Tb8Ag6S
Alexandria ALEXAlex-ID: agm072675868 · Space group: R-3 (#148)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
AB6C8_0_spg148
Tb6AgS4 TbAg Tb
2024-10-07 08:58:21.525755
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm072675868).
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
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# CIF generated by HEAS from Alexandria entry agm072675868
data_agm072675868
_cell_length_a 7.67988
_cell_length_b 7.67988
_cell_length_c 7.67988
_cell_angle_alpha 73.14595
_cell_angle_beta 73.14595
_cell_angle_gamma 73.14595
_cell_volume 404.27078
_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 0.31408 0.31408 0.31408 1.00000
Tb2 Tb 0.68592 0.68592 0.68592 1.00000
Tb3 Tb 0.84183 0.10374 0.33565 1.00000
Tb4 Tb 0.33565 0.84183 0.10374 1.00000
Tb5 Tb 0.10374 0.33565 0.84183 1.00000
Tb6 Tb 0.15817 0.89626 0.66435 1.00000
Tb7 Tb 0.66435 0.15817 0.89626 1.00000
Tb8 Tb 0.89626 0.66435 0.15817 1.00000
Ag1 Ag 0.07610 0.66477 0.46374 1.00000
Ag2 Ag 0.46374 0.07610 0.66477 1.00000
Ag3 Ag 0.66477 0.46374 0.07610 1.00000
Ag4 Ag 0.92390 0.33523 0.53626 1.00000
Ag5 Ag 0.53626 0.92390 0.33523 1.00000
Ag6 Ag 0.33523 0.53626 0.92390 1.00000
S1 S 0.00000 0.00000 0.00000 1.00000
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