Tb3MgCd7
Alexandria ALEXAlex-ID: agm005994932 · Space group: Cmcm (#63)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
AB3C7_287_spg63
TbCd2 TbCd3 TbMgCd2
2023-08-13 23:04:05.570630
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm005994932).
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 agm005994932
data_agm005994932
_cell_length_a 3.52071
_cell_length_b 13.36017
_cell_length_c 12.22658
_cell_angle_alpha 89.99971
_cell_angle_beta 90.00000
_cell_angle_gamma 97.57138
_cell_volume 570.09003
_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 0.09131 0.18262 0.42328 1.00000
Tb2 Tb 0.90869 0.81738 0.57672 1.00000
Tb3 Tb 0.21961 0.43922 0.75001 1.00000
Tb4 Tb 0.78039 0.56078 0.24999 1.00000
Tb5 Tb 0.09131 0.18262 0.07672 1.00000
Tb6 Tb 0.90869 0.81738 0.92328 1.00000
Mg1 Mg 0.93212 0.86424 0.25000 1.00000
Mg2 Mg 0.06788 0.13576 0.75000 1.00000
Cd1 Cd 0.34392 0.68785 0.75000 1.00000
Cd2 Cd 0.65608 0.31215 0.25000 1.00000
Cd3 Cd 0.48770 0.97539 0.38886 1.00000
Cd4 Cd 0.51230 0.02461 0.61114 1.00000
Cd5 Cd 0.51230 0.02461 0.88886 1.00000
Cd6 Cd 0.48770 0.97539 0.11114 1.00000
Cd7 Cd 0.36760 0.73520 0.37294 1.00000
Cd8 Cd 0.63240 0.26480 0.62706 1.00000
Cd9 Cd 0.29293 0.58585 0.53471 1.00000
Cd10 Cd 0.70707 0.41415 0.46529 1.00000
Cd11 Cd 0.70707 0.41414 0.03470 1.00000
Cd12 Cd 0.29293 0.58586 0.96530 1.00000
Cd13 Cd 0.36760 0.73521 0.12706 1.00000
Cd14 Cd 0.63240 0.26479 0.87294 1.00000
