Tm2Be12Co5
Alexandria ALEXAlex-ID: agm005680812 · Space group: R-3m (#166)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
A2B5C12_274_spg166
TmBe13 Tm5Co2 Be2Co
2023-06-23 01:36:50.373689
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm005680812).
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 agm005680812
data_agm005680812
_cell_length_a 5.92194
_cell_length_b 5.92194
_cell_length_c 5.92194
_cell_angle_alpha 83.39605
_cell_angle_beta 83.39605
_cell_angle_gamma 83.39605
_cell_volume 203.83936
_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
Tm1 Tm 0.66154 0.66154 0.66154 1.00000
Tm2 Tm 0.33846 0.33846 0.33846 1.00000
Be1 Be 0.27877 0.72123 0.00000 1.00000
Be2 Be 0.72123 0.00000 0.27877 1.00000
Be3 Be 1.00000 0.27877 0.72123 1.00000
Be4 Be 0.72123 0.27877 1.00000 1.00000
Be5 Be 0.27877 1.00000 0.72123 1.00000
Be6 Be 0.00000 0.72123 0.27877 1.00000
Be7 Be 0.33707 0.33707 0.85045 1.00000
Be8 Be 0.33707 0.85045 0.33707 1.00000
Be9 Be 0.85045 0.33707 0.33707 1.00000
Be10 Be 0.66293 0.14955 0.66293 1.00000
Be11 Be 0.66293 0.66293 0.14955 1.00000
Be12 Be 0.14955 0.66293 0.66293 1.00000
Co1 Co 0.00000 0.00000 0.50000 1.00000
Co2 Co 0.00000 0.50000 0.00000 1.00000
Co3 Co 0.50000 0.00000 0.00000 1.00000
Co4 Co 0.90203 0.90203 0.90203 1.00000
Co5 Co 0.09797 0.09797 0.09797 1.00000
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