Tb4Cd3Hg2
Alexandria ALEXAlex-ID: agm005633554 · Space group: P-3m1 (#164)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
A2B3C4_138_spg12
Tb3CdHg2 TbCd2
2023-07-03 11:31:08.381728
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm005633554).
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 agm005633554
data_agm005633554
_cell_length_a 5.19802
_cell_length_b 5.19802
_cell_length_c 9.93524
_cell_angle_alpha 89.99173
_cell_angle_beta 89.99173
_cell_angle_gamma 60.01055
_cell_volume 232.50461
_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 0.66670 0.66670 0.11906 1.00000
Tb2 Tb 1.00000 1.00000 0.67052 1.00000
Tb3 Tb 0.00000 0.00000 0.32948 1.00000
Tb4 Tb 0.33330 0.33330 0.88094 1.00000
Cd1 Cd 0.33334 0.33334 0.52206 1.00000
Cd2 Cd 0.00000 0.00000 0.00000 1.00000
Cd3 Cd 0.66666 0.66666 0.47794 1.00000
Hg1 Hg 0.33332 0.33332 0.19483 1.00000
Hg2 Hg 0.66668 0.66668 0.80517 1.00000
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