Ac(SmI4)2
Alexandria ALEXAlex-ID: agm003523932 · Space group: C2/m (#12)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
AB2C8_227_spg12
SmI2 SmI3 AcI3
2022-03-15 11:04:41.155692
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm003523932).
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 agm003523932
data_agm003523932
_cell_length_a 7.68489
_cell_length_b 10.59096
_cell_length_c 10.59096
_cell_angle_alpha 50.89453
_cell_angle_beta 93.91599
_cell_angle_gamma 93.91599
_cell_volume 666.98598
_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 0.00000 0.00000 0.00000 1.00000
Sm1 Sm 0.41418 0.14938 0.14938 1.00000
Sm2 Sm 0.58582 0.85062 0.85062 1.00000
I1 I 0.73258 0.19180 0.67517 1.00000
I2 I 0.26742 0.32483 0.80820 1.00000
I3 I 0.80855 0.15042 0.15042 1.00000
I4 I 0.19145 0.84958 0.84958 1.00000
I5 I 0.73258 0.67517 0.19180 1.00000
I6 I 0.26742 0.80820 0.32483 1.00000
I7 I 0.32393 0.29349 0.29349 1.00000
I8 I 0.67607 0.70651 0.70651 1.00000
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