CoTcOs
Alexandria ALEXAlex-ID: agm005658325 · Space group: C2/m (#12)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
ABC_7764_spg12
TcOs Co
2023-06-17 06:16:11.774603
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm005658325).
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 agm005658325
data_agm005658325
_cell_length_a 2.70546
_cell_length_b 5.42450
_cell_length_c 7.56047
_cell_angle_alpha 122.53891
_cell_angle_beta 79.73795
_cell_angle_gamma 119.91939
_cell_volume 80.45351
_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
Co1 Co 0.51483 0.56368 0.80051 1.00000
Co2 Co 0.49754 0.04316 0.79504 1.00000
Tc1 Tc 0.72855 0.10956 0.46558 1.00000
Tc2 Tc 0.28382 0.49728 0.12997 1.00000
Os1 Os 0.28300 0.99620 0.12911 1.00000
Os2 Os 0.72937 0.61064 0.46644 1.00000
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