Tm2AlH6Pt
Alexandria ALEXAlex-ID: agm007613874 · Space group: Cm (#8)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
ABC2D6_1277_spg1
TmH3 AlPt
2025-04-29 22:45:05
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm007613874).
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 agm007613874
data_agm007613874
_cell_length_a 3.61382
_cell_length_b 6.19675
_cell_length_c 5.85407
_cell_angle_alpha 107.12283
_cell_angle_beta 107.96697
_cell_angle_gamma 106.97966
_cell_volume 108.09115
_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 0.46096 0.92975 0.19206 1.00000
Tm2 Tm 0.47543 0.36179 0.78881 1.00000
Al1 Al 0.67297 0.84476 0.70111 1.00000
H1 H 0.14382 0.51692 0.97046 1.00000
H2 H 0.63647 0.30042 0.17511 1.00000
H3 H 0.14847 0.11503 0.38196 1.00000
H4 H 0.77211 0.11211 0.63226 1.00000
H5 H 0.93107 0.03696 0.02557 1.00000
H6 H 0.84031 0.69767 0.18322 1.00000
Pt1 Pt 0.92043 0.59058 0.45047 1.00000
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