PrMn5Co7
Alexandria ALEXAlex-ID: agm005262985 · Space group: Imm2 (#44)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
AB5C7_7_spg44
Mn5Co Pr2MnCo16 PrCo
2023-05-06 13:42:58.309823
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm005262985).
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 agm005262985
data_agm005262985
_cell_length_a 6.40914
_cell_length_b 6.40914
_cell_length_c 6.40914
_cell_angle_alpha 137.98999
_cell_angle_beta 97.75214
_cell_angle_gamma 97.01239
_cell_volume 164.48290
_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
Pr1 Pr 0.00130 0.00000 0.00130 1.00000
Mn1 Mn 0.49758 0.99396 0.99730 1.00000
Mn2 Mn 0.49758 0.50028 0.50361 1.00000
Mn3 Mn 0.00334 0.49972 0.99730 1.00000
Mn4 Mn 0.00334 0.00604 0.50361 1.00000
Mn5 Mn 0.76882 0.50000 0.26882 1.00000
Co1 Co 0.35851 0.00000 0.35851 1.00000
Co2 Co 0.63754 0.00000 0.63754 1.00000
Co3 Co 0.64170 0.63908 0.00262 1.00000
Co4 Co 0.36353 0.36092 0.00262 1.00000
Co5 Co 0.22927 0.50000 0.72927 1.00000
Co6 Co 0.23448 0.73573 0.49874 1.00000
Co7 Co 0.76301 0.26427 0.49874 1.00000
Get direct link