Ac(SmH4)2
Alexandria ALEXAlex-ID: agm005905018 · Space group: Immm (#71)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
AB2C8_1013_spg71
Sm4H9 SmH3 AcH3
2023-07-10 11:46:41.089101
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm005905018).
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 agm005905018
data_agm005905018
_cell_length_a 3.87152
_cell_length_b 5.49006
_cell_length_c 6.73978
_cell_angle_alpha 114.03447
_cell_angle_beta 106.69124
_cell_angle_gamma 90.00000
_cell_volume 124.19531
_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
Ac1 Ac 0.50000 0.00000 0.00000 1.00000
Sm1 Sm 0.17087 0.67089 0.34174 1.00000
Sm2 Sm 0.82913 0.32911 0.65826 1.00000
H1 H 0.66884 0.89832 0.33769 1.00000
H2 H 0.33115 0.56064 0.66229 1.00000
H3 H 0.15686 0.15679 0.31372 1.00000
H4 H 0.00001 0.29389 0.00001 1.00000
H5 H 0.84314 0.84321 0.68628 1.00000
H6 H 0.66885 0.43936 0.33771 1.00000
H7 H 0.33116 0.10168 0.66231 1.00000
H8 H 0.99999 0.70611 0.99999 1.00000
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