TbPuSi4
Alexandria ALEXAlex-ID: agm005777827 · Space group: Immm (#71)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
ABC4_179_spg71
Tb10Si17 PuSi2 Si
2023-07-31 07:56:50.044370
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm005777827).
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 agm005777827
data_agm005777827
_cell_length_a 4.07586
_cell_length_b 5.64741
_cell_length_c 5.64740
_cell_angle_alpha 76.95516
_cell_angle_beta 68.81793
_cell_angle_gamma 68.81794
_cell_volume 112.34140
_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 0.99997 0.00000 0.00000 1.00000
Pu1 Pu 0.49998 0.50000 0.50000 1.00000
Si1 Si 0.75275 0.58105 0.91331 1.00000
Si2 Si 0.75275 0.91331 0.58105 1.00000
Si3 Si 0.24719 0.41895 0.08669 1.00000
Si4 Si 0.24719 0.08669 0.41895 1.00000
