Ac6SmY
Alexandria ALEXAlex-ID: agm005759006 · Space group: C2/m (#12)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
ABC6_255_spg139
Sm2Y SmY2 Ac
2023-07-25 08:43:31.529070
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm005759006).
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 agm005759006
data_agm005759006
_cell_length_a 6.36182
_cell_length_b 9.38533
_cell_length_c 9.37666
_cell_angle_alpha 40.30288
_cell_angle_beta 70.16961
_cell_angle_gamma 70.18867
_cell_volume 337.68612
_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 0.24931 0.79346 0.70793 1.00000
Ac2 Ac 0.38179 0.14886 0.08757 1.00000
Ac3 Ac 0.88158 0.58705 0.64980 1.00000
Ac4 Ac 0.61821 0.85114 0.91243 1.00000
Ac5 Ac 0.75069 0.20654 0.29207 1.00000
Ac6 Ac 0.11842 0.41295 0.35020 1.00000
Sm1 Sm 0.50000 0.50000 0.50000 1.00000
Y1 Y 0.00000 0.00000 0.00000 1.00000
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