Tm3MnSbH
Alexandria ALEXAlex-ID: agm007652556 · Space group: P2_1/m (#11)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
ABCD3_920_spg11
Tm3Mn29 Tm6MnSb2 Tm5Sb3 TmH2
2024-03-06 03:12:46.684969
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm007652556).
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 agm007652556
data_agm007652556
_cell_length_a 4.06933
_cell_length_b 8.31202
_cell_length_c 8.23792
_cell_angle_alpha 63.40757
_cell_angle_beta 90.00000
_cell_angle_gamma 90.00000
_cell_volume 249.16547
_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 0.75000 0.32082 0.59903 1.00000
Tm2 Tm 0.25000 0.34128 0.91572 1.00000
Tm3 Tm 0.25000 0.94812 0.71508 1.00000
Tm4 Tm 0.25000 0.67918 0.40097 1.00000
Tm5 Tm 0.75000 0.05188 0.28492 1.00000
Tm6 Tm 0.75000 0.65872 0.08428 1.00000
Mn1 Mn 0.75000 0.03738 0.95206 1.00000
Mn2 Mn 0.25000 0.96262 0.04794 1.00000
Sb1 Sb 0.25000 0.32841 0.30265 1.00000
Sb2 Sb 0.75000 0.67159 0.69735 1.00000
H1 H 0.75000 0.59241 0.37271 1.00000
H2 H 0.25000 0.40759 0.62729 1.00000
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