Ce2Mn2B2C
Alexandria ALEXAlex-ID: agm017183503 · Space group: C2/m (#12)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
AB2C2D2_49_spg12
Ce(MnB3)2 Mn2B Ce(MnC)2 Ce
2025-04-30 01:14:33
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm017183503).
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 agm017183503
data_agm017183503
_cell_length_a 3.54938
_cell_length_b 5.42517
_cell_length_c 5.90989
_cell_angle_alpha 69.33402
_cell_angle_beta 72.53230
_cell_angle_gamma 70.91687
_cell_volume 98.40480
_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
Ce1 Ce 0.43585 0.79705 0.33145 1.00000
Ce2 Ce 0.56415 0.20295 0.66855 1.00000
Mn1 Mn 0.79829 0.31696 0.08643 1.00000
Mn2 Mn 0.20171 0.68304 0.91357 1.00000
B1 B 0.80878 0.62396 0.75828 1.00000
B2 B 0.19122 0.37604 0.24172 1.00000
C1 C 0.00000 0.00000 0.00000 1.00000
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