Tm2Mn3B2
Alexandria ALEXAlex-ID: agm009409398 · Space group: C2/m (#12)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
A2B2C3_237_spg12
Tm3MnB7 Mn2B Tm
2024-03-10 02:23:34.659783
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm009409398).
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 agm009409398
data_agm009409398
_cell_length_a 5.12956
_cell_length_b 5.12956
_cell_length_c 6.82198
_cell_angle_alpha 64.09340
_cell_angle_beta 64.09340
_cell_angle_gamma 36.13946
_cell_volume 94.02041
_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 0.86700 0.86700 0.77304 1.00000
Tm2 Tm 0.13300 0.13300 0.22696 1.00000
Mn1 Mn 0.50000 0.50000 0.00000 1.00000
Mn2 Mn 0.64612 0.64612 0.56542 1.00000
Mn3 Mn 0.35388 0.35388 0.43458 1.00000
B1 B 0.85579 0.85579 0.23355 1.00000
B2 B 0.14421 0.14421 0.76645 1.00000
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