Sm4CdAg7
Alexandria ALEXAlex-ID: agm003665643 · Space group: C2/m (#12)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
AB4C7_88_spg12
SmAg2 SmCdAg
2022-04-08 14:37:12.892920
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm003665643).
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 agm003665643
data_agm003665643
_cell_length_a 5.46503
_cell_length_b 10.32703
_cell_length_c 6.05924
_cell_angle_alpha 84.82410
_cell_angle_beta 63.19427
_cell_angle_gamma 74.65690
_cell_volume 294.17410
_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
Sm1 Sm 0.60562 0.21284 0.57592 1.00000
Sm2 Sm 0.39438 0.78716 0.42408 1.00000
Sm3 Sm 0.79631 0.63641 0.77097 1.00000
Sm4 Sm 0.20369 0.36359 0.22903 1.00000
Cd1 Cd 0.00000 0.00000 0.00000 1.00000
Ag1 Ag 0.79250 0.91196 0.50305 1.00000
Ag2 Ag 0.20750 0.08804 0.49695 1.00000
Ag3 Ag 0.07599 0.68191 0.16612 1.00000
Ag4 Ag 0.92401 0.31809 0.83388 1.00000
Ag5 Ag 0.37231 0.50502 0.75036 1.00000
Ag6 Ag 0.50000 0.00000 0.00000 1.00000
Ag7 Ag 0.62769 0.49498 0.24964 1.00000
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