Tb2Ag3Pb
Alexandria ALEXAlex-ID: agm005667748 · Space group: P6/mmm (#191)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
AB2C3_2046_spg191
TbAg2 TbAgPb
2023-08-07 02:41:49.710017
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm005667748).
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 agm005667748
data_agm005667748
_cell_length_a 6.95951
_cell_length_b 9.73073
_cell_length_c 9.73073
_cell_angle_alpha 119.99999
_cell_angle_beta 90.00000
_cell_angle_gamma 90.00000
_cell_volume 570.69032
_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 0.25000 0.00000 0.00000 1.00000
Tb2 Tb 0.75000 0.00000 0.00000 1.00000
Tb3 Tb 0.25000 0.49977 0.99954 1.00000
Tb4 Tb 0.25000 0.49977 0.50023 1.00000
Tb5 Tb 0.25000 0.00046 0.50023 1.00000
Tb6 Tb 0.75000 0.50023 0.00046 1.00000
Tb7 Tb 0.75000 0.50023 0.49977 1.00000
Tb8 Tb 0.75000 0.99954 0.49977 1.00000
Ag1 Ag 0.00053 0.83660 0.67320 1.00000
Ag2 Ag 0.00053 0.83660 0.16340 1.00000
Ag3 Ag 0.00053 0.32680 0.16340 1.00000
Ag4 Ag 0.99947 0.16340 0.32680 1.00000
Ag5 Ag 0.99947 0.16340 0.83660 1.00000
Ag6 Ag 0.99947 0.67320 0.83660 1.00000
Ag7 Ag 0.50053 0.16340 0.32680 1.00000
Ag8 Ag 0.50053 0.16340 0.83660 1.00000
Ag9 Ag 0.50053 0.67320 0.83660 1.00000
Ag10 Ag 0.49947 0.83660 0.67320 1.00000
Ag11 Ag 0.49947 0.83660 0.16340 1.00000
Ag12 Ag 0.49947 0.32680 0.16340 1.00000
Pb1 Pb 0.00055 0.66667 0.33333 1.00000
Pb2 Pb 0.99945 0.33333 0.66667 1.00000
Pb3 Pb 0.50055 0.33333 0.66667 1.00000
Pb4 Pb 0.49945 0.66667 0.33333 1.00000
