CeTcSn
Alexandria ALEXAlex-ID: agm005679158 · Space group: P2_1/c (#14)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
ABC_10965_spg14
CeTcSn
2023-06-18 13:38:23.587209
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm005679158).
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 agm005679158
data_agm005679158
_cell_length_a 6.63668
_cell_length_b 6.11549
_cell_length_c 7.21841
_cell_angle_alpha 90.00000
_cell_angle_beta 91.70629
_cell_angle_gamma 90.00000
_cell_volume 292.84078
_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
Ce1 Ce 0.78670 0.63140 0.38663 1.00000
Ce2 Ce 0.21330 0.36860 0.61337 1.00000
Ce3 Ce 0.28670 0.86860 0.88663 1.00000
Ce4 Ce 0.71330 0.13140 0.11337 1.00000
Tc1 Tc 0.96886 0.13862 0.34259 1.00000
Tc2 Tc 0.46886 0.36138 0.84259 1.00000
Tc3 Tc 0.03114 0.86138 0.65741 1.00000
Tc4 Tc 0.53114 0.63862 0.15741 1.00000
Sn1 Sn 0.81233 0.62065 0.88660 1.00000
Sn2 Sn 0.18767 0.37935 0.11340 1.00000
Sn3 Sn 0.68767 0.12065 0.61340 1.00000
Sn4 Sn 0.31233 0.87935 0.38660 1.00000
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