Sm(YGe)2
Alexandria ALEXAlex-ID: agm003398705 · Space group: C2/m (#12)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
AB2C2_1019_spg12
Y5Ge3 Sm2Y3Ge4 Sm4Ge3
2022-02-10 16:07:44.267065
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm003398705).
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 agm003398705
data_agm003398705
_cell_length_a 4.47278
_cell_length_b 6.66201
_cell_length_c 9.49381
_cell_angle_alpha 77.56256
_cell_angle_beta 76.37520
_cell_angle_gamma 70.38534
_cell_volume 256.09261
_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 0.78657 0.08103 0.34583 1.00000
Sm2 Sm 0.21343 0.91897 0.65417 1.00000
Y1 Y 0.30998 0.29595 0.08409 1.00000
Y2 Y 0.48452 0.34751 0.68344 1.00000
Y3 Y 0.69002 0.70405 0.91591 1.00000
Y4 Y 0.51548 0.65249 0.31656 1.00000
Ge1 Ge 0.95695 0.18627 0.89982 1.00000
Ge2 Ge 0.11790 0.32861 0.43559 1.00000
Ge3 Ge 0.04305 0.81373 0.10018 1.00000
Ge4 Ge 0.88210 0.67139 0.56441 1.00000
Get direct link