Th10Ga
Alexandria ALEXAlex-ID: agm012329486 · Space group: C2/m (#12)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
AB10_27_spg12
Th2Ga Th
2024-06-24 11:58:52.338537
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm012329486).
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 agm012329486
data_agm012329486
_cell_length_a 6.11261
_cell_length_b 6.11261
_cell_length_c 12.81533
_cell_angle_alpha 76.36305
_cell_angle_beta 76.36305
_cell_angle_gamma 47.10242
_cell_volume 338.97892
_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
Th1 Th 0.58864 0.58864 0.86241 1.00000
Th2 Th 0.77230 0.77230 0.58587 1.00000
Th3 Th 0.86157 0.86157 0.95390 1.00000
Th4 Th 0.96072 0.96072 0.32720 1.00000
Th5 Th 0.13843 0.13843 0.04610 1.00000
Th6 Th 0.22770 0.22770 0.41413 1.00000
Th7 Th 0.41136 0.41136 0.13759 1.00000
Th8 Th 0.03928 0.03928 0.67280 1.00000
Th9 Th 0.68134 0.68134 0.23574 1.00000
Th10 Th 0.31866 0.31866 0.76426 1.00000
Ga1 Ga 0.50000 0.50000 0.50000 1.00000
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