Tm6FeCo8
Alexandria ALEXAlex-ID: agm072867397 · Space group: P-1 (#2)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
AB6C8_78_spg147
TmCo2 Tm3FeCo3 TmCo
2024-10-06 00:54:34.022616
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm072867397).
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 agm072867397
data_agm072867397
_cell_length_a 5.32648
_cell_length_b 6.89724
_cell_length_c 7.62773
_cell_angle_alpha 107.75965
_cell_angle_beta 98.95264
_cell_angle_gamma 91.21392
_cell_volume 262.91898
_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 0.09750 0.24481 0.44315 1.00000
Tm2 Tm 0.21566 0.56419 0.89569 1.00000
Tm3 Tm 0.45338 0.03420 0.77307 1.00000
Tm4 Tm 0.90250 0.75519 0.55685 1.00000
Tm5 Tm 0.78434 0.43581 0.10431 1.00000
Tm6 Tm 0.54662 0.96580 0.22693 1.00000
Fe1 Fe 0.00000 0.00000 0.00000 1.00000
Co1 Co 0.96615 0.17308 0.78259 1.00000
Co2 Co 0.03385 0.82692 0.21741 1.00000
Co3 Co 0.69525 0.37884 0.68634 1.00000
Co4 Co 0.28437 0.28463 0.10356 1.00000
Co5 Co 0.41909 0.62351 0.61451 1.00000
Co6 Co 0.30475 0.62116 0.31366 1.00000
Co7 Co 0.71563 0.71537 0.89644 1.00000
Co8 Co 0.58091 0.37649 0.38549 1.00000
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