Ac2SmRu2
Alexandria ALEXAlex-ID: agm003406751 · Space group: C2/m (#12)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
AB2C2_1975_spg12
SmRu2 Sm7Ru3 Ac2Ru
2022-02-11 20:23:23.137600
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm003406751).
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 agm003406751
data_agm003406751
_cell_length_a 4.56531
_cell_length_b 6.59458
_cell_length_c 10.04916
_cell_angle_alpha 79.91787
_cell_angle_beta 76.87075
_cell_angle_gamma 69.74854
_cell_volume 274.87655
_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 0.32198 0.26513 0.09090 1.00000
Ac2 Ac 0.47400 0.35900 0.69299 1.00000
Ac3 Ac 0.67802 0.73487 0.90910 1.00000
Ac4 Ac 0.52600 0.64100 0.30701 1.00000
Sm1 Sm 0.79012 0.04924 0.37052 1.00000
Sm2 Sm 0.20988 0.95076 0.62948 1.00000
Ru1 Ru 0.96461 0.16288 0.90790 1.00000
Ru2 Ru 0.12484 0.32924 0.42108 1.00000
Ru3 Ru 0.03539 0.83712 0.09210 1.00000
Ru4 Ru 0.87516 0.67076 0.57892 1.00000
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