Pm4Nd2Sn3O2
Alexandria ALEXAlex-ID: agm004489350 · Space group: I4/mmm (#139)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
A2B2C3D4_39_spg139
Pm5Sn3O Nd5Sn3O Pm2(NdSn)3 Pm2O3
2022-06-18 05:57:59.582991
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm004489350).
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 agm004489350
data_agm004489350
_cell_length_a 4.79110
_cell_length_b 4.79110
_cell_length_c 13.38341
_cell_angle_alpha 100.31117
_cell_angle_beta 100.31117
_cell_angle_gamma 90.00000
_cell_volume 297.20594
_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
Pm1 Pm 0.41762 0.91762 0.83524 1.00000
Pm2 Pm 0.91762 0.41762 0.83524 1.00000
Pm3 Pm 0.08238 0.58238 0.16476 1.00000
Pm4 Pm 0.58238 0.08238 0.16476 1.00000
Nd1 Nd 0.30549 0.30549 0.61098 1.00000
Nd2 Nd 0.69451 0.69451 0.38902 1.00000
Sn1 Sn 0.00000 0.00000 0.00000 1.00000
Sn2 Sn 0.17712 0.17712 0.35424 1.00000
Sn3 Sn 0.82288 0.82288 0.64576 1.00000
O1 O 0.40087 0.40087 0.80174 1.00000
O2 O 0.59913 0.59913 0.19826 1.00000
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