Tb3(PrHg)2
Alexandria ALEXAlex-ID: agm009762901 · Space group: C2/m (#12)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
A2B2C3_22_spg12
Pr2Hg Tb2Hg Pr
2025-06-26 18:33:28
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm009762901).
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 agm009762901
data_agm009762901
_cell_length_a 6.76529
_cell_length_b 6.76529
_cell_length_c 8.75061
_cell_angle_alpha 81.39126
_cell_angle_beta 98.60874
_cell_angle_gamma 147.90898
_cell_volume 210.17939
_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 0.00000 0.00000 0.00000 1.00000
Tb2 Tb 0.12700 0.87300 0.44965 1.00000
Tb3 Tb 0.87300 0.12700 0.55035 1.00000
Pr1 Pr 0.25673 0.74327 0.82938 1.00000
Pr2 Pr 0.74327 0.25673 0.17062 1.00000
Hg1 Hg 0.54497 0.45503 0.73229 1.00000
Hg2 Hg 0.45503 0.54497 0.26771 1.00000
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