tb3ZnGa3
Alexandria ALEXAlex-ID: agm005940892 · Space group: C2/m (#12)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
AB3C3_609_spg12
TbZnGa TbGa
2023-08-07 01:39:31.739074
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm005940892).
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 agm005940892
data_agm005940892
_cell_length_a 4.40010
_cell_length_b 5.81107
_cell_length_c 13.53753
_cell_angle_alpha 84.61018
_cell_angle_beta 80.64711
_cell_angle_gamma 67.75325
_cell_volume 315.92052
_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 0.53983 0.30232 0.61802 1.00000
Tb2 Tb 0.46017 0.69768 0.38198 1.00000
Tb3 Tb 0.25613 0.26635 0.22139 1.00000
Tb4 Tb 0.74387 0.73365 0.77861 1.00000
Tb5 Tb 0.39883 0.28155 0.92080 1.00000
Tb6 Tb 0.60117 0.71845 0.07920 1.00000
Zn1 Zn 0.75279 0.10136 0.39305 1.00000
Zn2 Zn 0.24721 0.89864 0.60695 1.00000
Ga1 Ga 0.87008 0.71441 0.54542 1.00000
Ga2 Ga 0.12992 0.28559 0.45458 1.00000
Ga3 Ga 0.11259 0.84877 0.92605 1.00000
Ga4 Ga 0.88741 0.15123 0.07395 1.00000
Ga5 Ga 0.96403 0.83946 0.23249 1.00000
Ga6 Ga 0.03597 0.16054 0.76751 1.00000
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