Mn4Cr2FeCoB2
Alexandria ALEXAlex-ID: agm011156546 · Space group: P2/m (#10)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
ABC2D2E4_11_spg10
Mn2B Mn2CrB MnCrB Mn3CrCo2 Fe4Co3
2024-06-28 19:27:09.072379
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm011156546).
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 agm011156546
data_agm011156546
_cell_length_a 2.81362
_cell_length_b 8.55053
_cell_length_c 8.46287
_cell_angle_alpha 89.24236
_cell_angle_beta 90.00000
_cell_angle_gamma 90.00000
_cell_volume 203.58143
_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
Mn1 Mn 0.50000 0.07396 0.21072 1.00000
Mn2 Mn 0.50000 0.92604 0.78928 1.00000
Mn3 Mn 0.50000 0.28819 0.43105 1.00000
Mn4 Mn 0.50000 0.71181 0.56895 1.00000
Mn5 Mn 0.50000 0.21249 0.92892 1.00000
Mn6 Mn 0.50000 0.78751 0.07108 1.00000
Mn7 Mn 0.50000 0.50000 0.00000 1.00000
Mn8 Mn 0.50000 0.00000 0.50000 1.00000
Cr1 Cr 0.00000 0.67508 0.82548 1.00000
Cr2 Cr 0.00000 0.32492 0.17452 1.00000
Cr3 Cr 0.00000 0.17223 0.67643 1.00000
Cr4 Cr 0.00000 0.82777 0.32357 1.00000
Fe1 Fe 0.00000 0.50000 0.50000 1.00000
Fe2 Fe 0.00000 0.00000 0.00000 1.00000
Co1 Co 0.50000 0.57082 0.28706 1.00000
Co2 Co 0.50000 0.42918 0.71294 1.00000
B1 B 0.00000 0.12428 0.37516 1.00000
B2 B 0.00000 0.87572 0.62484 1.00000
B3 B 0.00000 0.62231 0.12502 1.00000
B4 B 0.00000 0.37769 0.87498 1.00000
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