TbMn3V5
Alexandria ALEXAlex-ID: agm012840897 · Space group: P-1 (#2)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
AB3C5_1034_spg2
Mn2V3 MnV2 Tb
2024-07-14 10:20:21.911949
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm012840897).
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 agm012840897
data_agm012840897
_cell_length_a 5.30141
_cell_length_b 6.56696
_cell_length_c 8.42393
_cell_angle_alpha 84.97634
_cell_angle_beta 77.32104
_cell_angle_gamma 68.29843
_cell_volume 265.83396
_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 0.98419 0.71134 0.31136 1.00000
Tb2 Tb 0.01581 0.28866 0.68864 1.00000
Mn1 Mn 0.61388 0.55595 0.22031 1.00000
Mn2 Mn 0.68560 0.07715 0.55973 1.00000
Mn3 Mn 0.00000 0.00000 0.00000 1.00000
Mn4 Mn 0.50000 0.50000 0.50000 1.00000
Mn5 Mn 0.38612 0.44405 0.77969 1.00000
Mn6 Mn 0.31440 0.92285 0.44027 1.00000
V1 V 0.56410 0.04716 0.85069 1.00000
V2 V 0.63786 0.30861 0.04388 1.00000
V3 V 0.86421 0.68209 0.95007 1.00000
V4 V 0.57259 0.76407 0.65016 1.00000
V5 V 0.42741 0.23593 0.34984 1.00000
V6 V 0.13579 0.31791 0.04993 1.00000
V7 V 0.06091 0.78873 0.67210 1.00000
V8 V 0.36214 0.69139 0.95612 1.00000
V9 V 0.43590 0.95284 0.14931 1.00000
V10 V 0.93909 0.21127 0.32790 1.00000
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