La(TmGa4)2
Alexandria ALEXAlex-ID: agm005986604 · Space group: Immm (#71)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
AB2C8_284_spg12
TmGa2 TmGa3 La3Ga8
2023-10-18 13:03:23.708606
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm005986604).
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 agm005986604
data_agm005986604
_cell_length_a 5.32513
_cell_length_b 5.87224
_cell_length_c 8.22626
_cell_angle_alpha 110.93665
_cell_angle_beta 108.91247
_cell_angle_gamma 89.92671
_cell_volume 225.36694
_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 0.68793 0.68793 0.37585 1.00000
Tm2 Tm 0.31207 0.31207 0.62415 1.00000
Ga1 Ga 0.12113 0.35598 0.24149 1.00000
Ga2 Ga 0.87964 0.11449 0.75851 1.00000
Ga3 Ga 0.73924 0.49954 1.00000 1.00000
Ga4 Ga 0.71775 0.21775 0.43550 1.00000
Ga5 Ga 0.28225 0.78225 0.56450 1.00000
Ga6 Ga 0.26076 0.50046 0.00000 1.00000
Ga7 Ga 0.12036 0.88551 0.24149 1.00000
Ga8 Ga 0.87887 0.64402 0.75851 1.00000
La1 La 0.50000 0.00000 0.00000 1.00000
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