Nd3(SmBi2)2
Alexandria ALEXAlex-ID: agm003340409 · Space group: C2/m (#12)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
A2B3C4_50_spg8
Nd3SmBi4 Nd3Sm2Bi3 Sm5Bi3
2022-01-29 22:21:22.013506
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm003340409).
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 agm003340409
data_agm003340409
_cell_length_a 4.83073
_cell_length_b 8.11899
_cell_length_c 10.66032
_cell_angle_alpha 130.11549
_cell_angle_beta 90.00000
_cell_angle_gamma 107.30726
_cell_volume 294.55926
_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
Nd1 Nd 0.65382 0.30764 0.72130 1.00000
Nd2 Nd 0.00000 0.00000 0.00000 1.00000
Nd3 Nd 0.34618 0.69236 0.27870 1.00000
Sm1 Sm 0.64972 0.29943 0.33272 1.00000
Sm2 Sm 0.35028 0.70057 0.66728 1.00000
Bi1 Bi 0.65662 0.31323 0.03361 1.00000
Bi2 Bi 0.34338 0.68677 0.96639 1.00000
Bi3 Bi 0.94320 0.88640 0.59568 1.00000
Bi4 Bi 0.05680 0.11360 0.40432 1.00000
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