TbMnB14
Alexandria ALEXAlex-ID: agm005754933 · Space group: Imma (#74)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
ABC14_1_spg74
TbB12 MnB4 TbB4
2023-07-18 14:04:45.507059
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm005754933).
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 agm005754933
data_agm005754933
_cell_length_a 5.85339
_cell_length_b 7.36781
_cell_length_c 7.36781
_cell_angle_alpha 68.09933
_cell_angle_beta 66.59504
_cell_angle_gamma 66.59505
_cell_volume 258.72732
_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
Tb1 Tb 0.25000 0.37782 0.12218 1.00000
Tb2 Tb 0.75000 0.62218 0.87782 1.00000
Mn1 Mn 0.50000 0.00000 0.50000 1.00000
Mn2 Mn 0.00000 0.00000 0.50000 1.00000
B1 B 0.66672 0.36489 0.30166 1.00000
B2 B 0.33328 0.63511 0.69834 1.00000
B3 B 0.16672 0.80166 0.86489 1.00000
B4 B 0.83328 0.19834 0.13511 1.00000
B5 B 0.12951 0.24013 0.50085 1.00000
B6 B 0.87049 0.75987 0.49915 1.00000
B7 B 0.62951 0.00085 0.74013 1.00000
B8 B 0.37049 0.99915 0.25987 1.00000
B9 B 0.08423 0.08575 0.74579 1.00000
B10 B 0.91577 0.91425 0.25421 1.00000
B11 B 0.58423 0.24579 0.58575 1.00000
B12 B 0.41577 0.75421 0.41425 1.00000
B13 B 0.72158 0.59963 0.27720 1.00000
B14 B 0.59840 0.40037 0.72280 1.00000
B15 B 0.22158 0.77720 0.09963 1.00000
B16 B 0.09840 0.22280 0.90037 1.00000
B17 B 0.27842 0.40037 0.72280 1.00000
B18 B 0.40160 0.59963 0.27720 1.00000
B19 B 0.77842 0.22280 0.90037 1.00000
B20 B 0.90160 0.77720 0.09963 1.00000
B21 B 0.32607 0.96940 0.87494 1.00000
B22 B 0.17040 0.03060 0.12506 1.00000
B23 B 0.82607 0.37494 0.46940 1.00000
B24 B 0.67040 0.62506 0.53060 1.00000
B25 B 0.67393 0.03060 0.12506 1.00000
B26 B 0.82960 0.96940 0.87494 1.00000
B27 B 0.17393 0.62506 0.53060 1.00000
B28 B 0.32960 0.37494 0.46940 1.00000
