Tb3InTc
Alexandria ALEXAlex-ID: agm005803111 · Space group: Fmmm (#69)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
ABC3_6810_spg2
Tb2In Tb4InTc TbTc2
2023-07-06 01:02:39.392866
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm005803111).
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 agm005803111
data_agm005803111
_cell_length_a 5.88991
_cell_length_b 5.88991
_cell_length_c 8.69687
_cell_angle_alpha 102.60143
_cell_angle_beta 102.59891
_cell_angle_gamma 110.84148
_cell_volume 260.30237
_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 0.29909 0.79910 0.09819 1.00000
Tb2 Tb 0.70091 0.20090 0.90181 1.00000
Tb3 Tb 0.08293 0.19841 0.28134 1.00000
Tb4 Tb 0.91707 0.80159 0.71866 1.00000
Tb5 Tb 0.69839 0.58295 0.28135 1.00000
Tb6 Tb 0.30161 0.41705 0.71865 1.00000
In1 In 0.70568 0.20568 0.50000 1.00000
In2 In 0.29432 0.79432 0.50000 1.00000
Tc1 Tc 0.25001 0.25001 0.00000 1.00000
Tc2 Tc 0.74999 0.74999 0.00000 1.00000
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