Cd2TcRu2
Alexandria ALEXAlex-ID: agm005409295 · Space group: I4/mmm (#139)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
AB2C2_106_spg139
TcRu TcRu3 Cd
2023-03-17 21:42:39.993552
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm005409295).
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 agm005409295
data_agm005409295
_cell_length_a 7.43419
_cell_length_b 7.43419
_cell_length_c 7.43419
_cell_angle_alpha 151.74936
_cell_angle_beta 151.74936
_cell_angle_gamma 40.37944
_cell_volume 91.86623
_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
Cd1 Cd 0.25000 0.75000 0.50000 1.00000
Cd2 Cd 0.75000 0.25000 0.50000 1.00000
Tc1 Tc 0.00000 0.00000 0.00000 1.00000
Ru1 Ru 0.58696 0.58696 0.00000 1.00000
Ru2 Ru 0.41304 0.41304 0.00000 1.00000
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