Tb8AuC4
Alexandria ALEXAlex-ID: agm097303469 · Space group: P1 (#1)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
AB4C8_1595_spg1
TbAu Tb4C5 Tb2C
2025-06-12 12:43:54
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm097303469).
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 agm097303469
data_agm097303469
_cell_length_a 3.61413
_cell_length_b 9.28264
_cell_length_c 10.15917
_cell_angle_alpha 120.98019
_cell_angle_beta 87.44535
_cell_angle_gamma 91.41609
_cell_volume 291.91526
_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 0.43034 0.11797 0.51255 1.00000
Tb2 Tb 0.15524 0.04473 0.86341 1.00000
Tb3 Tb 0.15296 0.63910 0.19427 1.00000
Tb4 Tb 0.15007 0.60131 0.67541 1.00000
Tb5 Tb 0.63734 0.38036 0.29669 1.00000
Tb6 Tb 0.67726 0.38698 0.85863 1.00000
Tb7 Tb 0.63264 0.81348 0.01438 1.00000
Tb8 Tb 0.68719 0.80787 0.53511 1.00000
Au1 Au 0.08827 0.09153 0.24826 1.00000
C1 C 0.65468 0.82453 0.78209 1.00000
C2 C 0.94484 0.10601 0.67121 1.00000
C3 C 0.14307 0.59745 0.93465 1.00000
C4 C 0.14609 0.58868 0.41334 1.00000
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